<?xml version="1.0" encoding="UTF-8"?>
<module xmlns="http://www.xml-cml.org/schema"
        xmlns:a="http://www.iochem-bd.org/dictionary/adf/"
        xmlns:cc="http://www.xml-cml.org/dictionary/compchem/"
        xmlns:cml="http://www.xml-cml.org/schema"
        xmlns:cmlx="http://www.xml-cml.org/schema/cmlx"
        xmlns:convention="http://www.xml-cml.org/convention/"
        xmlns:nonsi="http://www.xml-cml.org/unit/nonSi/"
        xmlns:nonsi2="http://www.iochem-bd.org/unit/nonSi2/"
        xmlns:si="http://www.xml-cml.org/unit/si/"
        xmlns:xi="http://www.w3.org/2001/XInclude"
        xmlns:xsd="http://www.w3.org/2001/XMLSchema"
        convention="convention:compchem"
        id="adf.log">
   <module dictRef="cc:jobList" id="jobList1">
      <module cmlx:templateRef="job" dictRef="cc:job" id="job">
         <module dictRef="cc:environment" id="environment">
            <parameterList>
               <parameter dictRef="cc:program">
                  <scalar dataType="xsd:string">AMS</scalar>
               </parameter>
               <parameter dictRef="cc:programVersion">
                  <scalar dataType="xsd:string">2021.101</scalar>
               </parameter>
               <parameter dictRef="cc:programSubversion">
                  <scalar dataType="xsd:string">r94406</scalar>
               </parameter>
               <parameter dictRef="cc:compileDate">
                  <scalar dataType="xsd:string">2021-05-14</scalar>
               </parameter>
               <parameter dictRef="cc:runDate">
                  <scalar dataType="xsd:date">2025-02-17T12:16:12.000</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList>
               <parameter dictRef="cc:runtype">
                  <scalar dataType="xsd:string">GEOMETRY OPTIMIZATION</scalar>
               </parameter>
               <parameter dictRef="cc:method">
                  <scalar dataType="xsd:string" id="method">DFT</scalar>
               </parameter>
               <parameter dictRef="cc:functional">
                  <scalar dataType="xsd:string">PBEc PBEx</scalar>
               </parameter>
               <parameter dictRef="cc:functional">
                  <scalar dataType="xsd:string">PBEc PBEx</scalar>
               </parameter>
            </parameterList>
            <molecule id="geometry">
               <atomArray>
                  <atom elementType="W"
                        id="a1"
                        x3="1.128277"
                        y3="8.194000"
                        z3="8.313215"/>
                  <atom elementType="W"
                        id="a2"
                        x3="2.965474"
                        y3="6.330137"
                        z3="10.996227"/>
                  <atom elementType="W"
                        id="a3"
                        x3="-0.617915"
                        y3="6.450770"
                        z3="5.857670"/>
                  <atom elementType="W"
                        id="a4"
                        x3="2.944409"
                        y3="6.453793"
                        z3="5.910610"/>
                  <atom elementType="W"
                        id="a5"
                        x3="-0.833735"
                        y3="6.319124"
                        z3="10.891587"/>
                  <atom elementType="O"
                        id="a6"
                        x3="-15.928254"
                        y3="4.596124"
                        z3="8.459348"/>
                  <atom elementType="O"
                        id="a7"
                        x3="6.782266"
                        y3="4.596124"
                        z3="8.459348"/>
                  <atom elementType="Tc"
                        id="a8"
                        x3="4.708333"
                        y3="4.596697"
                        z3="8.615390"/>
                  <atom elementType="O"
                        id="a9"
                        x3="-8.989330"
                        y3="4.597867"
                        z3="9.296004"/>
                  <atom elementType="Tc"
                        id="a10"
                        x3="-2.598122"
                        y3="4.596350"
                        z3="8.457196"/>
                  <atom elementType="O"
                        id="a11"
                        x3="-8.958146"
                        y3="8.045910"
                        z3="6.892381"/>
                  <atom elementType="P"
                        id="a12"
                        x3="1.137516"
                        y3="4.596527"
                        z3="8.434854"/>
                  <atom elementType="O"
                        id="a13"
                        x3="1.057577"
                        y3="6.223354"
                        z3="11.366836"/>
                  <atom elementType="O"
                        id="a14"
                        x3="-1.046095"
                        y3="4.600242"
                        z3="11.780993"/>
                  <atom elementType="O"
                        id="a15"
                        x3="1.184497"
                        y3="6.689154"
                        z3="5.090962"/>
                  <atom elementType="O"
                        id="a16"
                        x3="3.133906"
                        y3="4.600610"
                        z3="11.876302"/>
                  <atom elementType="O"
                        id="a17"
                        x3="-0.189543"
                        y3="8.048297"
                        z3="6.900970"/>
                  <atom elementType="O"
                        id="a18"
                        x3="-0.461618"
                        y3="4.592841"
                        z3="5.344338"/>
                  <atom elementType="O"
                        id="a19"
                        x3="-1.563600"
                        y3="7.124679"
                        z3="4.566675"/>
                  <atom elementType="O"
                        id="a20"
                        x3="2.415439"
                        y3="7.578232"
                        z3="9.608985"/>
                  <atom elementType="O"
                        id="a21"
                        x3="2.493865"
                        y3="8.052387"
                        z3="6.953020"/>
                  <atom elementType="O"
                        id="a22"
                        x3="-0.223298"
                        y3="7.570284"
                        z3="9.539973"/>
                  <atom elementType="O"
                        id="a23"
                        x3="-1.949043"
                        y3="5.948475"
                        z3="7.086393"/>
                  <atom elementType="O"
                        id="a24"
                        x3="4.586346"
                        y3="5.983560"
                        z3="10.067684"/>
                  <atom elementType="O"
                        id="a25"
                        x3="2.829201"
                        y3="4.592801"
                        z3="5.393277"/>
                  <atom elementType="O"
                        id="a26"
                        x3="-0.160802"
                        y3="4.597397"
                        z3="9.300782"/>
                  <atom elementType="O"
                        id="a27"
                        x3="-4.577769"
                        y3="4.595743"
                        z3="8.052046"/>
                  <atom elementType="O"
                        id="a28"
                        x3="2.450995"
                        y3="4.597567"
                        z3="9.306508"/>
                  <atom elementType="O"
                        id="a29"
                        x3="-2.421237"
                        y3="5.967585"
                        z3="9.899846"/>
                  <atom elementType="O"
                        id="a30"
                        x3="3.946639"
                        y3="7.132893"
                        z3="4.664739"/>
                  <atom elementType="O"
                        id="a31"
                        x3="4.228452"
                        y3="5.950485"
                        z3="7.201443"/>
                  <atom elementType="O"
                        id="a32"
                        x3="3.514566"
                        y3="7.401311"
                        z3="12.246949"/>
                  <atom elementType="O"
                        id="a33"
                        x3="-2.421110"
                        y3="3.228123"
                        z3="9.902772"/>
                  <atom elementType="O"
                        id="a34"
                        x3="1.146683"
                        y3="5.870320"
                        z3="7.544411"/>
                  <atom elementType="O"
                        id="a35"
                        x3="1.118779"
                        y3="9.903718"
                        z3="8.599900"/>
                  <atom elementType="O"
                        id="a36"
                        x3="-7.581676"
                        y3="7.119926"
                        z3="4.560372"/>
                  <atom elementType="O"
                        id="a37"
                        x3="-1.440029"
                        y3="7.393763"
                        z3="12.113066"/>
                  <atom elementType="O"
                        id="a38"
                        x3="-7.710905"
                        y3="1.810255"
                        z3="12.117769"/>
                  <atom elementType="O"
                        id="a39"
                        x3="-7.198085"
                        y3="5.946873"
                        z3="7.081991"/>
                  <atom elementType="O"
                        id="a40"
                        x3="1.146684"
                        y3="3.320832"
                        z3="7.547546"/>
                  <atom elementType="O"
                        id="a41"
                        x3="-11.563310"
                        y3="7.579885"
                        z3="9.600791"/>
                  <atom elementType="O"
                        id="a42"
                        x3="4.228335"
                        y3="3.239532"
                        z3="7.204754"/>
                  <atom elementType="O"
                        id="a43"
                        x3="-7.710778"
                        y3="7.397235"
                        z3="12.105984"/>
                  <atom elementType="O"
                        id="a44"
                        x3="-13.375529"
                        y3="5.947566"
                        z3="7.191366"/>
                  <atom elementType="O"
                        id="a45"
                        x3="-6.728048"
                        y3="5.968533"
                        z3="9.895072"/>
                  <atom elementType="O"
                        id="a46"
                        x3="-10.266764"
                        y3="-0.710871"
                        z3="8.610900"/>
                  <atom elementType="O"
                        id="a47"
                        x3="-13.733953"
                        y3="5.986180"
                        z3="10.057208"/>
                  <atom elementType="O"
                        id="a48"
                        x3="1.057606"
                        y3="2.976384"
                        z3="11.370171"/>
                  <atom elementType="O"
                        id="a49"
                        x3="1.184454"
                        y3="2.496070"
                        z3="5.096215"/>
                  <atom elementType="O"
                        id="a50"
                        x3="-0.189824"
                        y3="1.141282"
                        z3="6.909052"/>
                  <atom elementType="O"
                        id="a51"
                        x3="-10.266482"
                        y3="9.903876"
                        z3="8.589226"/>
                  <atom elementType="O"
                        id="a52"
                        x3="-1.563481"
                        y3="2.059468"
                        z3="4.572335"/>
                  <atom elementType="O"
                        id="a53"
                        x3="2.415485"
                        y3="1.617504"
                        z3="9.616073"/>
                  <atom elementType="O"
                        id="a54"
                        x3="2.493919"
                        y3="1.137005"
                        z3="6.961341"/>
                  <atom elementType="O"
                        id="a55"
                        x3="-0.223527"
                        y3="1.625160"
                        z3="9.546934"/>
                  <atom elementType="O"
                        id="a56"
                        x3="3.946631"
                        y3="2.050936"
                        z3="4.670986"/>
                  <atom elementType="O"
                        id="a57"
                        x3="3.514242"
                        y3="1.800838"
                        z3="12.253519"/>
                  <atom elementType="O"
                        id="a58"
                        x3="1.118527"
                        y3="-0.710416"
                        z3="8.612471"/>
                  <atom elementType="O"
                        id="a59"
                        x3="-1.439922"
                        y3="1.807368"
                        z3="12.119505"/>
                  <atom elementType="W"
                        id="a60"
                        x3="-10.276464"
                        y3="8.193432"
                        z3="8.305116"/>
                  <atom elementType="W"
                        id="a61"
                        x3="-8.317046"
                        y3="6.321096"
                        z3="10.885735"/>
                  <atom elementType="Tc"
                        id="a62"
                        x3="-13.854785"
                        y3="4.596320"
                        z3="8.603011"/>
                  <atom elementType="W"
                        id="a63"
                        x3="-12.089573"
                        y3="6.451188"
                        z3="5.901118"/>
                  <atom elementType="W"
                        id="a64"
                        x3="-8.527756"
                        y3="6.447830"
                        z3="5.852073"/>
                  <atom elementType="O"
                        id="a65"
                        x3="-10.295907"
                        y3="3.319414"
                        z3="7.543298"/>
                  <atom elementType="O"
                        id="a66"
                        x3="-12.284164"
                        y3="4.603040"
                        z3="11.870232"/>
                  <atom elementType="W"
                        id="a67"
                        x3="-12.116977"
                        y3="6.331778"
                        z3="10.987962"/>
                  <atom elementType="O"
                        id="a68"
                        x3="-10.330782"
                        y3="6.685362"
                        z3="5.082833"/>
                  <atom elementType="W"
                        id="a69"
                        x3="-10.276664"
                        y3="0.998106"
                        z3="8.319673"/>
                  <atom elementType="W"
                        id="a70"
                        x3="-8.317135"
                        y3="2.881415"
                        z3="10.892793"/>
                  <atom elementType="W"
                        id="a71"
                        x3="-12.089679"
                        y3="2.730132"
                        z3="5.908851"/>
                  <atom elementType="W"
                        id="a72"
                        x3="1.128146"
                        y3="0.998676"
                        z3="8.321718"/>
                  <atom elementType="W"
                        id="a73"
                        x3="2.965476"
                        y3="2.868906"
                        z3="11.000246"/>
                  <atom elementType="W"
                        id="a74"
                        x3="-0.617972"
                        y3="2.736245"
                        z3="5.862143"/>
                  <atom elementType="W"
                        id="a75"
                        x3="2.944405"
                        y3="2.733127"
                        z3="5.915228"/>
                  <atom elementType="W"
                        id="a76"
                        x3="-0.833833"
                        y3="2.879373"
                        z3="10.895548"/>
                  <atom elementType="W"
                        id="a77"
                        x3="-8.527931"
                        y3="2.733381"
                        z3="5.859816"/>
                  <atom elementType="W"
                        id="a78"
                        x3="-12.117184"
                        y3="2.870727"
                        z3="10.994920"/>
                  <atom elementType="O"
                        id="a79"
                        x3="-10.207482"
                        y3="2.978100"
                        z3="11.365602"/>
                  <atom elementType="O"
                        id="a80"
                        x3="-10.330806"
                        y3="2.492460"
                        z3="5.091509"/>
                  <atom elementType="O"
                        id="a81"
                        x3="-11.641853"
                        y3="1.135655"
                        z3="6.957797"/>
                  <atom elementType="O"
                        id="a82"
                        x3="-13.091700"
                        y3="2.046829"
                        z3="4.664865"/>
                  <atom elementType="O"
                        id="a83"
                        x3="-8.958314"
                        y3="1.139586"
                        z3="6.906668"/>
                  <atom elementType="O"
                        id="a84"
                        x3="-11.563554"
                        y3="1.616741"
                        z3="9.612674"/>
                  <atom elementType="O"
                        id="a85"
                        x3="-13.375546"
                        y3="3.239403"
                        z3="7.197232"/>
                  <atom elementType="Tc"
                        id="a86"
                        x3="-6.548574"
                        y3="4.596145"
                        z3="8.455209"/>
                  <atom elementType="O"
                        id="a87"
                        x3="-6.728056"
                        y3="3.229756"
                        z3="9.900951"/>
                  <atom elementType="O"
                        id="a88"
                        x3="-13.734130"
                        y3="3.212558"
                        z3="10.063008"/>
                  <atom elementType="O"
                        id="a89"
                        x3="-12.665788"
                        y3="1.803763"
                        z3="12.249706"/>
                  <atom elementType="O"
                        id="a90"
                        x3="-8.103808"
                        y3="4.603062"
                        z3="11.776481"/>
                  <atom elementType="O"
                        id="a91"
                        x3="-11.975547"
                        y3="4.589615"
                        z3="5.385780"/>
                  <atom elementType="O"
                        id="a92"
                        x3="-8.924669"
                        y3="1.625438"
                        z3="9.543872"/>
                  <atom elementType="O"
                        id="a93"
                        x3="-13.091598"
                        y3="7.129555"
                        z3="4.654371"/>
                  <atom elementType="O"
                        id="a94"
                        x3="-12.665540"
                        y3="7.403807"
                        z3="12.238199"/>
                  <atom elementType="O"
                        id="a95"
                        x3="-10.295793"
                        y3="5.868980"
                        z3="7.538138"/>
                  <atom elementType="P"
                        id="a96"
                        x3="-10.287446"
                        y3="4.596135"
                        z3="8.429625"/>
                  <atom elementType="O"
                        id="a97"
                        x3="-10.207289"
                        y3="6.225640"
                        z3="11.359047"/>
                  <atom elementType="O"
                        id="a98"
                        x3="-7.581609"
                        y3="2.056053"
                        z3="4.571098"/>
                  <atom elementType="O"
                        id="a99"
                        x3="-8.685632"
                        y3="4.589600"
                        z3="5.340507"/>
                  <atom elementType="O"
                        id="a100"
                        x3="-8.924510"
                        y3="7.571287"
                        z3="9.531935"/>
                  <atom elementType="O"
                        id="a101"
                        x3="-7.198404"
                        y3="3.239909"
                        z3="7.087775"/>
                  <atom elementType="O"
                        id="a102"
                        x3="-11.601007"
                        y3="4.597978"
                        z3="9.301588"/>
                  <atom elementType="O"
                        id="a103"
                        x3="-1.949106"
                        y3="3.241300"
                        z3="7.089458"/>
                  <atom elementType="O"
                        id="a104"
                        x3="4.586351"
                        y3="3.213279"
                        z3="10.071112"/>
                  <atom elementType="O"
                        id="a105"
                        x3="-11.641647"
                        y3="8.050031"
                        z3="6.943661"/>
                  <atom elementType="H"
                        id="a106"
                        x3="7.092491"
                        y3="4.596387"
                        z3="9.389004"/>
                  <atom elementType="H"
                        id="a107"
                        x3="-16.132517"
                        y3="4.595214"
                        z3="7.500709"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a17 a1" order="S"/>
                  <bond atomRefs2="a20 a1" order="S"/>
                  <bond atomRefs2="a21 a1" order="S"/>
                  <bond atomRefs2="a22 a1" order="S"/>
                  <bond atomRefs2="a34 a1" order="S"/>
                  <bond atomRefs2="a35 a1" order="S"/>
                  <bond atomRefs2="a13 a2" order="S"/>
                  <bond atomRefs2="a16 a2" order="S"/>
                  <bond atomRefs2="a20 a2" order="S"/>
                  <bond atomRefs2="a24 a2" order="S"/>
                  <bond atomRefs2="a32 a2" order="S"/>
                  <bond atomRefs2="a15 a3" order="S"/>
                  <bond atomRefs2="a17 a3" order="S"/>
                  <bond atomRefs2="a18 a3" order="S"/>
                  <bond atomRefs2="a19 a3" order="S"/>
                  <bond atomRefs2="a23 a3" order="S"/>
                  <bond atomRefs2="a15 a4" order="S"/>
                  <bond atomRefs2="a21 a4" order="S"/>
                  <bond atomRefs2="a25 a4" order="S"/>
                  <bond atomRefs2="a30 a4" order="S"/>
                  <bond atomRefs2="a31 a4" order="S"/>
                  <bond atomRefs2="a13 a5" order="S"/>
                  <bond atomRefs2="a14 a5" order="S"/>
                  <bond atomRefs2="a22 a5" order="S"/>
                  <bond atomRefs2="a26 a5" order="S"/>
                  <bond atomRefs2="a29 a5" order="S"/>
                  <bond atomRefs2="a37 a5" order="S"/>
                  <bond atomRefs2="a62 a6" order="S"/>
                  <bond atomRefs2="a107 a6" order="S"/>
                  <bond atomRefs2="a8 a7" order="S"/>
                  <bond atomRefs2="a106 a7" order="S"/>
                  <bond atomRefs2="a24 a8" order="S"/>
                  <bond atomRefs2="a31 a8" order="S"/>
                  <bond atomRefs2="a42 a8" order="S"/>
                  <bond atomRefs2="a104 a8" order="S"/>
                  <bond atomRefs2="a96 a9" order="S"/>
                  <bond atomRefs2="a23 a10" order="S"/>
                  <bond atomRefs2="a27 a10" order="S"/>
                  <bond atomRefs2="a29 a10" order="S"/>
                  <bond atomRefs2="a33 a10" order="S"/>
                  <bond atomRefs2="a103 a10" order="S"/>
                  <bond atomRefs2="a60 a11" order="S"/>
                  <bond atomRefs2="a64 a11" order="S"/>
                  <bond atomRefs2="a26 a12" order="S"/>
                  <bond atomRefs2="a28 a12" order="S"/>
                  <bond atomRefs2="a34 a12" order="S"/>
                  <bond atomRefs2="a40 a12" order="S"/>
                  <bond atomRefs2="a76 a14" order="S"/>
                  <bond atomRefs2="a73 a16" order="S"/>
                  <bond atomRefs2="a74 a18" order="S"/>
                  <bond atomRefs2="a75 a25" order="S"/>
                  <bond atomRefs2="a76 a26" order="S"/>
                  <bond atomRefs2="a86 a27" order="S"/>
                  <bond atomRefs2="a76 a33" order="S"/>
                  <bond atomRefs2="a64 a36" order="S"/>
                  <bond atomRefs2="a70 a38" order="S"/>
                  <bond atomRefs2="a64 a39" order="S"/>
                  <bond atomRefs2="a86 a39" order="S"/>
                  <bond atomRefs2="a72 a40" order="S"/>
                  <bond atomRefs2="a60 a41" order="S"/>
                  <bond atomRefs2="a67 a41" order="S"/>
                  <bond atomRefs2="a75 a42" order="S"/>
                  <bond atomRefs2="a61 a43" order="S"/>
                  <bond atomRefs2="a62 a44" order="S"/>
                  <bond atomRefs2="a63 a44" order="S"/>
                  <bond atomRefs2="a61 a45" order="S"/>
                  <bond atomRefs2="a86 a45" order="S"/>
                  <bond atomRefs2="a69 a46" order="S"/>
                  <bond atomRefs2="a62 a47" order="S"/>
                  <bond atomRefs2="a67 a47" order="S"/>
                  <bond atomRefs2="a73 a48" order="S"/>
                  <bond atomRefs2="a76 a48" order="S"/>
                  <bond atomRefs2="a74 a49" order="S"/>
                  <bond atomRefs2="a75 a49" order="S"/>
                  <bond atomRefs2="a72 a50" order="S"/>
                  <bond atomRefs2="a74 a50" order="S"/>
                  <bond atomRefs2="a60 a51" order="S"/>
                  <bond atomRefs2="a74 a52" order="S"/>
                  <bond atomRefs2="a72 a53" order="S"/>
                  <bond atomRefs2="a73 a53" order="S"/>
                  <bond atomRefs2="a72 a54" order="S"/>
                  <bond atomRefs2="a75 a54" order="S"/>
                  <bond atomRefs2="a72 a55" order="S"/>
                  <bond atomRefs2="a76 a55" order="S"/>
                  <bond atomRefs2="a75 a56" order="S"/>
                  <bond atomRefs2="a73 a57" order="S"/>
                  <bond atomRefs2="a72 a58" order="S"/>
                  <bond atomRefs2="a76 a59" order="S"/>
                  <bond atomRefs2="a95 a60" order="S"/>
                  <bond atomRefs2="a100 a60" order="S"/>
                  <bond atomRefs2="a105 a60" order="S"/>
                  <bond atomRefs2="a90 a61" order="S"/>
                  <bond atomRefs2="a97 a61" order="S"/>
                  <bond atomRefs2="a100 a61" order="S"/>
                  <bond atomRefs2="a85 a62" order="S"/>
                  <bond atomRefs2="a88 a62" order="S"/>
                  <bond atomRefs2="a68 a63" order="S"/>
                  <bond atomRefs2="a91 a63" order="S"/>
                  <bond atomRefs2="a93 a63" order="S"/>
                  <bond atomRefs2="a105 a63" order="S"/>
                  <bond atomRefs2="a68 a64" order="S"/>
                  <bond atomRefs2="a99 a64" order="S"/>
                  <bond atomRefs2="a69 a65" order="S"/>
                  <bond atomRefs2="a96 a65" order="S"/>
                  <bond atomRefs2="a67 a66" order="S"/>
                  <bond atomRefs2="a78 a66" order="S"/>
                  <bond atomRefs2="a94 a67" order="S"/>
                  <bond atomRefs2="a97 a67" order="S"/>
                  <bond atomRefs2="a102 a67" order="S"/>
                  <bond atomRefs2="a81 a69" order="S"/>
                  <bond atomRefs2="a83 a69" order="S"/>
                  <bond atomRefs2="a84 a69" order="S"/>
                  <bond atomRefs2="a92 a69" order="S"/>
                  <bond atomRefs2="a79 a70" order="S"/>
                  <bond atomRefs2="a87 a70" order="S"/>
                  <bond atomRefs2="a90 a70" order="S"/>
                  <bond atomRefs2="a92 a70" order="S"/>
                  <bond atomRefs2="a80 a71" order="S"/>
                  <bond atomRefs2="a81 a71" order="S"/>
                  <bond atomRefs2="a82 a71" order="S"/>
                  <bond atomRefs2="a85 a71" order="S"/>
                  <bond atomRefs2="a91 a71" order="S"/>
                  <bond atomRefs2="a104 a73" order="S"/>
                  <bond atomRefs2="a103 a74" order="S"/>
                  <bond atomRefs2="a80 a77" order="S"/>
                  <bond atomRefs2="a83 a77" order="S"/>
                  <bond atomRefs2="a98 a77" order="S"/>
                  <bond atomRefs2="a99 a77" order="S"/>
                  <bond atomRefs2="a101 a77" order="S"/>
                  <bond atomRefs2="a79 a78" order="S"/>
                  <bond atomRefs2="a84 a78" order="S"/>
                  <bond atomRefs2="a88 a78" order="S"/>
                  <bond atomRefs2="a89 a78" order="S"/>
                  <bond atomRefs2="a102 a78" order="S"/>
                  <bond atomRefs2="a87 a86" order="S"/>
                  <bond atomRefs2="a101 a86" order="S"/>
                  <bond atomRefs2="a96 a95" order="S"/>
                  <bond atomRefs2="a102 a96" order="S"/>
               </bondArray>
               <formula concise="H2O79P2Tc4W20"/>
               <property dictRef="cml:molmass">
                  <scalar units="nonsi:dalton">5398.580018</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1/2O4P.2H2O.69O.4Tc.20W/c2*1-5(2,3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h;;2*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q2*-2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;2*+1;;;;;;;;;;;;;;;;;4*+1/p-2/rH2O79P2Tc4W20/c1-80-25-100(19)58-88(7)34-83(4)35-89(8,47-88)51-91(10)37-84(36-90(9,50-88,52-91)60-100,38-96(15,66-100)55-97(16,39-84)67-101(20,26-80,59-89,61-91)73-103(22,43-83,71-97)76-102(21,42-83,70-96,72-100)78(80)103)29-85-40-92(11)48-86(5)30-82(3)31-87(6,46-86)49-93(12,41-85,53-92)63-99(18,57-87)28-81(2)27-98(17,56-86,62-92)64-94(13,32-82)54-95(14,33-82,65-99)69-105(24,45-85,75-99)77-104(23,44-85,68-94,74-98)79(81)105/h3-4H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:9,65,95,102,96;26,28,34,40,12;6;7;11;13;14;15;16;17;18;19;20;21;22;23;24;25;27;29;30;31;32;33;35;36;37;38;39;41;42;43;44;45;46;47;48;49;50;51;52;53;54;55;56;57;58;59;66;68;79;80;81;82;83;84;85;87;88;89;90;91;92;93;94;97;98;99;100;101;103;104;105;10;86;8;62;2;3;4;5;61;63;64;67;70;71;73;74;75;76;77;78;1;60;69;72/E:2*(1,2,3,4);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/CRV:1.1,2-1,3-1,4.1,5.4;1.1,2.1,3-1,4-1,5.4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rA:107nWWWWWOOTcO1TcOP4OOOOOOO1OOOOOOO3OO1OO1OO1OOO1O1O1O1OOOOO1OOO1OOOOO1O1OOOO1O1O1O1WWTcWWOOWOWWWWWWWWWWOOOO1OOOTcOOO1OOOO1O1OP4OO1OOOO3OOOHH/rB:;;;;;;s7;;;;;s2s5;s5;s3s4;s2;s1s3;s3;s3;s1s2;s1s4;s1s5;s3s10;s2s8;s4;s5s12;s10;s12;s5s10;s4;s4s8;s2;s10;s1s12;s1;;s5;;;s12;;s8;;;;;;;;;;;;;;;;;;s11s41s51;s43s45;s6s44s47;s44;s11s36s39;;;s41s47s66;s63s64;s46s65;s38;;s40s50s53s54s55s58;s16s48s53s57;s18s49s50s52;s25s42s49s54s56;s14s26s33s48s55s59;;s66;s70s78;s71s77;s69s71;s71;s69s77;s69s78;s62s71;s27s39s45;s70s86;s62s78;s78;s61s70;s63s71;s69s70;s63;s67;s60;s9s65s95;s61s67;s77;s64s77;s60s61;s77s86;s67s78s96;s10s74;s8s73;s60s63;s7;s6;/rC:1.1283,8.194,8.3132;2.9655,6.3301,10.9962;-.6179,6.4508,5.8577;2.9444,6.4538,5.9106;-.8337,6.3191,10.8916;-15.9283,4.5961,8.4593;6.7823,4.5961,8.4593;4.7083,4.5967,8.6154;-8.9893,4.5979,9.296;-2.5981,4.5964,8.4572;-8.9581,8.0459,6.8924;1.1375,4.5965,8.4349;1.0576,6.2234,11.3668;-1.0461,4.6002,11.781;1.1845,6.6892,5.091;3.1339,4.6006,11.8763;-.1895,8.0483,6.901;-.4616,4.5928,5.3443;-1.5636,7.1247,4.5667;2.4154,7.5782,9.609;2.4939,8.0524,6.953;-.2233,7.5703,9.54;-1.949,5.9485,7.0864;4.5863,5.9836,10.0677;2.8292,4.5928,5.3933;-.1608,4.5974,9.3008;-4.5778,4.5957,8.052;2.451,4.5976,9.3065;-2.4212,5.9676,9.8998;3.9466,7.1329,4.6647;4.2285,5.9505,7.2014;3.5146,7.4013,12.2469;-2.4211,3.2281,9.9028;1.1467,5.8703,7.5444;1.1188,9.9037,8.5999;-7.5817,7.1199,4.5604;-1.44,7.3938,12.1131;-7.7109,1.8103,12.1178;-7.1981,5.9469,7.082;1.1467,3.3208,7.5475;-11.5633,7.5799,9.6008;4.2283,3.2395,7.2048;-7.7108,7.3972,12.106;-13.3755,5.9476,7.1914;-6.728,5.9685,9.8951;-10.2668,-.7109,8.6109;-13.734,5.9862,10.0572;1.0576,2.9764,11.3702;1.1845,2.4961,5.0962;-.1898,1.1413,6.9091;-10.2665,9.9039,8.5892;-1.5635,2.0595,4.5723;2.4155,1.6175,9.6161;2.4939,1.137,6.9613;-.2235,1.6252,9.5469;3.9466,2.0509,4.671;3.5142,1.8008,12.2535;1.1185,-.7104,8.6125;-1.4399,1.8074,12.1195;-10.2765,8.1934,8.3051;-8.317,6.3211,10.8857;-13.8548,4.5963,8.603;-12.0896,6.4512,5.9011;-8.5278,6.4478,5.8521;-10.2959,3.3194,7.5433;-12.2842,4.603,11.8702;-12.117,6.3318,10.988;-10.3308,6.6854,5.0828;-10.2767,.9981,8.3197;-8.3171,2.8814,10.8928;-12.0897,2.7301,5.9089;1.1281,.9987,8.3217;2.9655,2.8689,11.0002;-.618,2.7362,5.8621;2.9444,2.7331,5.9152;-.8338,2.8794,10.8955;-8.5279,2.7334,5.8598;-12.1172,2.8707,10.9949;-10.2075,2.9781,11.3656;-10.3308,2.4925,5.0915;-11.6419,1.1357,6.9578;-13.0917,2.0468,4.6649;-8.9583,1.1396,6.9067;-11.5636,1.6167,9.6127;-13.3755,3.2394,7.1972;-6.5486,4.5961,8.4552;-6.7281,3.2298,9.901;-13.7341,3.2126,10.063;-12.6658,1.8038,12.2497;-8.1038,4.6031,11.7765;-11.9755,4.5896,5.3858;-8.9247,1.6254,9.5439;-13.0916,7.1296,4.6544;-12.6655,7.4038,12.2382;-10.2958,5.869,7.5381;-10.2874,4.5961,8.4296;-10.2073,6.2256,11.359;-7.5816,2.0561,4.5711;-8.6856,4.5896,5.3405;-8.9245,7.5713,9.5319;-7.1984,3.2399,7.0878;-11.601,4.598,9.3016;-1.9491,3.2413,7.0895;4.5864,3.2133,10.0711;-11.6416,8.05,6.9437;7.0925,4.5964,9.389;-16.1325,4.5952,7.5007;/R:/0/N:9,28,7,6,30,56,82,93,98,36,19,52,32,57,38,43,35,58,46,51,89,94,37,59,65,95,34,40,27,31,42,24,104,85,44,101,39,87,45,23,103,88,47,29,33,25,91,15,49,80,68,99,18,16,90,21,54,81,105,83,11,17,50,20,53,92,100,13,48,79,97,84,41,22,55,66,14,102,26,96,12,8,62,86,10,4,75,71,63,77,64,3,74,2,73,70,61,1,72,69,60,78,67,5,76/E:(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20)(21,22)(23,24)(25,26)(27,28)(30,31)(32,33)(34,35)(36,37)(38,39)(40,41)(42,43)(44,45)(48,49)(50,51)(56,57)(58,59)(60,61)(62,63)(64,65)(66,67)(68,69)(70,71)(72,73)(74,75)(86,87)(88,89)(90,91)(92,93)(94,95)(96,97)(98,99)(100,101)(102,103)(104,105)/CRV:1.1,2.1,5.1,6.1,7.1,8.1,9.1,10.1,11.1,12.1,13.1,14.1,15.1,16.1,17.1,18.1,19.1,20.1,21.1,22.1,23.1,24.1,78.3,79.3,80.4,81.4,82.5,83.5,84.5,85.5</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="parameters2">
                  <list cmlx:templateRef="scf"/>
                  <list cmlx:templateRef="spin">
                     <scalar dataType="xsd:string" dictRef="cc:spinMolecule">Unrestricted</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:spinFragments">Restricted</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="solvation" dictRef="cc:userDefinedModule">
                  <list id="cosmo">
                     <scalar dataType="xsd:double" dictRef="a:gdsf">0.00000</scalar>
                     <scalar dataType="xsd:double" dictRef="a:ccnv">1.0E-08</scalar>
                     <scalar dataType="xsd:double" dictRef="a:ncix">1000</scalar>
                     <scalar dataType="xsd:string" dictRef="a:cosmomethod">conjugate-gradient</scalar>
                     <scalar dataType="xsd:double" dictRef="a:epsl">78.39000</scalar>
                     <scalar dataType="xsd:double" dictRef="a:rsol" units="nonsi:angstrom">1.93000</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:nfdiv">1</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:ndiv">3</scalar>
                     <scalar dataType="xsd:double" dictRef="a:cosmoArea">3489.22018078</scalar>
                     <scalar dataType="xsd:double" dictRef="a:cosmoVolume">10163.32232736</scalar>
                     <scalar dataType="xsd:double" dictRef="a:solvent" units="nonsi:angstrom">Water</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="parameters">
                  <scalar dictRef="cc:method" id="method">DFT</scalar>
                  <list cmlx:templateRef="scf" endLine="9202" startLine="9200">
                     <scalar dataType="xsd:string" dictRef="cc:functional">PW92                                    == Not Default ==</scalar>
                  </list>
                  <list cmlx:templateRef="spin" endLine="9206" startLine="9204">
                     <scalar dataType="xsd:string" dictRef="cc:spinMolecule">UNrestricted</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:spinFragments">Restricted</scalar>
                  </list>
                  <list cmlx:templateRef="other" endLine="9215" startLine="9208">
                     <scalar dataType="xsd:string" dictRef="a:densityMode">Point Charge Nuclei</scalar>
                     <scalar dataType="xsd:string" dictRef="a:coretreat">Frozen Orbital(s)</scalar>
                  </list>
               </module>
            </module>
            <module cmlx:templateRef="input.file" dictRef="cc:inputFile">
               <scalar dataType="xsd:string" dictRef="cc:inputLine">Task GeometryOptimization</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">System</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    Atoms</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W 1.074898 8.0702 8.480200999999999 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W 2.94259 6.290958 11.15239 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -0.682926 6.435459 6.047651 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W 2.833338 6.436195 6.056411 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -0.859306 6.293899 11.109843 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -15.92817 4.5961 8.459303 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 6.78223 4.5961 8.459303 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        Tc 4.631121 4.5961 8.708327000000001 adf.R=1.967</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -9.065799 4.5961 9.535487 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        Tc -2.516913 4.5961 8.67454 adf.R=1.967</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -8.969428000000001 8.024791 7.082789 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        P 1.038382 4.5961 8.662025999999999 adf.R=2.13</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 1.104422 6.186351 11.450092 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -1.145399 4.5961 11.988184 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 1.060831 6.699275 5.190709 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 3.227543 4.5961 12.025726 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -0.250667 8.022952 7.090298 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -0.519947 4.5961 5.568624 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -1.687058 7.123955 4.84658 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 2.356467 7.44752 9.740713 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 2.385772 8.024791 7.082789 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -0.221034 7.443844 9.673138 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -1.890334 6.008022 7.341824 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 4.539827 6.017214 10.198716 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 2.678831 4.5961 5.581138 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -0.197388 4.5961 9.535487 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -4.57297 4.5961 8.459303 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 2.289401 4.5961 9.535487 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -2.472009 6.035599 10.198716 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 3.827841 7.107409 4.860345 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 4.041118 5.932646 7.385622 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 3.412088 7.432813 12.354837 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -2.472009 3.156601 10.198716 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 1.0778 5.844401 7.732254 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 1.085174 9.743732 8.824705 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -7.527359 7.107409 4.860345 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -1.325695 7.397883 12.318548 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -7.943112 1.759387 12.354837 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -7.314082 5.932646 7.385622 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 1.0778 3.347799 7.732254 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -11.576234 7.443844 9.673138 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 4.041118 3.259554 7.385622 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -7.943112 7.432813 12.354837 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -13.245534 6.008022 7.341824 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -6.815373 6.017214 10.198716 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -10.270026 -0.551532 8.824705 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -13.827209 6.035599 10.198716 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 1.104422 3.005849 11.450092 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 1.060831 2.492925 5.190709 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -0.250667 1.169248 7.090298 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -10.270026 9.743732 8.824705 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -1.687058 2.068245 4.84658 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 2.356467 1.74468 9.740713 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 2.385772 1.167409 7.082789 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -0.221034 1.748356 9.673138 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 3.827841 2.084791 4.860345 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 3.412088 1.759387 12.354837 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 1.085174 -0.551532 8.824705 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -1.325695 1.794317 12.318548 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -10.280302 8.0702 8.480200999999999 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -8.412610000000001 6.290958 11.15239 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        Tc -13.872113 4.5961 8.67454 adf.R=1.967</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -12.038126 6.435459 6.047651 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -8.521862 6.436195 6.056411 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -10.2774 3.347799 7.732254 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -12.500599 4.5961 11.988184 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -12.214506 6.293899 11.109843 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -10.294369 6.699275 5.190709 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -10.280302 1.122 8.480200999999999 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -8.412610000000001 2.901242 11.15239 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -12.038126 2.756741 6.047651 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W 1.074898 1.122 8.480200999999999 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W 2.94259 2.901242 11.15239 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -0.682926 2.756741 6.047651 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W 2.833338 2.756005 6.056411 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -0.859306 2.898301 11.109843 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -8.521862 2.756005 6.056411 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        W -12.214506 2.898301 11.109843 adf.R=1.992</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -10.250778 3.005849 11.450092 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -10.294369 2.492925 5.190709 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -11.605867 1.169248 7.090298 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -13.042258 2.068245 4.84658 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -8.969428000000001 1.167409 7.082789 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -11.576234 1.748356 9.673138 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -13.245534 3.184178 7.341824 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        Tc -6.724079 4.5961 8.708327000000001 adf.R=1.967</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -6.815373 3.174986 10.198716 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -13.827209 3.156601 10.198716 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -12.680895 1.794317 12.318548 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -8.127656999999999 4.5961 12.025726 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -11.875147 4.5961 5.568624 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -8.998733 1.74468 9.740713 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -13.042258 7.123955 4.84658 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -12.680895 7.397883 12.318548 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -10.2774 5.844401 7.732254 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        P -10.316818 4.5961 8.662025999999999 adf.R=2.13</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -10.250778 6.186351 11.450092 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -7.527359 2.084791 4.860345 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -8.676368999999999 4.5961 5.581138 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -8.998733 7.44752 9.740713 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -7.314082 3.259554 7.385622 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -11.552588 4.5961 9.535487 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -1.890334 3.184178 7.341824 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O 4.539827 3.174986 10.198716 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        O -11.605867 8.022952 7.090298 adf.R=1.72</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        H 7.2041908110314 4.5961 9.321595916562419 adf.R=1.30</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        H -16.15219635144274 4.5961 7.525808386271964 adf.R=1.30</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    End</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    Charge -10</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    BondOrders</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         1 17 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         1 20 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         1 21 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         1 22 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         1 34 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         1 35 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         2 13 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         2 16 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         2 20 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         2 24 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         2 32 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         3 15 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         3 17 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         3 18 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         3 19 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         3 23 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         4 15 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         4 21 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         4 25 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         4 30 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         4 31 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         5 13 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         5 14 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         5 22 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         5 26 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         5 29 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         5 37 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         8 7 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         8 24 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         8 31 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         8 42 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         8 104 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         9 96 2.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         10 23 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         10 27 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         10 29 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         10 33 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         10 103 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         12 26 2.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         12 28 2.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         12 34 2.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         12 40 2.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         60 11 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         60 41 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         60 51 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         60 95 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         60 100 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         60 105 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         61 43 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         61 45 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         61 90 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         61 97 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         61 100 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         62 6 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         62 44 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         62 47 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         62 85 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         62 88 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         63 44 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         63 68 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         63 91 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         63 93 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         63 105 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         64 11 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         64 36 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         64 39 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         64 68 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         64 99 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         65 96 2.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         67 41 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         67 47 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         67 66 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         67 94 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         67 97 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         67 102 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         69 46 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         69 65 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         69 81 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         69 83 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         69 84 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         69 92 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         70 38 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         70 79 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         70 87 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         70 90 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         70 92 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         71 80 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         71 81 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         71 82 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         71 85 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         71 91 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         72 40 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         72 50 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         72 53 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         72 54 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         72 55 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         72 58 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         73 16 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         73 48 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         73 53 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         73 57 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         73 104 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         74 18 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         74 49 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         74 50 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         74 52 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         74 103 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         75 25 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         75 42 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         75 49 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         75 54 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         75 56 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         76 14 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         76 26 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         76 33 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         76 48 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         76 55 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         76 59 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         77 80 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         77 83 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         77 98 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         77 99 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         77 101 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         78 66 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         78 79 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         78 84 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         78 88 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         78 89 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         78 102 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         86 27 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         86 39 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         86 45 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         86 87 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         86 101 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         95 96 2.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         96 102 2.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         106 7 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">         107 6 1.0</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    End</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">End</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">Constraints</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    Atom 6</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    Atom 7</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">End</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">Engine ADF</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    Basis</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        Type TZP</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        Core Small</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    End</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    SpinPolarization 12</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    XC</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        GGA PBE</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    End</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    Unrestricted Yes</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    Solvation</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        Surf Delley</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        Solv name=Water cav0=0.0 cav1=0.0067639</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        Charged method=CONJ</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        C-Mat POT</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        SCF VAR ALL </scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">        CSMRSP</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    End</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">    NumericalQuality Good</scalar>
               <scalar dataType="xsd:string" dictRef="cc:inputLine">EndEngine</scalar>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation">
            <module cmlx:templateRef="adf">
               <module cmlx:templateRef="adf.runtype">
                  <module cmlx:templateRef="symmetry">
                     <scalar dataType="xsd:string" dictRef="a:symmetry">NOSYM</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:charge">-10</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:spinPolarization">12</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="scf">
                  <scalar dataType="xsd:string" dictRef="cc:scfConverged">SCF CONVERGED</scalar>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <molecule id="finalization">
               <atomArray>
                  <atom elementType="W"
                        id="a1"
                        x3="1.128277"
                        y3="8.194000"
                        z3="8.313215"/>
                  <atom elementType="W"
                        id="a2"
                        x3="2.965474"
                        y3="6.330137"
                        z3="10.996227"/>
                  <atom elementType="W"
                        id="a3"
                        x3="-0.617915"
                        y3="6.450770"
                        z3="5.857670"/>
                  <atom elementType="W"
                        id="a4"
                        x3="2.944409"
                        y3="6.453793"
                        z3="5.910610"/>
                  <atom elementType="W"
                        id="a5"
                        x3="-0.833735"
                        y3="6.319124"
                        z3="10.891587"/>
                  <atom elementType="O"
                        id="a6"
                        x3="-15.928254"
                        y3="4.596124"
                        z3="8.459348"/>
                  <atom elementType="O"
                        id="a7"
                        x3="6.782266"
                        y3="4.596124"
                        z3="8.459348"/>
                  <atom elementType="Tc"
                        id="a8"
                        x3="4.708333"
                        y3="4.596697"
                        z3="8.615390"/>
                  <atom elementType="O"
                        id="a9"
                        x3="-8.989330"
                        y3="4.597867"
                        z3="9.296004"/>
                  <atom elementType="Tc"
                        id="a10"
                        x3="-2.598122"
                        y3="4.596350"
                        z3="8.457196"/>
                  <atom elementType="O"
                        id="a11"
                        x3="-8.958146"
                        y3="8.045910"
                        z3="6.892381"/>
                  <atom elementType="P"
                        id="a12"
                        x3="1.137516"
                        y3="4.596527"
                        z3="8.434854"/>
                  <atom elementType="O"
                        id="a13"
                        x3="1.057577"
                        y3="6.223354"
                        z3="11.366836"/>
                  <atom elementType="O"
                        id="a14"
                        x3="-1.046095"
                        y3="4.600242"
                        z3="11.780993"/>
                  <atom elementType="O"
                        id="a15"
                        x3="1.184497"
                        y3="6.689154"
                        z3="5.090962"/>
                  <atom elementType="O"
                        id="a16"
                        x3="3.133906"
                        y3="4.600610"
                        z3="11.876302"/>
                  <atom elementType="O"
                        id="a17"
                        x3="-0.189543"
                        y3="8.048297"
                        z3="6.900970"/>
                  <atom elementType="O"
                        id="a18"
                        x3="-0.461618"
                        y3="4.592841"
                        z3="5.344338"/>
                  <atom elementType="O"
                        id="a19"
                        x3="-1.563600"
                        y3="7.124679"
                        z3="4.566675"/>
                  <atom elementType="O"
                        id="a20"
                        x3="2.415439"
                        y3="7.578232"
                        z3="9.608985"/>
                  <atom elementType="O"
                        id="a21"
                        x3="2.493865"
                        y3="8.052387"
                        z3="6.953020"/>
                  <atom elementType="O"
                        id="a22"
                        x3="-0.223298"
                        y3="7.570284"
                        z3="9.539973"/>
                  <atom elementType="O"
                        id="a23"
                        x3="-1.949043"
                        y3="5.948475"
                        z3="7.086393"/>
                  <atom elementType="O"
                        id="a24"
                        x3="4.586346"
                        y3="5.983560"
                        z3="10.067684"/>
                  <atom elementType="O"
                        id="a25"
                        x3="2.829201"
                        y3="4.592801"
                        z3="5.393277"/>
                  <atom elementType="O"
                        id="a26"
                        x3="-0.160802"
                        y3="4.597397"
                        z3="9.300782"/>
                  <atom elementType="O"
                        id="a27"
                        x3="-4.577769"
                        y3="4.595743"
                        z3="8.052046"/>
                  <atom elementType="O"
                        id="a28"
                        x3="2.450995"
                        y3="4.597567"
                        z3="9.306508"/>
                  <atom elementType="O"
                        id="a29"
                        x3="-2.421237"
                        y3="5.967585"
                        z3="9.899846"/>
                  <atom elementType="O"
                        id="a30"
                        x3="3.946639"
                        y3="7.132893"
                        z3="4.664739"/>
                  <atom elementType="O"
                        id="a31"
                        x3="4.228452"
                        y3="5.950485"
                        z3="7.201443"/>
                  <atom elementType="O"
                        id="a32"
                        x3="3.514566"
                        y3="7.401311"
                        z3="12.246949"/>
                  <atom elementType="O"
                        id="a33"
                        x3="-2.421110"
                        y3="3.228123"
                        z3="9.902772"/>
                  <atom elementType="O"
                        id="a34"
                        x3="1.146683"
                        y3="5.870320"
                        z3="7.544411"/>
                  <atom elementType="O"
                        id="a35"
                        x3="1.118779"
                        y3="9.903718"
                        z3="8.599900"/>
                  <atom elementType="O"
                        id="a36"
                        x3="-7.581676"
                        y3="7.119926"
                        z3="4.560372"/>
                  <atom elementType="O"
                        id="a37"
                        x3="-1.440029"
                        y3="7.393763"
                        z3="12.113066"/>
                  <atom elementType="O"
                        id="a38"
                        x3="-7.710905"
                        y3="1.810255"
                        z3="12.117769"/>
                  <atom elementType="O"
                        id="a39"
                        x3="-7.198085"
                        y3="5.946873"
                        z3="7.081991"/>
                  <atom elementType="O"
                        id="a40"
                        x3="1.146684"
                        y3="3.320832"
                        z3="7.547546"/>
                  <atom elementType="O"
                        id="a41"
                        x3="-11.563310"
                        y3="7.579885"
                        z3="9.600791"/>
                  <atom elementType="O"
                        id="a42"
                        x3="4.228335"
                        y3="3.239532"
                        z3="7.204754"/>
                  <atom elementType="O"
                        id="a43"
                        x3="-7.710778"
                        y3="7.397235"
                        z3="12.105984"/>
                  <atom elementType="O"
                        id="a44"
                        x3="-13.375529"
                        y3="5.947566"
                        z3="7.191366"/>
                  <atom elementType="O"
                        id="a45"
                        x3="-6.728048"
                        y3="5.968533"
                        z3="9.895072"/>
                  <atom elementType="O"
                        id="a46"
                        x3="-10.266764"
                        y3="-0.710871"
                        z3="8.610900"/>
                  <atom elementType="O"
                        id="a47"
                        x3="-13.733953"
                        y3="5.986180"
                        z3="10.057208"/>
                  <atom elementType="O"
                        id="a48"
                        x3="1.057606"
                        y3="2.976384"
                        z3="11.370171"/>
                  <atom elementType="O"
                        id="a49"
                        x3="1.184454"
                        y3="2.496070"
                        z3="5.096215"/>
                  <atom elementType="O"
                        id="a50"
                        x3="-0.189824"
                        y3="1.141282"
                        z3="6.909052"/>
                  <atom elementType="O"
                        id="a51"
                        x3="-10.266482"
                        y3="9.903876"
                        z3="8.589226"/>
                  <atom elementType="O"
                        id="a52"
                        x3="-1.563481"
                        y3="2.059468"
                        z3="4.572335"/>
                  <atom elementType="O"
                        id="a53"
                        x3="2.415485"
                        y3="1.617504"
                        z3="9.616073"/>
                  <atom elementType="O"
                        id="a54"
                        x3="2.493919"
                        y3="1.137005"
                        z3="6.961341"/>
                  <atom elementType="O"
                        id="a55"
                        x3="-0.223527"
                        y3="1.625160"
                        z3="9.546934"/>
                  <atom elementType="O"
                        id="a56"
                        x3="3.946631"
                        y3="2.050936"
                        z3="4.670986"/>
                  <atom elementType="O"
                        id="a57"
                        x3="3.514242"
                        y3="1.800838"
                        z3="12.253519"/>
                  <atom elementType="O"
                        id="a58"
                        x3="1.118527"
                        y3="-0.710416"
                        z3="8.612471"/>
                  <atom elementType="O"
                        id="a59"
                        x3="-1.439922"
                        y3="1.807368"
                        z3="12.119505"/>
                  <atom elementType="W"
                        id="a60"
                        x3="-10.276464"
                        y3="8.193432"
                        z3="8.305116"/>
                  <atom elementType="W"
                        id="a61"
                        x3="-8.317046"
                        y3="6.321096"
                        z3="10.885735"/>
                  <atom elementType="Tc"
                        id="a62"
                        x3="-13.854785"
                        y3="4.596320"
                        z3="8.603011"/>
                  <atom elementType="W"
                        id="a63"
                        x3="-12.089573"
                        y3="6.451188"
                        z3="5.901118"/>
                  <atom elementType="W"
                        id="a64"
                        x3="-8.527756"
                        y3="6.447830"
                        z3="5.852073"/>
                  <atom elementType="O"
                        id="a65"
                        x3="-10.295907"
                        y3="3.319414"
                        z3="7.543298"/>
                  <atom elementType="O"
                        id="a66"
                        x3="-12.284164"
                        y3="4.603040"
                        z3="11.870232"/>
                  <atom elementType="W"
                        id="a67"
                        x3="-12.116977"
                        y3="6.331778"
                        z3="10.987962"/>
                  <atom elementType="O"
                        id="a68"
                        x3="-10.330782"
                        y3="6.685362"
                        z3="5.082833"/>
                  <atom elementType="W"
                        id="a69"
                        x3="-10.276664"
                        y3="0.998106"
                        z3="8.319673"/>
                  <atom elementType="W"
                        id="a70"
                        x3="-8.317135"
                        y3="2.881415"
                        z3="10.892793"/>
                  <atom elementType="W"
                        id="a71"
                        x3="-12.089679"
                        y3="2.730132"
                        z3="5.908851"/>
                  <atom elementType="W"
                        id="a72"
                        x3="1.128146"
                        y3="0.998676"
                        z3="8.321718"/>
                  <atom elementType="W"
                        id="a73"
                        x3="2.965476"
                        y3="2.868906"
                        z3="11.000246"/>
                  <atom elementType="W"
                        id="a74"
                        x3="-0.617972"
                        y3="2.736245"
                        z3="5.862143"/>
                  <atom elementType="W"
                        id="a75"
                        x3="2.944405"
                        y3="2.733127"
                        z3="5.915228"/>
                  <atom elementType="W"
                        id="a76"
                        x3="-0.833833"
                        y3="2.879373"
                        z3="10.895548"/>
                  <atom elementType="W"
                        id="a77"
                        x3="-8.527931"
                        y3="2.733381"
                        z3="5.859816"/>
                  <atom elementType="W"
                        id="a78"
                        x3="-12.117184"
                        y3="2.870727"
                        z3="10.994920"/>
                  <atom elementType="O"
                        id="a79"
                        x3="-10.207482"
                        y3="2.978100"
                        z3="11.365602"/>
                  <atom elementType="O"
                        id="a80"
                        x3="-10.330806"
                        y3="2.492460"
                        z3="5.091509"/>
                  <atom elementType="O"
                        id="a81"
                        x3="-11.641853"
                        y3="1.135655"
                        z3="6.957797"/>
                  <atom elementType="O"
                        id="a82"
                        x3="-13.091700"
                        y3="2.046829"
                        z3="4.664865"/>
                  <atom elementType="O"
                        id="a83"
                        x3="-8.958314"
                        y3="1.139586"
                        z3="6.906668"/>
                  <atom elementType="O"
                        id="a84"
                        x3="-11.563554"
                        y3="1.616741"
                        z3="9.612674"/>
                  <atom elementType="O"
                        id="a85"
                        x3="-13.375546"
                        y3="3.239403"
                        z3="7.197232"/>
                  <atom elementType="Tc"
                        id="a86"
                        x3="-6.548574"
                        y3="4.596145"
                        z3="8.455209"/>
                  <atom elementType="O"
                        id="a87"
                        x3="-6.728056"
                        y3="3.229756"
                        z3="9.900951"/>
                  <atom elementType="O"
                        id="a88"
                        x3="-13.734130"
                        y3="3.212558"
                        z3="10.063008"/>
                  <atom elementType="O"
                        id="a89"
                        x3="-12.665788"
                        y3="1.803763"
                        z3="12.249706"/>
                  <atom elementType="O"
                        id="a90"
                        x3="-8.103808"
                        y3="4.603062"
                        z3="11.776481"/>
                  <atom elementType="O"
                        id="a91"
                        x3="-11.975547"
                        y3="4.589615"
                        z3="5.385780"/>
                  <atom elementType="O"
                        id="a92"
                        x3="-8.924669"
                        y3="1.625438"
                        z3="9.543872"/>
                  <atom elementType="O"
                        id="a93"
                        x3="-13.091598"
                        y3="7.129555"
                        z3="4.654371"/>
                  <atom elementType="O"
                        id="a94"
                        x3="-12.665540"
                        y3="7.403807"
                        z3="12.238199"/>
                  <atom elementType="O"
                        id="a95"
                        x3="-10.295793"
                        y3="5.868980"
                        z3="7.538138"/>
                  <atom elementType="P"
                        id="a96"
                        x3="-10.287446"
                        y3="4.596135"
                        z3="8.429625"/>
                  <atom elementType="O"
                        id="a97"
                        x3="-10.207289"
                        y3="6.225640"
                        z3="11.359047"/>
                  <atom elementType="O"
                        id="a98"
                        x3="-7.581609"
                        y3="2.056053"
                        z3="4.571098"/>
                  <atom elementType="O"
                        id="a99"
                        x3="-8.685632"
                        y3="4.589600"
                        z3="5.340507"/>
                  <atom elementType="O"
                        id="a100"
                        x3="-8.924510"
                        y3="7.571287"
                        z3="9.531935"/>
                  <atom elementType="O"
                        id="a101"
                        x3="-7.198404"
                        y3="3.239909"
                        z3="7.087775"/>
                  <atom elementType="O"
                        id="a102"
                        x3="-11.601007"
                        y3="4.597978"
                        z3="9.301588"/>
                  <atom elementType="O"
                        id="a103"
                        x3="-1.949106"
                        y3="3.241300"
                        z3="7.089458"/>
                  <atom elementType="O"
                        id="a104"
                        x3="4.586351"
                        y3="3.213279"
                        z3="10.071112"/>
                  <atom elementType="O"
                        id="a105"
                        x3="-11.641647"
                        y3="8.050031"
                        z3="6.943661"/>
                  <atom elementType="H"
                        id="a106"
                        x3="7.092491"
                        y3="4.596387"
                        z3="9.389004"/>
                  <atom elementType="H"
                        id="a107"
                        x3="-16.132517"
                        y3="4.595214"
                        z3="7.500709"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a17 a1" order="S"/>
                  <bond atomRefs2="a20 a1" order="S"/>
                  <bond atomRefs2="a21 a1" order="S"/>
                  <bond atomRefs2="a22 a1" order="S"/>
                  <bond atomRefs2="a34 a1" order="S"/>
                  <bond atomRefs2="a35 a1" order="S"/>
                  <bond atomRefs2="a13 a2" order="S"/>
                  <bond atomRefs2="a16 a2" order="S"/>
                  <bond atomRefs2="a20 a2" order="S"/>
                  <bond atomRefs2="a24 a2" order="S"/>
                  <bond atomRefs2="a32 a2" order="S"/>
                  <bond atomRefs2="a15 a3" order="S"/>
                  <bond atomRefs2="a17 a3" order="S"/>
                  <bond atomRefs2="a18 a3" order="S"/>
                  <bond atomRefs2="a19 a3" order="S"/>
                  <bond atomRefs2="a23 a3" order="S"/>
                  <bond atomRefs2="a15 a4" order="S"/>
                  <bond atomRefs2="a21 a4" order="S"/>
                  <bond atomRefs2="a25 a4" order="S"/>
                  <bond atomRefs2="a30 a4" order="S"/>
                  <bond atomRefs2="a31 a4" order="S"/>
                  <bond atomRefs2="a13 a5" order="S"/>
                  <bond atomRefs2="a14 a5" order="S"/>
                  <bond atomRefs2="a22 a5" order="S"/>
                  <bond atomRefs2="a26 a5" order="S"/>
                  <bond atomRefs2="a29 a5" order="S"/>
                  <bond atomRefs2="a37 a5" order="S"/>
                  <bond atomRefs2="a62 a6" order="S"/>
                  <bond atomRefs2="a107 a6" order="S"/>
                  <bond atomRefs2="a8 a7" order="S"/>
                  <bond atomRefs2="a106 a7" order="S"/>
                  <bond atomRefs2="a24 a8" order="S"/>
                  <bond atomRefs2="a31 a8" order="S"/>
                  <bond atomRefs2="a42 a8" order="S"/>
                  <bond atomRefs2="a104 a8" order="S"/>
                  <bond atomRefs2="a96 a9" order="S"/>
                  <bond atomRefs2="a23 a10" order="S"/>
                  <bond atomRefs2="a27 a10" order="S"/>
                  <bond atomRefs2="a29 a10" order="S"/>
                  <bond atomRefs2="a33 a10" order="S"/>
                  <bond atomRefs2="a103 a10" order="S"/>
                  <bond atomRefs2="a60 a11" order="S"/>
                  <bond atomRefs2="a64 a11" order="S"/>
                  <bond atomRefs2="a26 a12" order="S"/>
                  <bond atomRefs2="a28 a12" order="S"/>
                  <bond atomRefs2="a34 a12" order="S"/>
                  <bond atomRefs2="a40 a12" order="S"/>
                  <bond atomRefs2="a76 a14" order="S"/>
                  <bond atomRefs2="a73 a16" order="S"/>
                  <bond atomRefs2="a74 a18" order="S"/>
                  <bond atomRefs2="a75 a25" order="S"/>
                  <bond atomRefs2="a76 a26" order="S"/>
                  <bond atomRefs2="a86 a27" order="S"/>
                  <bond atomRefs2="a76 a33" order="S"/>
                  <bond atomRefs2="a64 a36" order="S"/>
                  <bond atomRefs2="a70 a38" order="S"/>
                  <bond atomRefs2="a64 a39" order="S"/>
                  <bond atomRefs2="a86 a39" order="S"/>
                  <bond atomRefs2="a72 a40" order="S"/>
                  <bond atomRefs2="a60 a41" order="S"/>
                  <bond atomRefs2="a67 a41" order="S"/>
                  <bond atomRefs2="a75 a42" order="S"/>
                  <bond atomRefs2="a61 a43" order="S"/>
                  <bond atomRefs2="a62 a44" order="S"/>
                  <bond atomRefs2="a63 a44" order="S"/>
                  <bond atomRefs2="a61 a45" order="S"/>
                  <bond atomRefs2="a86 a45" order="S"/>
                  <bond atomRefs2="a69 a46" order="S"/>
                  <bond atomRefs2="a62 a47" order="S"/>
                  <bond atomRefs2="a67 a47" order="S"/>
                  <bond atomRefs2="a73 a48" order="S"/>
                  <bond atomRefs2="a76 a48" order="S"/>
                  <bond atomRefs2="a74 a49" order="S"/>
                  <bond atomRefs2="a75 a49" order="S"/>
                  <bond atomRefs2="a72 a50" order="S"/>
                  <bond atomRefs2="a74 a50" order="S"/>
                  <bond atomRefs2="a60 a51" order="S"/>
                  <bond atomRefs2="a74 a52" order="S"/>
                  <bond atomRefs2="a72 a53" order="S"/>
                  <bond atomRefs2="a73 a53" order="S"/>
                  <bond atomRefs2="a72 a54" order="S"/>
                  <bond atomRefs2="a75 a54" order="S"/>
                  <bond atomRefs2="a72 a55" order="S"/>
                  <bond atomRefs2="a76 a55" order="S"/>
                  <bond atomRefs2="a75 a56" order="S"/>
                  <bond atomRefs2="a73 a57" order="S"/>
                  <bond atomRefs2="a72 a58" order="S"/>
                  <bond atomRefs2="a76 a59" order="S"/>
                  <bond atomRefs2="a95 a60" order="S"/>
                  <bond atomRefs2="a100 a60" order="S"/>
                  <bond atomRefs2="a105 a60" order="S"/>
                  <bond atomRefs2="a90 a61" order="S"/>
                  <bond atomRefs2="a97 a61" order="S"/>
                  <bond atomRefs2="a100 a61" order="S"/>
                  <bond atomRefs2="a85 a62" order="S"/>
                  <bond atomRefs2="a88 a62" order="S"/>
                  <bond atomRefs2="a68 a63" order="S"/>
                  <bond atomRefs2="a91 a63" order="S"/>
                  <bond atomRefs2="a93 a63" order="S"/>
                  <bond atomRefs2="a105 a63" order="S"/>
                  <bond atomRefs2="a68 a64" order="S"/>
                  <bond atomRefs2="a99 a64" order="S"/>
                  <bond atomRefs2="a69 a65" order="S"/>
                  <bond atomRefs2="a96 a65" order="S"/>
                  <bond atomRefs2="a67 a66" order="S"/>
                  <bond atomRefs2="a78 a66" order="S"/>
                  <bond atomRefs2="a94 a67" order="S"/>
                  <bond atomRefs2="a97 a67" order="S"/>
                  <bond atomRefs2="a102 a67" order="S"/>
                  <bond atomRefs2="a81 a69" order="S"/>
                  <bond atomRefs2="a83 a69" order="S"/>
                  <bond atomRefs2="a84 a69" order="S"/>
                  <bond atomRefs2="a92 a69" order="S"/>
                  <bond atomRefs2="a79 a70" order="S"/>
                  <bond atomRefs2="a87 a70" order="S"/>
                  <bond atomRefs2="a90 a70" order="S"/>
                  <bond atomRefs2="a92 a70" order="S"/>
                  <bond atomRefs2="a80 a71" order="S"/>
                  <bond atomRefs2="a81 a71" order="S"/>
                  <bond atomRefs2="a82 a71" order="S"/>
                  <bond atomRefs2="a85 a71" order="S"/>
                  <bond atomRefs2="a91 a71" order="S"/>
                  <bond atomRefs2="a104 a73" order="S"/>
                  <bond atomRefs2="a103 a74" order="S"/>
                  <bond atomRefs2="a80 a77" order="S"/>
                  <bond atomRefs2="a83 a77" order="S"/>
                  <bond atomRefs2="a98 a77" order="S"/>
                  <bond atomRefs2="a99 a77" order="S"/>
                  <bond atomRefs2="a101 a77" order="S"/>
                  <bond atomRefs2="a79 a78" order="S"/>
                  <bond atomRefs2="a84 a78" order="S"/>
                  <bond atomRefs2="a88 a78" order="S"/>
                  <bond atomRefs2="a89 a78" order="S"/>
                  <bond atomRefs2="a102 a78" order="S"/>
                  <bond atomRefs2="a87 a86" order="S"/>
                  <bond atomRefs2="a101 a86" order="S"/>
                  <bond atomRefs2="a96 a95" order="S"/>
                  <bond atomRefs2="a102 a96" order="S"/>
               </bondArray>
               <formula concise="H2O79P2Tc4W20"/>
               <property dictRef="cml:molmass">
                  <scalar units="nonsi:dalton">5398.580018</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1/2O4P.2H2O.69O.4Tc.20W/c2*1-5(2,3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h;;2*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q2*-2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;2*+1;;;;;;;;;;;;;;;;;4*+1/p-2/rH2O79P2Tc4W20/c1-80-25-100(19)58-88(7)34-83(4)35-89(8,47-88)51-91(10)37-84(36-90(9,50-88,52-91)60-100,38-96(15,66-100)55-97(16,39-84)67-101(20,26-80,59-89,61-91)73-103(22,43-83,71-97)76-102(21,42-83,70-96,72-100)78(80)103)29-85-40-92(11)48-86(5)30-82(3)31-87(6,46-86)49-93(12,41-85,53-92)63-99(18,57-87)28-81(2)27-98(17,56-86,62-92)64-94(13,32-82)54-95(14,33-82,65-99)69-105(24,45-85,75-99)77-104(23,44-85,68-94,74-98)79(81)105/h3-4H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:9,65,95,102,96;26,28,34,40,12;6;7;11;13;14;15;16;17;18;19;20;21;22;23;24;25;27;29;30;31;32;33;35;36;37;38;39;41;42;43;44;45;46;47;48;49;50;51;52;53;54;55;56;57;58;59;66;68;79;80;81;82;83;84;85;87;88;89;90;91;92;93;94;97;98;99;100;101;103;104;105;10;86;8;62;2;3;4;5;61;63;64;67;70;71;73;74;75;76;77;78;1;60;69;72/E:2*(1,2,3,4);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/CRV:1.1,2-1,3-1,4.1,5.4;1.1,2.1,3-1,4-1,5.4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/rA:107nWWWWWOOTcO1TcOP4OOOOOOO1OOOOOOO3OO1OO1OO1OOO1O1O1O1OOOOO1OOO1OOOOO1O1OOOO1O1O1O1WWTcWWOOWOWWWWWWWWWWOOOO1OOOTcOOO1OOOO1O1OP4OO1OOOO3OOOHH/rB:;;;;;;s7;;;;;s2s5;s5;s3s4;s2;s1s3;s3;s3;s1s2;s1s4;s1s5;s3s10;s2s8;s4;s5s12;s10;s12;s5s10;s4;s4s8;s2;s10;s1s12;s1;;s5;;;s12;;s8;;;;;;;;;;;;;;;;;;s11s41s51;s43s45;s6s44s47;s44;s11s36s39;;;s41s47s66;s63s64;s46s65;s38;;s40s50s53s54s55s58;s16s48s53s57;s18s49s50s52;s25s42s49s54s56;s14s26s33s48s55s59;;s66;s70s78;s71s77;s69s71;s71;s69s77;s69s78;s62s71;s27s39s45;s70s86;s62s78;s78;s61s70;s63s71;s69s70;s63;s67;s60;s9s65s95;s61s67;s77;s64s77;s60s61;s77s86;s67s78s96;s10s74;s8s73;s60s63;s7;s6;/rC:1.1283,8.194,8.3132;2.9655,6.3301,10.9962;-.6179,6.4508,5.8577;2.9444,6.4538,5.9106;-.8337,6.3191,10.8916;-15.9283,4.5961,8.4593;6.7823,4.5961,8.4593;4.7083,4.5967,8.6154;-8.9893,4.5979,9.296;-2.5981,4.5964,8.4572;-8.9581,8.0459,6.8924;1.1375,4.5965,8.4349;1.0576,6.2234,11.3668;-1.0461,4.6002,11.781;1.1845,6.6892,5.091;3.1339,4.6006,11.8763;-.1895,8.0483,6.901;-.4616,4.5928,5.3443;-1.5636,7.1247,4.5667;2.4154,7.5782,9.609;2.4939,8.0524,6.953;-.2233,7.5703,9.54;-1.949,5.9485,7.0864;4.5863,5.9836,10.0677;2.8292,4.5928,5.3933;-.1608,4.5974,9.3008;-4.5778,4.5957,8.052;2.451,4.5976,9.3065;-2.4212,5.9676,9.8998;3.9466,7.1329,4.6647;4.2285,5.9505,7.2014;3.5146,7.4013,12.2469;-2.4211,3.2281,9.9028;1.1467,5.8703,7.5444;1.1188,9.9037,8.5999;-7.5817,7.1199,4.5604;-1.44,7.3938,12.1131;-7.7109,1.8103,12.1178;-7.1981,5.9469,7.082;1.1467,3.3208,7.5475;-11.5633,7.5799,9.6008;4.2283,3.2395,7.2048;-7.7108,7.3972,12.106;-13.3755,5.9476,7.1914;-6.728,5.9685,9.8951;-10.2668,-.7109,8.6109;-13.734,5.9862,10.0572;1.0576,2.9764,11.3702;1.1845,2.4961,5.0962;-.1898,1.1413,6.9091;-10.2665,9.9039,8.5892;-1.5635,2.0595,4.5723;2.4155,1.6175,9.6161;2.4939,1.137,6.9613;-.2235,1.6252,9.5469;3.9466,2.0509,4.671;3.5142,1.8008,12.2535;1.1185,-.7104,8.6125;-1.4399,1.8074,12.1195;-10.2765,8.1934,8.3051;-8.317,6.3211,10.8857;-13.8548,4.5963,8.603;-12.0896,6.4512,5.9011;-8.5278,6.4478,5.8521;-10.2959,3.3194,7.5433;-12.2842,4.603,11.8702;-12.117,6.3318,10.988;-10.3308,6.6854,5.0828;-10.2767,.9981,8.3197;-8.3171,2.8814,10.8928;-12.0897,2.7301,5.9089;1.1281,.9987,8.3217;2.9655,2.8689,11.0002;-.618,2.7362,5.8621;2.9444,2.7331,5.9152;-.8338,2.8794,10.8955;-8.5279,2.7334,5.8598;-12.1172,2.8707,10.9949;-10.2075,2.9781,11.3656;-10.3308,2.4925,5.0915;-11.6419,1.1357,6.9578;-13.0917,2.0468,4.6649;-8.9583,1.1396,6.9067;-11.5636,1.6167,9.6127;-13.3755,3.2394,7.1972;-6.5486,4.5961,8.4552;-6.7281,3.2298,9.901;-13.7341,3.2126,10.063;-12.6658,1.8038,12.2497;-8.1038,4.6031,11.7765;-11.9755,4.5896,5.3858;-8.9247,1.6254,9.5439;-13.0916,7.1296,4.6544;-12.6655,7.4038,12.2382;-10.2958,5.869,7.5381;-10.2874,4.5961,8.4296;-10.2073,6.2256,11.359;-7.5816,2.0561,4.5711;-8.6856,4.5896,5.3405;-8.9245,7.5713,9.5319;-7.1984,3.2399,7.0878;-11.601,4.598,9.3016;-1.9491,3.2413,7.0895;4.5864,3.2133,10.0711;-11.6416,8.05,6.9437;7.0925,4.5964,9.389;-16.1325,4.5952,7.5007;/R:/0/N:9,28,7,6,30,56,82,93,98,36,19,52,32,57,38,43,35,58,46,51,89,94,37,59,65,95,34,40,27,31,42,24,104,85,44,101,39,87,45,23,103,88,47,29,33,25,91,15,49,80,68,99,18,16,90,21,54,81,105,83,11,17,50,20,53,92,100,13,48,79,97,84,41,22,55,66,14,102,26,96,12,8,62,86,10,4,75,71,63,77,64,3,74,2,73,70,61,1,72,69,60,78,67,5,76/E:(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)(19,20)(21,22)(23,24)(25,26)(27,28)(30,31)(32,33)(34,35)(36,37)(38,39)(40,41)(42,43)(44,45)(48,49)(50,51)(56,57)(58,59)(60,61)(62,63)(64,65)(66,67)(68,69)(70,71)(72,73)(74,75)(86,87)(88,89)(90,91)(92,93)(94,95)(96,97)(98,99)(100,101)(102,103)(104,105)/CRV:1.1,2.1,5.1,6.1,7.1,8.1,9.1,10.1,11.1,12.1,13.1,14.1,15.1,16.1,17.1,18.1,19.1,20.1,21.1,22.1,23.1,24.1,78.3,79.3,80.4,81.4,82.5,83.5,84.5,85.5</scalar>
               </formula>
            </molecule>
            <propertyList>
               <property dataType="xsd:double" dictRef="cc:cputime">
                  <scalar>52130.59395800</scalar>
               </property>
               <property dataType="xsd:double" dictRef="cc:systemtime">
                  <scalar>650.52865500</scalar>
               </property>
               <property dataType="xsd:double" dictRef="cc:elapsedtime">
                  <scalar>61777.74119782</scalar>
               </property>
            </propertyList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="atomic.charges.spin" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="spin">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="107">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="107">W W W W W O O Tc O Tc O P O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O W W Tc W W O O W O W W W W W W W W W W O O O O O O O Tc O O O O O O O O O P O O O O O O O O O H H</array>
                     <array dataType="xsd:double" dictRef="a:mdcm" size="107">2.516735 2.504235 2.503769 2.502916 2.509569 -0.699290 -0.700732 2.599943 -1.045632 2.595397 -0.945428 2.004221 -0.963296 -0.948156 -0.954778 -0.951859 -0.945324 -0.965328 -0.817206 -0.960614 -0.946233 -0.959033 -1.055440 -1.046658 -0.966313 -1.045855 -1.181492 -1.065609 -1.048971 -0.820929 -1.065804 -0.816364 -1.048961 -1.030385 -0.808393 -0.817232 -0.814620 -0.815010 -1.054894 -1.030379 -0.960572 -1.065800 -0.814936 -1.065599 -1.049265 -0.808534 -1.046299 -0.963309 -0.954803 -0.945330 -0.808563 -0.817292 -0.960593 -0.946225 -0.958974 -0.820969 -0.816313 -0.808332 -0.814682 2.516599 2.509602 2.601222 2.503247 2.503639 -1.030395 -0.951870 2.504024 -0.954689 2.516702 2.509533 2.503231 2.516654 2.504306 2.503803 2.502932 2.509611 2.503645 2.503939 -0.963510 -0.954674 -0.946381 -0.821094 -0.945428 -0.960591 -1.065718 2.599975 -1.049249 -1.046250 -0.816676 -0.948292 -0.966208 -0.959081 -0.821147 -0.816660 -1.030334 2.004342 -0.963519 -0.817183 -0.965363 -0.959031 -1.054969 -1.065683 -1.055456 -1.046620 -0.946398 0.065740 0.065547</array>
                     <array dataType="xsd:double" dictRef="a:mdcd" size="107">1.941441 1.936104 1.943556 1.944246 1.941334 -0.839279 -0.860239 1.717840 -0.774864 1.783282 -0.766432 1.575316 -0.711851 -0.772419 -0.775858 -0.773777 -0.766414 -0.718711 -0.713803 -0.722744 -0.768396 -0.718035 -0.809128 -0.816839 -0.719167 -0.775050 -0.842082 -0.776921 -0.825187 -0.717640 -0.805408 -0.710944 -0.825210 -0.748126 -0.707310 -0.713806 -0.709808 -0.710346 -0.808841 -0.748183 -0.720871 -0.805381 -0.710269 -0.800390 -0.825064 -0.707493 -0.825950 -0.711847 -0.775845 -0.766362 -0.707508 -0.713906 -0.722727 -0.768370 -0.717905 -0.717685 -0.710903 -0.707239 -0.709869 1.940984 1.941190 1.716048 1.941048 1.943318 -0.749851 -0.772640 1.941650 -0.776399 1.941231 1.941008 1.941064 1.941345 1.936237 1.943460 1.944210 1.941322 1.943352 1.941504 -0.711002 -0.776386 -0.770045 -0.717549 -0.766471 -0.720935 -0.800445 1.786192 -0.825101 -0.825855 -0.710573 -0.772626 -0.720196 -0.718143 -0.717607 -0.710578 -0.749828 1.574553 -0.711037 -0.713755 -0.718846 -0.718026 -0.808898 -0.773541 -0.809093 -0.816796 -0.770074 0.380746 0.367119</array>
                     <array dataType="xsd:double" dictRef="a:mdcq" size="107">2.041705 2.045799 2.046874 2.051497 2.041118 -0.837718 -0.870726 1.958440 -0.833059 1.898014 -0.806601 1.539883 -0.798098 -0.818432 -0.821472 -0.811268 -0.806897 -0.811329 -0.676543 -0.800077 -0.803762 -0.799648 -0.853932 -0.900349 -0.810652 -0.832833 -0.930793 -0.822591 -0.835336 -0.678827 -0.893112 -0.675110 -0.835332 -0.815639 -0.670259 -0.676600 -0.676602 -0.677176 -0.853502 -0.815758 -0.799056 -0.893139 -0.677075 -0.912394 -0.835337 -0.670403 -0.877803 -0.798133 -0.821487 -0.806867 -0.670417 -0.676631 -0.800034 -0.803730 -0.799445 -0.678873 -0.675079 -0.670194 -0.676683 2.041736 2.040891 1.962312 2.050569 2.047103 -0.813416 -0.820555 2.044894 -0.821406 2.041969 2.040723 2.050574 2.041600 2.045969 2.046779 2.051459 2.041083 2.047150 2.044731 -0.800076 -0.821381 -0.807882 -0.677947 -0.806605 -0.799077 -0.912622 1.901067 -0.835303 -0.877560 -0.674076 -0.818918 -0.803279 -0.799726 -0.678012 -0.674063 -0.813273 1.540802 -0.800099 -0.676551 -0.810651 -0.799612 -0.853670 -0.825195 -0.853865 -0.900302 -0.807950 0.402598 0.368542</array>
                  </list>
               </module>
               <module cmlx:templateRef="spin.density" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="spinDensity">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="107">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="107">W W W W W O O Tc O Tc O P O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O W W Tc W W O O W O W W W W W W W W W W O O O O O O O Tc O O O O O O O O O P O O O O O O O O O H H</array>
                     <array dataType="xsd:double" dictRef="a:mdcm" size="107">0.013895 0.022929 0.024029 0.023953 0.024801 0.128507 0.132504 2.045627 0.014907 2.056950 0.004698 0.002672 0.002959 0.036320 0.008598 0.033599 0.004698 0.032164 0.017223 0.004634 0.004897 0.005125 0.120992 0.125641 0.032803 0.015771 0.282302 0.014421 0.134398 0.022692 0.136494 0.012998 0.134359 0.001025 -0.000455 0.016896 0.015677 0.015491 0.119456 0.001023 0.004634 0.136431 0.015486 0.137234 0.134321 -0.000443 0.126798 0.002958 0.008602 0.004699 -0.000444 0.017230 0.004627 0.004898 0.005118 0.022686 0.012982 -0.000455 0.015679 0.013875 0.024582 2.045635 0.024011 0.024053 0.000975 0.033109 0.023054 0.008494 0.013855 0.024562 0.024076 0.013905 0.022904 0.024033 0.023960 0.024760 0.024092 0.023059 0.002846 0.008511 0.004950 0.023068 0.004711 0.004630 0.137325 2.040015 0.134266 0.126756 0.013937 0.036482 0.033002 0.005128 0.023063 0.013935 0.000974 0.002052 0.002851 0.016881 0.032094 0.005131 0.119497 0.013012 0.120978 0.125598 0.004941 0.012548 0.013108</array>
                     <array dataType="xsd:double" dictRef="a:mdcd" size="107">0.012500 0.025132 0.026176 0.027399 0.027034 0.214733 0.224324 1.579742 0.035024 1.635637 0.007157 0.003557 0.001686 0.038591 0.007523 0.035000 0.007171 0.033543 0.020841 0.008742 0.007609 0.008887 0.188449 0.184535 0.035849 0.035939 0.463786 0.043895 0.203741 0.026673 0.207211 0.015229 0.203689 0.004027 0.000413 0.020480 0.018296 0.018120 0.186265 0.004024 0.008784 0.207129 0.018117 0.196818 0.202990 0.000425 0.197087 0.001684 0.007527 0.007172 0.000424 0.020848 0.008732 0.007609 0.008878 0.026666 0.015210 0.000413 0.018295 0.012486 0.026883 1.579237 0.026286 0.026133 0.003794 0.036440 0.026467 0.007400 0.012471 0.026865 0.026347 0.012507 0.025111 0.026177 0.027401 0.026996 0.026169 0.026470 0.001708 0.007413 0.007586 0.026506 0.007171 0.008782 0.196935 1.621724 0.202956 0.197059 0.016535 0.038757 0.034374 0.008896 0.026495 0.016534 0.003793 0.003020 0.001712 0.020469 0.033402 0.008898 0.186335 0.044488 0.188445 0.184454 0.007574 0.054259 0.058647</array>
                     <array dataType="xsd:double" dictRef="a:mdcq" size="107">0.012836 0.023066 0.021413 0.020309 0.023198 0.206639 0.222018 1.577232 0.027090 1.642444 0.008321 0.000066 0.001713 0.037216 0.004989 0.034705 0.008146 0.032500 0.018592 0.012064 0.007238 0.011689 0.196783 0.191129 0.032944 0.028325 0.458828 0.038342 0.210965 0.024668 0.231465 0.012851 0.210913 0.000925 0.000156 0.018297 0.015852 0.015621 0.194563 0.000929 0.010922 0.231358 0.015615 0.211066 0.210333 0.000178 0.218908 0.001716 0.004993 0.008153 0.000179 0.018595 0.012060 0.007249 0.011676 0.024659 0.012837 0.000158 0.015857 0.013014 0.022767 1.570910 0.022076 0.021758 0.003677 0.032485 0.020275 0.005920 0.012995 0.022748 0.022127 0.012848 0.023057 0.021413 0.020315 0.023166 0.021791 0.020276 0.000021 0.005925 0.008624 0.024219 0.008340 0.010906 0.211237 1.628598 0.210280 0.218869 0.013494 0.037129 0.034770 0.011560 0.024215 0.013490 0.003681 0.001266 0.000025 0.018282 0.032941 0.011577 0.194688 0.032407 0.196772 0.190996 0.008608 0.035435 0.044481</array>
                  </list>
               </module>
               <module cmlx:templateRef="bonding.energy">
                  <module cmlx:templateRef="summary">
                     <scalar dataType="xsd:double" dictRef="cc:eener" units="nonsi:electronvolt">-799.058858</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:kinener"
                             units="nonsi:electronvolt">765.975191</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:coulombener"
                             units="nonsi:electronvolt">3.102284</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:xcener"
                             units="nonsi:electronvolt">-813.092248</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:solvener"
                             units="nonsi:electronvolt">-88.455659</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:dispener"
                             units="nonsi:electronvolt">0.000000</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:total" units="nonsi:electronvolt">-931.529278</scalar>
                  </module>
               </module>
               <module cmlx:templateRef="mulliken">
                  <module cmlx:templateRef="charges">
                     <list cmlx:templateRef="row" id="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="107">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="107">W W W W W O O Tc O Tc O P O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O W W Tc W W O O W O W W W W W W W W W W O O O O O O O Tc O O O O O O O O O P O O O O O O O O O H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="107">2.47891007 2.43243921 2.46154775 2.45378140 2.44500251 -0.78165295 -0.78370529 1.97986326 -1.01980774 1.96027575 -0.96853845 2.38973451 -0.95792449 -0.96600702 -0.97194557 -0.96631302 -0.96840648 -0.96354273 -0.78330501 -0.95902761 -0.96835595 -0.95877066 -0.94485486 -0.93712247 -0.96318737 -1.01981490 -0.89721053 -1.04584840 -0.93678709 -0.78580668 -0.94047678 -0.78367276 -0.93684199 -1.04464369 -0.77808203 -0.78330444 -0.78300475 -0.78330385 -0.94466912 -1.04455866 -0.95895579 -0.94048180 -0.78331035 -0.94073829 -0.93684981 -0.77819867 -0.93516535 -0.95794225 -0.97196438 -0.96840733 -0.77814220 -0.78335449 -0.95899620 -0.96834133 -0.95872764 -0.78583479 -0.78367987 -0.77801145 -0.78305029 2.47868305 2.44548834 1.98503402 2.45512357 2.46106007 -1.04434976 -0.96629639 2.43164434 -0.97153240 2.47893496 2.44524987 2.45513445 2.47866775 2.43262356 2.46160982 2.45383147 2.44505268 2.46113216 2.43136099 -0.95814282 -0.97151740 -0.96840060 -0.78564868 -0.96857549 -0.95895482 -0.94074380 1.96558443 -0.93685559 -0.93515265 -0.78422261 -0.96613974 -0.96319870 -0.95870660 -0.78568816 -0.78425926 -1.04429703 2.38218905 -0.95815583 -0.78327746 -0.96362290 -0.95872049 -0.94470428 -1.04656217 -0.94489378 -0.93715878 -0.96836744 0.28573272 0.28309950</array>
                        <array dataType="xsd:double" dictRef="a:spinDensity" size="107">0.01756745 0.02746977 0.02906594 0.02833264 0.02976481 0.05974654 0.06442355 2.40618624 -0.00226049 2.41960877 0.00169339 0.00764682 0.00263460 0.03629981 0.00915725 0.03381665 0.00169289 0.03136008 0.01604579 0.00162447 0.00189018 0.00193531 0.06149171 0.05865126 0.03190180 -0.00200310 0.09807759 -0.01059821 0.06403653 0.02177463 0.06887827 0.01222453 0.06401393 -0.00006285 -0.00111426 0.01570287 0.01490252 0.01471266 0.06053697 -0.00006412 0.00159991 0.06881007 0.01470578 0.06870401 0.06441843 -0.00110058 0.06014876 0.00263576 0.00916255 0.00169269 -0.00110236 0.01605456 0.00161856 0.00189040 0.00193130 0.02176868 0.01220918 -0.00111509 0.01490573 0.01757368 0.02950614 2.40866675 0.02858954 0.02907014 -0.00003199 0.03330764 0.02732790 0.00902281 0.01754780 0.02947806 0.02868214 0.01758093 0.02743570 0.02906638 0.02834097 0.02970764 0.02912628 0.02732715 0.00256472 0.00903960 0.00197116 0.02219752 0.00170339 0.00159862 0.06876012 2.39980200 0.06437788 0.06009255 0.01313595 0.03646035 0.03209570 0.00194832 0.02219717 0.01313196 -0.00003097 0.00602764 0.00257047 0.01568415 0.03129919 0.00194690 0.06056836 -0.01134823 0.06146827 0.05861913 0.00196721 0.00748348 0.00763826</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="dipole.moment" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="cc:dipole" size="3">86.46713390 -86.85464670 -158.23579788</array>
                  <scalar dataType="xsd:double" dictRef="x:dipole">180.505671</scalar>
               </module>
               <module cmlx:templateRef="quadrupole.moment" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">-288.11356550 1126.44851350 2094.10956361 1466.16469428 -2061.53841015 -1178.05112877</array>
               </module>
               <module cmlx:templateRef="s2" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="cc:s2">42.00000000</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:s2expected">42.05624775</scalar>
               </module>
               <module cmlx:templateRef="orbital.energies.spin.zora"
                       dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="energies" dictRef="energies">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="5226">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413 414 415 416 417 418 419 420 421 422 423 424 425 426 427 428 429 430 431 432 433 434 435 436 437 438 439 440 441 442 443 444 445 446 447 448 449 450 451 452 453 454 455 456 457 458 459 460 461 462 463 464 465 466 467 468 469 470 471 472 473 474 475 476 477 478 479 480 481 482 483 484 485 486 487 488 489 490 491 492 493 494 495 496 497 498 499 500 501 502 503 504 505 506 507 508 509 510 511 512 513 514 515 516 517 518 519 520 521 522 523 524 525 526 527 528 529 530 531 532 533 534 535 536 537 538 539 540 541 542 543 544 545 546 547 548 549 550 551 552 553 554 555 556 557 558 559 560 561 562 563 564 565 566 567 568 569 570 571 572 573 574 575 576 577 578 579 580 581 582 583 584 585 586 587 588 589 590 591 592 593 594 595 596 597 598 599 600 601 602 603 604 605 606 607 608 609 610 611 612 613 614 615 616 617 618 619 620 621 622 623 624 625 626 627 628 629 630 631 632 633 634 635 636 637 638 639 640 641 642 643 644 645 646 647 648 649 650 651 652 653 654 655 656 657 658 659 660 661 662 663 664 665 666 667 668 669 670 671 672 673 674 675 676 677 678 679 680 681 682 683 684 685 686 687 688 689 690 691 692 693 694 695 696 697 698 699 700 701 702 703 704 705 706 707 708 709 710 711 712 713 714 715 716 717 718 719 720 721 722 723 724 725 726 727 728 729 730 731 732 733 734 735 736 737 738 739 740 741 742 743 744 745 746 747 748 749 750 751 752 753 754 755 756 757 758 759 760 761 762 763 764 765 766 767 768 769 770 771 772 773 774 775 776 777 778 779 780 781 782 783 784 785 786 787 788 789 790 791 792 793 794 795 796 797 798 799 800 801 802 803 804 805 806 807 808 809 810 811 812 813 814 815 816 817 818 819 820 821 822 823 824 825 826 827 828 829 830 831 832 833 834 835 836 837 838 839 840 841 842 843 844 845 846 847 848 849 850 851 852 853 854 855 856 857 858 859 860 861 862 863 864 865 866 867 868 869 870 871 872 873 874 875 876 877 878 879 880 881 882 883 884 885 886 887 888 889 890 891 892 893 894 895 896 897 898 899 900 901 902 903 904 905 906 907 908 909 910 911 912 913 914 915 916 917 918 919 920 921 922 923 924 925 926 927 928 929 930 931 932 933 934 935 936 937 938 939 940 941 942 943 944 945 946 947 948 949 950 951 952 953 954 955 956 957 958 959 960 961 962 963 964 965 966 967 968 969 970 971 972 973 974 975 976 977 978 979 980 981 982 983 984 985 986 987 988 989 990 991 992 993 994 995 996 997 998 999 1000 1001 1002 1003 1004 1005 1006 1007 1008 1009 1010 1011 1012 1013 1014 1015 1016 1017 1018 1019 1020 1021 1022 1023 1024 1025 1026 1027 1028 1029 1030 1031 1032 1033 1034 1035 1036 1037 1038 1039 1040 1041 1042 1043 1044 1045 1046 1047 1048 1049 1050 1051 1052 1053 1054 1055 1056 1057 1058 1059 1060 1061 1062 1063 1064 1065 1066 1067 1068 1069 1070 1071 1072 1073 1074 1075 1076 1077 1078 1079 1080 1081 1082 1083 1084 1085 1086 1087 1088 1089 1090 1091 1092 1093 1094 1095 1096 1097 1098 1099 1100 1101 1102 1103 1104 1105 1106 1107 1108 1109 1110 1111 1112 1113 1114 1115 1116 1117 1118 1119 1120 1121 1122 1123 1124 1125 1126 1127 1128 1129 1130 1131 1132 1133 1134 1135 1136 1137 1138 1139 1140 1141 1142 1143 1144 1145 1146 1147 1148 1149 1150 1151 1152 1153 1154 1155 1156 1157 1158 1159 1160 1161 1162 1163 1164 1165 1166 1167 1168 1169 1170 1171 1172 1173 1174 1175 1176 1177 1178 1179 1180 1181 1182 1183 1184 1185 1186 1187 1188 1189 1190 1191 1192 1193 1194 1195 1196 1197 1198 1199 1200 1201 1202 1203 1204 1205 1206 1207 1208 1209 1210 1211 1212 1213 1214 1215 1216 1217 1218 1219 1220 1221 1222 1223 1224 1225 1226 1227 1228 1229 1230 1231 1232 1233 1234 1235 1236 1237 1238 1239 1240 1241 1242 1243 1244 1245 1246 1247 1248 1249 1250 1251 1252 1253 1254 1255 1256 1257 1258 1259 1260 1261 1262 1263 1264 1265 1266 1267 1268 1269 1270 1271 1272 1273 1274 1275 1276 1277 1278 1279 1280 1281 1282 1283 1284 1285 1286 1287 1288 1289 1290 1291 1292 1293 1294 1295 1296 1297 1298 1299 1300 1301 1302 1303 1304 1305 1306 1307 1308 1309 1310 1311 1312 1313 1314 1315 1316 1317 1318 1319 1320 1321 1322 1323 1324 1325 1326 1327 1328 1329 1330 1331 1332 1333 1334 1335 1336 1337 1338 1339 1340 1341 1342 1343 1344 1345 1346 1347 1348 1349 1350 1351 1352 1353 1354 1355 1356 1357 1358 1359 1360 1361 1362 1363 1364 1365 1366 1367 1368 1369 1370 1371 1372 1373 1374 1375 1376 1377 1378 1379 1380 1381 1382 1383 1384 1385 1386 1387 1388 1389 1390 1391 1392 1393 1394 1395 1396 1397 1398 1399 1400 1401 1402 1403 1404 1405 1406 1407 1408 1409 1410 1411 1412 1413 1414 1415 1416 1417 1418 1419 1420 1421 1422 1423 1424 1425 1426 1427 1428 1429 1430 1431 1432 1433 1434 1435 1436 1437 1438 1439 1440 1441 1442 1443 1444 1445 1446 1447 1448 1449 1450 1451 1452 1453 1454 1455 1456 1457 1458 1459 1460 1461 1462 1463 1464 1465 1466 1467 1468 1469 1470 1471 1472 1473 1474 1475 1476 1477 1478 1479 1480 1481 1482 1483 1484 1485 1486 1487 1488 1489 1490 1491 1492 1493 1494 1495 1496 1497 1498 1499 1500 1501 1502 1503 1504 1505 1506 1507 1508 1509 1510 1511 1512 1513 1514 1515 1516 1517 1518 1519 1520 1521 1522 1523 1524 1525 1526 1527 1528 1529 1530 1531 1532 1533 1534 1535 1536 1537 1538 1539 1540 1541 1542 1543 1544 1545 1546 1547 1548 1549 1550 1551 1552 1553 1554 1555 1556 1557 1558 1559 1560 1561 1562 1563 1564 1565 1566 1567 1568 1569 1570 1571 1572 1573 1574 1575 1576 1577 1578 1579 1580 1581 1582 1583 1584 1585 1586 1587 1588 1589 1590 1591 1592 1593 1594 1595 1596 1597 1598 1599 1600 1601 1602 1603 1604 1605 1606 1607 1608 1609 1610 1611 1612 1613 1614 1615 1616 1617 1618 1619 1620 1621 1622 1623 1624 1625 1626 1627 1628 1629 1630 1631 1632 1633 1634 1635 1636 1637 1638 1639 1640 1641 1642 1643 1644 1645 1646 1647 1648 1649 1650 1651 1652 1653 1654 1655 1656 1657 1658 1659 1660 1661 1662 1663 1664 1665 1666 1667 1668 1669 1670 1671 1672 1673 1674 1675 1676 1677 1678 1679 1680 1681 1682 1683 1684 1685 1686 1687 1688 1689 1690 1691 1692 1693 1694 1695 1696 1697 1698 1699 1700 1701 1702 1703 1704 1705 1706 1707 1708 1709 1710 1711 1712 1713 1714 1715 1716 1717 1718 1719 1720 1721 1722 1723 1724 1725 1726 1727 1728 1729 1730 1731 1732 1733 1734 1735 1736 1737 1738 1739 1740 1741 1742 1743 1744 1745 1746 1747 1748 1749 1750 1751 1752 1753 1754 1755 1756 1757 1758 1759 1760 1761 1762 1763 1764 1765 1766 1767 1768 1769 1770 1771 1772 1773 1774 1775 1776 1777 1778 1779 1780 1781 1782 1783 1784 1785 1786 1787 1788 1789 1790 1791 1792 1793 1794 1795 1796 1797 1798 1799 1800 1801 1802 1803 1804 1805 1806 1807 1808 1809 1810 1811 1812 1813 1814 1815 1816 1817 1818 1819 1820 1821 1822 1823 1824 1825 1826 1827 1828 1829 1830 1831 1832 1833 1834 1835 1836 1837 1838 1839 1840 1841 1842 1843 1844 1845 1846 1847 1848 1849 1850 1851 1852 1853 1854 1855 1856 1857 1858 1859 1860 1861 1862 1863 1864 1865 1866 1867 1868 1869 1870 1871 1872 1873 1874 1875 1876 1877 1878 1879 1880 1881 1882 1883 1884 1885 1886 1887 1888 1889 1890 1891 1892 1893 1894 1895 1896 1897 1898 1899 1900 1901 1902 1903 1904 1905 1906 1907 1908 1909 1910 1911 1912 1913 1914 1915 1916 1917 1918 1919 1920 1921 1922 1923 1924 1925 1926 1927 1928 1929 1930 1931 1932 1933 1934 1935 1936 1937 1938 1939 1940 1941 1942 1943 1944 1945 1946 1947 1948 1949 1950 1951 1952 1953 1954 1955 1956 1957 1958 1959 1960 1961 1962 1963 1964 1965 1966 1967 1968 1969 1970 1971 1972 1973 1974 1975 1976 1977 1978 1979 1980 1981 1982 1983 1984 1985 1986 1987 1988 1989 1990 1991 1992 1993 1994 1995 1996 1997 1998 1999 2000 2001 2002 2003 2004 2005 2006 2007 2008 2009 2010 2011 2012 2013 2014 2015 2016 2017 2018 2019 2020 2021 2022 2023 2024 2025 2026 2027 2028 2029 2030 2031 2032 2033 2034 2035 2036 2037 2038 2039 2040 2041 2042 2043 2044 2045 2046 2047 2048 2049 2050 2051 2052 2053 2054 2055 2056 2057 2058 2059 2060 2061 2062 2063 2064 2065 2066 2067 2068 2069 2070 2071 2072 2073 2074 2075 2076 2077 2078 2079 2080 2081 2082 2083 2084 2085 2086 2087 2088 2089 2090 2091 2092 2093 2094 2095 2096 2097 2098 2099 2100 2101 2102 2103 2104 2105 2106 2107 2108 2109 2110 2111 2112 2113 2114 2115 2116 2117 2118 2119 2120 2121 2122 2123 2124 2125 2126 2127 2128 2129 2130 2131 2132 2133 2134 2135 2136 2137 2138 2139 2140 2141 2142 2143 2144 2145 2146 2147 2148 2149 2150 2151 2152 2153 2154 2155 2156 2157 2158 2159 2160 2161 2162 2163 2164 2165 2166 2167 2168 2169 2170 2171 2172 2173 2174 2175 2176 2177 2178 2179 2180 2181 2182 2183 2184 2185 2186 2187 2188 2189 2190 2191 2192 2193 2194 2195 2196 2197 2198 2199 2200 2201 2202 2203 2204 2205 2206 2207 2208 2209 2210 2211 2212 2213 2214 2215 2216 2217 2218 2219 2220 2221 2222 2223 2224 2225 2226 2227 2228 2229 2230 2231 2232 2233 2234 2235 2236 2237 2238 2239 2240 2241 2242 2243 2244 2245 2246 2247 2248 2249 2250 2251 2252 2253 2254 2255 2256 2257 2258 2259 2260 2261 2262 2263 2264 2265 2266 2267 2268 2269 2270 2271 2272 2273 2274 2275 2276 2277 2278 2279 2280 2281 2282 2283 2284 2285 2286 2287 2288 2289 2290 2291 2292 2293 2294 2295 2296 2297 2298 2299 2300 2301 2302 2303 2304 2305 2306 2307 2308 2309 2310 2311 2312 2313 2314 2315 2316 2317 2318 2319 2320 2321 2322 2323 2324 2325 2326 2327 2328 2329 2330 2331 2332 2333 2334 2335 2336 2337 2338 2339 2340 2341 2342 2343 2344 2345 2346 2347 2348 2349 2350 2351 2352 2353 2354 2355 2356 2357 2358 2359 2360 2361 2362 2363 2364 2365 2366 2367 2368 2369 2370 2371 2372 2373 2374 2375 2376 2377 2378 2379 2380 2381 2382 2383 2384 2385 2386 2387 2388 2389 2390 2391 2392 2393 2394 2395 2396 2397 2398 2399 2400 2401 2402 2403 2404 2405 2406 2407 2408 2409 2410 2411 2412 2413 2414 2415 2416 2417 2418 2419 2420 2421 2422 2423 2424 2425 2426 2427 2428 2429 2430 2431 2432 2433 2434 2435 2436 2437 2438 2439 2440 2441 2442 2443 2444 2445 2446 2447 2448 2449 2450 2451 2452 2453 2454 2455 2456 2457 2458 2459 2460 2461 2462 2463 2464 2465 2466 2467 2468 2469 2470 2471 2472 2473 2474 2475 2476 2477 2478 2479 2480 2481 2482 2483 2484 2485 2486 2487 2488 2489 2490 2491 2492 2493 2494 2495 2496 2497 2498 2499 2500 2501 2502 2503 2504 2505 2506 2507 2508 2509 2510 2511 2512 2513 2514 2515 2516 2517 2518 2519 2520 2521 2522 2523 2524 2525 2526 2527 2528 2529 2530 2531 2532 2533 2534 2535 2536 2537 2538 2539 2540 2541 2542 2543 2544 2545 2546 2547 2548 2549 2550 2551 2552 2553 2554 2555 2556 2557 2558 2559 2560 2561 2562 2563 2564 2565 2566 2567 2568 2569 2570 2571 2572 2573 2574 2575 2576 2577 2578 2579 2580 2581 2582 2583 2584 2585 2586 2587 2588 2589 2590 2591 2592 2593 2594 2595 2596 2597 2598 2599 2600 2601 2602 2603 2604 2605 2606 2607 2608 2609 2610 2611 2612 2613 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 184 185 186 187 188 189 190 191 192 193 194 195 196 197 198 199 200 201 202 203 204 205 206 207 208 209 210 211 212 213 214 215 216 217 218 219 220 221 222 223 224 225 226 227 228 229 230 231 232 233 234 235 236 237 238 239 240 241 242 243 244 245 246 247 248 249 250 251 252 253 254 255 256 257 258 259 260 261 262 263 264 265 266 267 268 269 270 271 272 273 274 275 276 277 278 279 280 281 282 283 284 285 286 287 288 289 290 291 292 293 294 295 296 297 298 299 300 301 302 303 304 305 306 307 308 309 310 311 312 313 314 315 316 317 318 319 320 321 322 323 324 325 326 327 328 329 330 331 332 333 334 335 336 337 338 339 340 341 342 343 344 345 346 347 348 349 350 351 352 353 354 355 356 357 358 359 360 361 362 363 364 365 366 367 368 369 370 371 372 373 374 375 376 377 378 379 380 381 382 383 384 385 386 387 388 389 390 391 392 393 394 395 396 397 398 399 400 401 402 403 404 405 406 407 408 409 410 411 412 413 414 415 416 417 418 419 420 421 422 423 424 425 426 427 428 429 430 431 432 433 434 435 436 437 438 439 440 441 442 443 444 445 446 447 448 449 450 451 452 453 454 455 456 457 458 459 460 461 462 463 464 465 466 467 468 469 470 471 472 473 474 475 476 477 478 479 480 481 482 483 484 485 486 487 488 489 490 491 492 493 494 495 496 497 498 499 500 501 502 503 504 505 506 507 508 509 510 511 512 513 514 515 516 517 518 519 520 521 522 523 524 525 526 527 528 529 530 531 532 533 534 535 536 537 538 539 540 541 542 543 544 545 546 547 548 549 550 551 552 553 554 555 556 557 558 559 560 561 562 563 564 565 566 567 568 569 570 571 572 573 574 575 576 577 578 579 580 581 582 583 584 585 586 587 588 589 590 591 592 593 594 595 596 597 598 599 600 601 602 603 604 605 606 607 608 609 610 611 612 613 614 615 616 617 618 619 620 621 622 623 624 625 626 627 628 629 630 631 632 633 634 635 636 637 638 639 640 641 642 643 644 645 646 647 648 649 650 651 652 653 654 655 656 657 658 659 660 661 662 663 664 665 666 667 668 669 670 671 672 673 674 675 676 677 678 679 680 681 682 683 684 685 686 687 688 689 690 691 692 693 694 695 696 697 698 699 700 701 702 703 704 705 706 707 708 709 710 711 712 713 714 715 716 717 718 719 720 721 722 723 724 725 726 727 728 729 730 731 732 733 734 735 736 737 738 739 740 741 742 743 744 745 746 747 748 749 750 751 752 753 754 755 756 757 758 759 760 761 762 763 764 765 766 767 768 769 770 771 772 773 774 775 776 777 778 779 780 781 782 783 784 785 786 787 788 789 790 791 792 793 794 795 796 797 798 799 800 801 802 803 804 805 806 807 808 809 810 811 812 813 814 815 816 817 818 819 820 821 822 823 824 825 826 827 828 829 830 831 832 833 834 835 836 837 838 839 840 841 842 843 844 845 846 847 848 849 850 851 852 853 854 855 856 857 858 859 860 861 862 863 864 865 866 867 868 869 870 871 872 873 874 875 876 877 878 879 880 881 882 883 884 885 886 887 888 889 890 891 892 893 894 895 896 897 898 899 900 901 902 903 904 905 906 907 908 909 910 911 912 913 914 915 916 917 918 919 920 921 922 923 924 925 926 927 928 929 930 931 932 933 934 935 936 937 938 939 940 941 942 943 944 945 946 947 948 949 950 951 952 953 954 955 956 957 958 959 960 961 962 963 964 965 966 967 968 969 970 971 972 973 974 975 976 977 978 979 980 981 982 983 984 985 986 987 988 989 990 991 992 993 994 995 996 997 998 999 1000 1001 1002 1003 1004 1005 1006 1007 1008 1009 1010 1011 1012 1013 1014 1015 1016 1017 1018 1019 1020 1021 1022 1023 1024 1025 1026 1027 1028 1029 1030 1031 1032 1033 1034 1035 1036 1037 1038 1039 1040 1041 1042 1043 1044 1045 1046 1047 1048 1049 1050 1051 1052 1053 1054 1055 1056 1057 1058 1059 1060 1061 1062 1063 1064 1065 1066 1067 1068 1069 1070 1071 1072 1073 1074 1075 1076 1077 1078 1079 1080 1081 1082 1083 1084 1085 1086 1087 1088 1089 1090 1091 1092 1093 1094 1095 1096 1097 1098 1099 1100 1101 1102 1103 1104 1105 1106 1107 1108 1109 1110 1111 1112 1113 1114 1115 1116 1117 1118 1119 1120 1121 1122 1123 1124 1125 1126 1127 1128 1129 1130 1131 1132 1133 1134 1135 1136 1137 1138 1139 1140 1141 1142 1143 1144 1145 1146 1147 1148 1149 1150 1151 1152 1153 1154 1155 1156 1157 1158 1159 1160 1161 1162 1163 1164 1165 1166 1167 1168 1169 1170 1171 1172 1173 1174 1175 1176 1177 1178 1179 1180 1181 1182 1183 1184 1185 1186 1187 1188 1189 1190 1191 1192 1193 1194 1195 1196 1197 1198 1199 1200 1201 1202 1203 1204 1205 1206 1207 1208 1209 1210 1211 1212 1213 1214 1215 1216 1217 1218 1219 1220 1221 1222 1223 1224 1225 1226 1227 1228 1229 1230 1231 1232 1233 1234 1235 1236 1237 1238 1239 1240 1241 1242 1243 1244 1245 1246 1247 1248 1249 1250 1251 1252 1253 1254 1255 1256 1257 1258 1259 1260 1261 1262 1263 1264 1265 1266 1267 1268 1269 1270 1271 1272 1273 1274 1275 1276 1277 1278 1279 1280 1281 1282 1283 1284 1285 1286 1287 1288 1289 1290 1291 1292 1293 1294 1295 1296 1297 1298 1299 1300 1301 1302 1303 1304 1305 1306 1307 1308 1309 1310 1311 1312 1313 1314 1315 1316 1317 1318 1319 1320 1321 1322 1323 1324 1325 1326 1327 1328 1329 1330 1331 1332 1333 1334 1335 1336 1337 1338 1339 1340 1341 1342 1343 1344 1345 1346 1347 1348 1349 1350 1351 1352 1353 1354 1355 1356 1357 1358 1359 1360 1361 1362 1363 1364 1365 1366 1367 1368 1369 1370 1371 1372 1373 1374 1375 1376 1377 1378 1379 1380 1381 1382 1383 1384 1385 1386 1387 1388 1389 1390 1391 1392 1393 1394 1395 1396 1397 1398 1399 1400 1401 1402 1403 1404 1405 1406 1407 1408 1409 1410 1411 1412 1413 1414 1415 1416 1417 1418 1419 1420 1421 1422 1423 1424 1425 1426 1427 1428 1429 1430 1431 1432 1433 1434 1435 1436 1437 1438 1439 1440 1441 1442 1443 1444 1445 1446 1447 1448 1449 1450 1451 1452 1453 1454 1455 1456 1457 1458 1459 1460 1461 1462 1463 1464 1465 1466 1467 1468 1469 1470 1471 1472 1473 1474 1475 1476 1477 1478 1479 1480 1481 1482 1483 1484 1485 1486 1487 1488 1489 1490 1491 1492 1493 1494 1495 1496 1497 1498 1499 1500 1501 1502 1503 1504 1505 1506 1507 1508 1509 1510 1511 1512 1513 1514 1515 1516 1517 1518 1519 1520 1521 1522 1523 1524 1525 1526 1527 1528 1529 1530 1531 1532 1533 1534 1535 1536 1537 1538 1539 1540 1541 1542 1543 1544 1545 1546 1547 1548 1549 1550 1551 1552 1553 1554 1555 1556 1557 1558 1559 1560 1561 1562 1563 1564 1565 1566 1567 1568 1569 1570 1571 1572 1573 1574 1575 1576 1577 1578 1579 1580 1581 1582 1583 1584 1585 1586 1587 1588 1589 1590 1591 1592 1593 1594 1595 1596 1597 1598 1599 1600 1601 1602 1603 1604 1605 1606 1607 1608 1609 1610 1611 1612 1613 1614 1615 1616 1617 1618 1619 1620 1621 1622 1623 1624 1625 1626 1627 1628 1629 1630 1631 1632 1633 1634 1635 1636 1637 1638 1639 1640 1641 1642 1643 1644 1645 1646 1647 1648 1649 1650 1651 1652 1653 1654 1655 1656 1657 1658 1659 1660 1661 1662 1663 1664 1665 1666 1667 1668 1669 1670 1671 1672 1673 1674 1675 1676 1677 1678 1679 1680 1681 1682 1683 1684 1685 1686 1687 1688 1689 1690 1691 1692 1693 1694 1695 1696 1697 1698 1699 1700 1701 1702 1703 1704 1705 1706 1707 1708 1709 1710 1711 1712 1713 1714 1715 1716 1717 1718 1719 1720 1721 1722 1723 1724 1725 1726 1727 1728 1729 1730 1731 1732 1733 1734 1735 1736 1737 1738 1739 1740 1741 1742 1743 1744 1745 1746 1747 1748 1749 1750 1751 1752 1753 1754 1755 1756 1757 1758 1759 1760 1761 1762 1763 1764 1765 1766 1767 1768 1769 1770 1771 1772 1773 1774 1775 1776 1777 1778 1779 1780 1781 1782 1783 1784 1785 1786 1787 1788 1789 1790 1791 1792 1793 1794 1795 1796 1797 1798 1799 1800 1801 1802 1803 1804 1805 1806 1807 1808 1809 1810 1811 1812 1813 1814 1815 1816 1817 1818 1819 1820 1821 1822 1823 1824 1825 1826 1827 1828 1829 1830 1831 1832 1833 1834 1835 1836 1837 1838 1839 1840 1841 1842 1843 1844 1845 1846 1847 1848 1849 1850 1851 1852 1853 1854 1855 1856 1857 1858 1859 1860 1861 1862 1863 1864 1865 1866 1867 1868 1869 1870 1871 1872 1873 1874 1875 1876 1877 1878 1879 1880 1881 1882 1883 1884 1885 1886 1887 1888 1889 1890 1891 1892 1893 1894 1895 1896 1897 1898 1899 1900 1901 1902 1903 1904 1905 1906 1907 1908 1909 1910 1911 1912 1913 1914 1915 1916 1917 1918 1919 1920 1921 1922 1923 1924 1925 1926 1927 1928 1929 1930 1931 1932 1933 1934 1935 1936 1937 1938 1939 1940 1941 1942 1943 1944 1945 1946 1947 1948 1949 1950 1951 1952 1953 1954 1955 1956 1957 1958 1959 1960 1961 1962 1963 1964 1965 1966 1967 1968 1969 1970 1971 1972 1973 1974 1975 1976 1977 1978 1979 1980 1981 1982 1983 1984 1985 1986 1987 1988 1989 1990 1991 1992 1993 1994 1995 1996 1997 1998 1999 2000 2001 2002 2003 2004 2005 2006 2007 2008 2009 2010 2011 2012 2013 2014 2015 2016 2017 2018 2019 2020 2021 2022 2023 2024 2025 2026 2027 2028 2029 2030 2031 2032 2033 2034 2035 2036 2037 2038 2039 2040 2041 2042 2043 2044 2045 2046 2047 2048 2049 2050 2051 2052 2053 2054 2055 2056 2057 2058 2059 2060 2061 2062 2063 2064 2065 2066 2067 2068 2069 2070 2071 2072 2073 2074 2075 2076 2077 2078 2079 2080 2081 2082 2083 2084 2085 2086 2087 2088 2089 2090 2091 2092 2093 2094 2095 2096 2097 2098 2099 2100 2101 2102 2103 2104 2105 2106 2107 2108 2109 2110 2111 2112 2113 2114 2115 2116 2117 2118 2119 2120 2121 2122 2123 2124 2125 2126 2127 2128 2129 2130 2131 2132 2133 2134 2135 2136 2137 2138 2139 2140 2141 2142 2143 2144 2145 2146 2147 2148 2149 2150 2151 2152 2153 2154 2155 2156 2157 2158 2159 2160 2161 2162 2163 2164 2165 2166 2167 2168 2169 2170 2171 2172 2173 2174 2175 2176 2177 2178 2179 2180 2181 2182 2183 2184 2185 2186 2187 2188 2189 2190 2191 2192 2193 2194 2195 2196 2197 2198 2199 2200 2201 2202 2203 2204 2205 2206 2207 2208 2209 2210 2211 2212 2213 2214 2215 2216 2217 2218 2219 2220 2221 2222 2223 2224 2225 2226 2227 2228 2229 2230 2231 2232 2233 2234 2235 2236 2237 2238 2239 2240 2241 2242 2243 2244 2245 2246 2247 2248 2249 2250 2251 2252 2253 2254 2255 2256 2257 2258 2259 2260 2261 2262 2263 2264 2265 2266 2267 2268 2269 2270 2271 2272 2273 2274 2275 2276 2277 2278 2279 2280 2281 2282 2283 2284 2285 2286 2287 2288 2289 2290 2291 2292 2293 2294 2295 2296 2297 2298 2299 2300 2301 2302 2303 2304 2305 2306 2307 2308 2309 2310 2311 2312 2313 2314 2315 2316 2317 2318 2319 2320 2321 2322 2323 2324 2325 2326 2327 2328 2329 2330 2331 2332 2333 2334 2335 2336 2337 2338 2339 2340 2341 2342 2343 2344 2345 2346 2347 2348 2349 2350 2351 2352 2353 2354 2355 2356 2357 2358 2359 2360 2361 2362 2363 2364 2365 2366 2367 2368 2369 2370 2371 2372 2373 2374 2375 2376 2377 2378 2379 2380 2381 2382 2383 2384 2385 2386 2387 2388 2389 2390 2391 2392 2393 2394 2395 2396 2397 2398 2399 2400 2401 2402 2403 2404 2405 2406 2407 2408 2409 2410 2411 2412 2413 2414 2415 2416 2417 2418 2419 2420 2421 2422 2423 2424 2425 2426 2427 2428 2429 2430 2431 2432 2433 2434 2435 2436 2437 2438 2439 2440 2441 2442 2443 2444 2445 2446 2447 2448 2449 2450 2451 2452 2453 2454 2455 2456 2457 2458 2459 2460 2461 2462 2463 2464 2465 2466 2467 2468 2469 2470 2471 2472 2473 2474 2475 2476 2477 2478 2479 2480 2481 2482 2483 2484 2485 2486 2487 2488 2489 2490 2491 2492 2493 2494 2495 2496 2497 2498 2499 2500 2501 2502 2503 2504 2505 2506 2507 2508 2509 2510 2511 2512 2513 2514 2515 2516 2517 2518 2519 2520 2521 2522 2523 2524 2525 2526 2527 2528 2529 2530 2531 2532 2533 2534 2535 2536 2537 2538 2539 2540 2541 2542 2543 2544 2545 2546 2547 2548 2549 2550 2551 2552 2553 2554 2555 2556 2557 2558 2559 2560 2561 2562 2563 2564 2565 2566 2567 2568 2569 2570 2571 2572 2573 2574 2575 2576 2577 2578 2579 2580 2581 2582 2583 2584 2585 2586 2587 2588 2589 2590 2591 2592 2593 2594 2595 2596 2597 2598 2599 2600 2601 2602 2603 2604 2605 2606 2607 2608 2609 2610 2611 2612 2613</array>
                     <array dataType="xsd:double" dictRef="cc:occup" size="5226">1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 1.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000 0.00000000</array>
                     <array dataType="xsd:double"
                            dictRef="cc:energy"
                            size="5226"
                            units="nonsi:electronvolt">-175.329106 -175.328026 -125.710393 -125.709305 -125.696312 -125.695288 -125.692311 -125.691134 -79.905891 -79.905095 -79.904671 -79.903328 -79.826206 -79.824633 -79.821133 -79.819574 -79.818785 -79.817148 -79.815015 -79.813404 -79.770957 -79.770321 -79.770043 -79.769325 -79.766221 -79.765492 -79.765485 -79.764913 -73.167881 -73.167488 -73.165141 -73.163277 -45.456347 -45.454157 -45.440808 -45.438028 -45.433099 -45.419701 -45.414439 -45.413224 -45.373159 -45.371473 -45.370156 -45.368667 -44.745574 -44.744930 -44.743728 -44.743147 -44.675652 -44.670443 -44.659198 -44.655139 -44.654786 -44.649564 -44.636550 -44.632499 -44.614971 -44.614258 -44.609493 -44.608782 -44.603952 -44.603849 -44.599942 -44.599713 -44.575152 -44.573922 -44.568971 -44.567875 -44.557187 -44.555495 -44.548367 -44.546880 -44.504758 -44.500116 -44.500090 -44.496578 -44.479330 -44.476276 -44.474608 -44.471830 -44.455139 -44.450774 -44.448056 -44.447311 -44.443322 -44.442093 -44.440528 -44.438734 -44.438036 -44.435561 -44.432407 -44.432380 -44.427053 -44.423051 -44.419101 -44.418238 -44.409796 -44.409008 -44.392356 -44.391738 -44.375567 -44.374487 -44.367668 -44.366706 -34.862320 -34.861416 -34.861125 -34.859721 -34.838610 -34.837717 -34.837486 -34.837233 -34.836357 -34.836131 -34.836006 -34.834634 -34.830143 -34.829264 -34.829027 -34.827510 -34.824161 -34.823244 -34.822975 -34.822436 -34.821517 -34.821547 -34.821336 -34.819854 -34.816541 -34.815725 -34.815526 -34.813906 -34.785688 -34.783597 -34.780713 -34.778614 -34.777258 -34.775151 -34.773631 -34.771539 -34.765974 -34.764017 -34.761156 -34.759200 -34.758426 -34.756337 -34.754855 -34.752788 -34.751316 -34.750662 -34.749357 -34.747795 -34.746164 -34.745532 -34.745436 -34.744956 -34.744855 -34.744160 -34.744056 -34.743387 -34.742746 -34.741664 -34.741588 -34.741132 -34.741093 -34.740214 -34.739733 -34.739414 -34.739372 -34.739149 -34.738400 -34.737798 -34.737089 -34.736205 -34.735694 -34.735506 -34.735114 -34.734901 -34.734543 -34.734024 -34.733421 -34.732341 -34.732067 -34.731460 -34.730868 -34.730015 -34.729902 -34.729364 -34.728999 -34.728554 -34.728590 -34.728099 -34.726999 -34.726551 -34.725673 -34.724901 -34.713513 -34.712696 -34.712025 -34.711146 -34.710279 -34.709764 -34.708805 -34.708347 -34.698183 -34.697843 -34.697185 -34.696629 -34.693018 -34.692408 -34.692213 -34.692123 -34.691646 -34.691492 -34.691392 -34.691146 -34.689799 -34.689259 -34.688928 -34.688821 -34.688316 -34.687924 -34.687930 -34.687598 -34.687148 -34.687033 -34.686806 -34.686228 -34.684386 -34.684033 -34.683683 -34.683563 -34.683233 -34.682930 -34.682818 -34.682123 -34.681283 -34.680539 -34.680365 -34.679497 -34.676647 -34.675953 -34.675818 -34.675229 -26.918979 -26.916674 -24.612161 -24.611186 -24.575979 -24.575116 -24.502224 -24.498868 -23.728040 -23.725638 -23.455904 -23.453657 -23.438131 -23.425560 -23.362694 -23.360552 -23.359486 -23.357434 -23.228227 -23.226436 -23.159891 -23.157169 -23.156375 -23.153927 -23.064615 -23.062637 -22.944148 -22.943935 -22.865317 -22.860783 -22.838654 -22.836652 -22.694048 -22.689914 -22.687315 -22.685769 -22.675151 -22.674607 -22.633096 -22.631348 -22.612088 -22.610104 -22.469506 -22.469265 -22.468141 -22.467557 -22.459982 -22.457906 -22.440227 -22.439549 -22.407394 -22.403833 -22.402969 -22.399556 -22.385264 -22.381598 -22.378833 -22.375373 -22.359921 -22.358504 -22.353639 -22.353373 -22.351043 -22.350984 -22.341448 -22.341039 -22.339412 -22.336726 -22.313857 -22.306311 -22.276180 -22.274341 -22.200556 -22.167657 -22.161982 -22.080136 -22.079123 -22.018339 -22.016257 -14.673323 -14.669958 -12.528462 -12.516757 -12.413332 -12.412487 -12.410488 -12.392961 -12.087219 -12.084995 -12.024300 -12.022322 -11.727849 -11.724920 -11.686528 -11.679715 -11.397527 -11.396154 -11.304877 -11.300096 -11.274839 -11.273040 -11.249515 -11.248065 -11.143987 -11.143052 -11.119812 -11.114047 -10.998404 -10.985726 -10.912090 -10.910186 -10.901018 -10.884948 -10.829569 -10.744795 -10.738397 -10.735726 -10.703907 -10.691221 -10.622146 -10.615037 -10.596260 -10.550954 -10.497335 -10.495344 -10.444344 -10.437118 -10.388006 -10.386267 -10.316180 -10.313865 -10.186605 -10.165473 -10.094387 -9.935899 -9.928479 -9.926650 -9.918937 -9.874134 -9.873555 -9.870498 -9.861529 -9.843425 -9.838423 -9.826675 -9.776648 -9.752072 -9.746345 -9.722571 -9.721516 -9.666994 -9.616132 -9.579980 -9.570757 -9.568257 -9.550925 -9.540720 -9.534151 -9.412216 -9.409462 -9.370342 -9.368545 -9.347421 -9.345883 -9.338908 -9.324094 -9.312250 -9.304615 -9.292573 -9.292197 -9.280264 -9.269559 -9.247060 -9.241823 -9.208922 -9.202202 -9.201356 -9.198344 -9.184383 -9.152367 -9.144761 -9.125249 -9.040289 -9.018493 -9.009426 -9.006411 -8.999208 -8.981409 -8.966035 -8.959480 -8.948981 -8.944947 -8.943375 -8.941502 -8.930130 -8.925954 -8.816322 -8.802839 -8.769496 -8.768292 -8.700699 -8.663601 -8.663262 -8.632384 -8.630746 -8.620684 -8.615615 -8.609119 -8.594333 -8.591412 -8.540362 -8.537412 -8.513886 -8.484887 -8.449022 -8.432212 -8.387297 -8.366670 -8.343112 -8.334778 -8.320212 -8.311777 -8.305299 -8.290942 -8.222962 -8.214693 -8.185644 -8.179053 -8.138989 -8.127546 -8.120283 -8.118681 -8.101132 -8.092656 -7.976896 -7.927659 -7.914723 -7.875641 -7.873316 -7.848524 -7.832328 -7.776750 -7.773216 -7.772115 -7.736534 -7.693405 -7.628090 -7.581733 -7.561577 -7.536982 -7.526282 -7.474484 -7.463068 -7.450971 -7.388414 -7.387525 -7.378276 -7.355608 -7.319782 -7.305329 -7.245769 -7.234213 -7.229202 -7.179493 -7.066989 -7.060035 -7.045208 -7.031754 -7.030295 -7.024882 -7.019823 -6.961941 -6.953079 -6.937617 -6.918204 -6.901148 -6.881437 -6.874618 -6.859492 -6.854957 -6.847795 -6.846599 -6.842395 -6.815146 -6.805261 -6.804461 -6.793262 -6.767809 -6.767051 -6.762046 -6.743008 -6.729812 -6.723963 -6.719088 -6.712427 -6.700570 -6.678728 -6.675402 -6.657830 -6.656439 -6.528094 -6.526234 -6.475922 -6.457274 -6.454810 -6.449666 -6.407745 -6.402457 -6.326675 -6.324419 -6.280255 -6.278802 -6.147409 -6.145235 -6.000026 -5.998690 -4.985674 -4.937773 -4.937295 -4.915042 -4.764667 -4.757847 -4.668022 -4.662210 -4.549160 -4.545332 -4.405023 -4.022275 -3.604326 -3.172659 -3.169263 -2.928884 -2.926282 -2.905440 -2.835670 -2.834042 -2.795639 -2.599589 -2.584990 -2.487566 -2.484885 -2.383341 -2.382588 -2.368374 -2.367387 -2.355901 -2.290002 -2.252707 -2.137234 -2.054848 -2.053858 -2.029827 -2.027036 -2.017432 -2.014045 -2.011669 -1.966730 -1.962517 -1.891080 -1.878531 -1.873526 -1.808037 -1.717217 -1.707282 -1.697499 -1.679693 -1.676746 -1.669905 -1.616195 -1.611898 -1.586325 -1.584042 -1.384294 -1.377516 -1.234618 -1.226974 -1.221318 -1.221287 -1.123790 -1.121141 -1.106091 -1.104251 -1.102704 -1.097674 -1.072212 -1.047564 -0.975795 -0.938509 -0.932973 -0.926462 -0.920994 -0.916214 -0.744225 -0.740678 -0.701483 -0.692425 -0.257325 -0.163678 0.024935 0.058789 0.088503 0.206467 0.208493 0.283407 0.321962 0.382271 0.425458 0.490865 0.514660 0.656880 0.682125 0.701440 0.867191 0.870905 0.872557 0.929113 0.943635 0.949908 0.950336 0.989781 0.993566 1.000831 1.018393 1.036187 1.119863 1.136440 1.138246 1.153072 1.215953 1.298804 1.351279 1.351981 1.486408 1.509732 1.539889 1.549135 1.551270 1.635642 1.669212 1.724986 1.772129 1.806172 1.876419 1.921266 1.957250 2.177946 2.319674 2.338249 2.436036 2.596253 2.604682 2.628803 2.729367 2.731120 2.935069 2.944610 3.001544 3.043352 3.089048 3.113916 3.186524 3.252755 3.276402 3.304328 3.320459 3.361096 3.390757 3.393596 3.415391 3.428275 3.450605 3.484392 3.567429 3.613637 3.693135 3.693474 3.752319 3.857885 3.987693 4.035108 4.113798 4.142671 4.143594 4.181255 4.184030 4.248660 4.307210 4.353512 4.390661 4.425478 4.427105 4.476296 4.518277 4.528880 4.662589 4.671928 4.679549 4.733986 4.759424 4.779982 4.797013 4.860675 4.909318 4.911853 5.054083 5.132223 5.158031 5.228833 5.230343 5.246253 5.260452 5.316470 5.329742 5.364559 5.382764 5.520306 5.602846 5.623946 5.719848 5.737019 5.762916 5.808274 5.819553 5.867753 5.881360 5.934961 5.935521 5.967023 6.006399 6.070463 6.089724 6.155575 6.285899 6.291958 6.353104 6.459043 6.538283 6.542709 6.556718 6.624057 6.658510 6.679769 6.738109 6.800242 6.920244 6.943676 7.013482 7.022591 7.059286 7.081149 7.135956 7.158867 7.176053 7.223430 7.254592 7.291418 7.308453 7.314240 7.330519 7.362462 7.391616 7.447725 7.495676 7.515047 7.518836 7.580986 7.602349 7.687230 7.716924 7.732024 7.752257 7.810815 7.826261 7.871038 7.918688 7.962049 7.974545 8.101488 8.105072 8.190327 8.349497 8.359865 8.369620 8.455034 8.589221 8.624970 8.712487 8.742390 8.754025 8.781114 8.841895 8.868952 8.870266 8.921974 8.962708 9.008837 9.031132 9.051064 9.054674 9.100440 9.105029 9.117091 9.170191 9.214639 9.259489 9.261119 9.307198 9.337930 9.371289 9.374095 9.399422 9.471350 9.489897 9.572846 9.653942 9.771297 9.921993 9.966775 9.985154 9.989895 10.047785 10.049219 10.073342 10.170321 10.272322 10.283415 10.327452 10.381287 10.395159 10.404298 10.441833 10.448955 10.472518 10.517442 10.566725 10.625803 10.698929 10.734716 10.773927 10.782062 10.864750 10.908935 10.954022 10.984067 11.013508 11.096386 11.123517 11.139377 11.145625 11.186714 11.193739 11.201422 11.263111 11.349430 11.363995 11.409395 11.531638 11.584101 11.609924 11.622127 11.660142 11.779712 11.799026 11.818083 11.841269 11.883680 11.993211 12.023769 12.042403 12.072042 12.110771 12.119123 12.327108 12.363460 12.464433 12.494103 12.599887 12.643407 12.684679 12.782313 12.794563 12.818696 12.846783 12.961773 12.967062 13.059274 13.131005 13.179967 13.207983 13.331901 13.488171 13.598368 13.598609 13.698755 13.790075 13.829607 13.896718 14.031268 14.273896 14.392774 14.445833 14.467437 14.548155 14.562274 14.608988 14.778843 14.863765 14.947489 15.015735 15.154437 15.255076 15.356704 15.435965 15.501406 15.520892 15.717304 15.761415 15.791581 15.872572 15.985346 16.251613 16.581645 16.687399 16.787391 16.819527 16.929316 17.037697 17.125236 17.185237 17.260166 17.365601 17.380392 17.386716 17.501480 17.509816 17.516602 17.606191 17.617361 17.633995 17.708299 17.816535 17.880961 17.906190 17.920836 17.942591 18.002157 18.010993 18.026012 18.101923 18.132757 18.158055 18.167135 18.186139 18.279283 18.293369 18.341297 18.427014 18.519544 18.546408 18.641680 18.663393 18.786854 18.802900 18.878706 19.070896 19.155212 19.262718 19.341640 19.356887 19.367073 19.380124 19.458060 19.509965 19.526588 19.580456 19.651529 19.654398 19.672851 19.712572 19.753919 19.779160 19.808687 19.849240 19.865306 19.927536 19.993169 20.041295 20.095711 20.158721 20.254750 20.286247 20.292284 20.351654 20.359670 20.479992 20.515167 20.552103 20.606414 20.651502 20.696408 20.699452 20.758836 20.777557 20.855765 20.873260 20.897942 21.025877 21.094766 21.105779 21.145845 21.146993 21.252381 21.261762 21.324408 21.368340 21.429450 21.502637 21.505491 21.645847 21.663322 21.684027 21.809269 21.942346 21.946462 22.010326 22.068985 22.086485 22.136637 22.217856 22.262025 22.329547 22.432971 22.490133 22.524196 22.624621 22.682566 22.738155 22.786746 22.794597 22.838581 22.916190 22.970808 22.986160 23.024709 23.078524 23.198137 23.251073 23.289446 23.323269 23.532493 23.602631 23.620422 23.673317 23.728241 23.763255 23.772660 23.794744 23.922334 23.940899 24.098803 24.124146 24.251412 24.320985 24.342336 24.360358 24.413202 24.509259 24.538208 24.741814 24.781976 24.848730 24.879112 24.889375 24.927115 25.034346 25.248355 25.331273 25.411729 25.455982 25.538169 25.615693 25.645644 25.678624 25.719224 25.814755 25.871823 25.904241 25.967520 26.023106 26.089117 26.128850 26.140272 26.211920 26.243902 26.247046 26.321481 26.354170 26.415450 26.422426 26.449863 26.464133 26.581490 26.623082 26.714092 26.721877 26.771589 26.798822 26.859087 26.889323 26.965365 27.101301 27.129553 27.152525 27.205914 27.320161 27.346531 27.444166 27.485848 27.559443 27.578370 27.637878 27.656696 27.710951 27.724404 27.743495 27.774423 27.791394 27.837762 27.847857 27.973307 27.985947 28.045329 28.051912 28.101380 28.125805 28.223519 28.245137 28.285809 28.306122 28.381083 28.387057 28.464912 28.555066 28.556126 28.640344 28.700771 28.776799 28.794992 28.826434 28.842591 28.911345 28.915085 29.080868 29.174168 29.208359 29.221155 29.236927 29.239562 29.315714 29.325316 29.359985 29.391271 29.418359 29.449162 29.479463 29.582021 29.640420 29.706509 29.743727 29.824709 29.838851 29.856633 29.892285 29.960907 29.996043 30.017715 30.085159 30.125590 30.154023 30.196823 30.219773 30.244528 30.340651 30.411851 30.430327 30.439881 30.458679 30.491428 30.508904 30.532228 30.538815 30.643470 30.670403 30.728707 30.749656 30.829617 30.844971 30.920122 30.937524 31.029587 31.101412 31.110966 31.159471 31.161188 31.167585 31.227644 31.253325 31.269360 31.316849 31.361813 31.413673 31.508163 31.582133 31.663060 31.685716 31.687912 31.756118 31.825254 31.847116 31.942710 31.961108 31.987505 31.998317 32.089714 32.111666 32.208914 32.241511 32.271895 32.277338 32.295135 32.335683 32.366068 32.427224 32.433602 32.478242 32.513764 32.595366 32.603265 32.617607 32.646182 32.699780 32.700760 32.714058 32.767440 32.796709 32.813704 32.857759 32.907035 32.917959 32.951079 32.980890 33.036612 33.039521 33.103687 33.119489 33.130805 33.208152 33.258116 33.287037 33.321609 33.379237 33.404705 33.420344 33.448676 33.453862 33.459435 33.527126 33.547100 33.567129 33.609010 33.649774 33.685407 33.734011 33.761413 33.777479 33.781811 33.828063 33.862420 33.903218 33.944832 33.951329 33.952871 33.961285 33.997675 34.018786 34.038075 34.045456 34.107171 34.123402 34.124408 34.156444 34.195252 34.211825 34.278292 34.315607 34.319427 34.362433 34.407065 34.475290 34.493305 34.546139 34.554941 34.616724 34.636251 34.692763 34.711564 34.731356 34.775011 34.803134 34.903298 35.002997 35.068713 35.070802 35.108332 35.109649 35.165961 35.196338 35.198053 35.271796 35.288045 35.325325 35.331885 35.359235 35.367721 35.387029 35.454074 35.456875 35.584391 35.614869 35.658094 35.710005 35.754779 35.798659 35.849701 35.869322 35.901076 35.927696 35.964146 36.005887 36.022999 36.061790 36.113100 36.224769 36.226970 36.325250 36.349491 36.352685 36.365578 36.380514 36.395000 36.403599 36.453432 36.476842 36.503872 36.592839 36.593173 36.697024 36.763669 36.793601 36.841839 36.855643 36.931629 36.939389 36.988432 36.994851 37.005903 37.045825 37.110102 37.129663 37.181487 37.214976 37.238561 37.254362 37.301217 37.344185 37.381833 37.408206 37.432906 37.497348 37.546802 37.602562 37.605006 37.628939 37.701570 37.711962 37.771373 37.778278 37.796267 37.921052 37.935685 37.992753 38.032175 38.087316 38.132100 38.137907 38.195207 38.218206 38.266348 38.320793 38.458682 38.557481 38.562884 38.669020 38.787118 38.807333 38.891830 38.921219 38.923288 39.106808 39.192740 39.347125 39.353392 39.513849 39.544514 39.553649 39.595882 39.681570 39.711028 39.712155 39.721211 39.792615 39.936714 39.955608 40.031917 40.125695 40.163451 40.227932 40.228834 40.244011 40.264214 40.296684 40.397066 40.492911 40.532143 40.578314 40.607042 40.665714 40.705325 40.885749 40.905096 40.930722 40.940867 40.985047 41.036148 41.071587 41.097055 41.114981 41.163796 41.242845 41.325553 41.367217 41.468546 41.519122 41.629223 41.843768 41.849052 41.872499 41.956897 42.058873 42.119596 42.129594 42.200876 42.297780 42.465217 42.514125 42.522090 42.628606 42.743062 42.814947 42.825373 42.833739 43.070818 43.167485 43.182558 43.391761 43.391902 43.537742 43.652066 43.656095 43.681843 43.685035 43.774971 43.827908 43.858713 43.916974 43.924635 43.945630 43.977439 44.073291 44.085529 44.128015 44.226445 44.246320 44.256236 44.430648 44.453147 44.480039 44.516838 44.552338 44.584349 44.626122 44.721841 44.778573 44.814929 44.853980 44.918264 45.073413 45.132008 45.158422 45.307066 45.349875 45.383569 45.413165 45.419782 45.573581 45.610723 45.741695 45.858658 45.870011 45.954259 45.982893 46.016964 46.034344 46.189986 46.210367 46.267774 46.371728 46.387238 46.412301 46.523024 46.574385 46.584740 46.651350 46.674530 46.729458 46.756145 46.828767 46.879906 47.167790 47.202946 47.266222 47.381890 47.544517 47.795728 47.959585 47.979168 47.991829 48.061171 48.089229 48.099122 48.316986 48.487612 48.562043 48.583298 48.684678 48.807035 48.869308 48.948284 48.974826 49.107314 49.174205 49.219985 49.402216 49.556320 49.584165 49.724047 49.751748 49.754434 49.821765 49.868722 49.947998 50.014322 50.174529 50.236102 50.255676 50.286567 50.349369 50.408992 50.514842 50.556549 50.656460 50.749445 50.786599 50.937221 50.955947 50.977727 51.064662 51.090455 51.119121 51.132467 51.302508 51.356871 51.382115 51.442266 51.558507 51.607931 51.608305 51.721314 52.009939 52.018250 52.039443 52.084024 52.159017 52.168275 52.216241 52.295767 52.492109 52.531056 52.550753 52.573624 52.863017 52.920470 53.012105 53.140207 53.216091 53.348653 53.380286 53.409121 53.440324 53.548242 53.608195 53.724173 53.724998 53.726547 53.784388 53.889582 53.909864 54.052103 54.106822 54.127216 54.227065 54.441302 54.443894 54.559709 54.668692 54.740579 54.773341 54.782453 54.823782 54.972695 55.022059 55.058536 55.100507 55.194733 55.283002 55.293389 55.336468 55.407181 55.506631 55.554148 55.725169 55.734680 55.743565 55.823632 55.867833 55.957006 55.993537 56.022336 56.100753 56.171022 56.180189 56.373805 56.387546 56.417381 56.474061 56.527168 56.593313 56.696768 56.698889 56.854865 56.928468 56.968908 57.029628 57.060206 57.138139 57.169279 57.178094 57.196256 57.304045 57.354405 57.456690 57.548041 57.666326 57.672563 57.699301 57.714237 57.737277 57.767798 57.966106 58.047509 58.083048 58.156399 58.206641 58.214003 58.253521 58.306134 58.320778 58.416824 58.436356 58.452355 58.526683 58.552875 58.615320 58.821975 58.925837 58.948328 59.083854 59.162665 59.227354 59.262464 59.326808 59.486827 59.761436 59.855568 59.897725 60.042662 60.062012 60.208369 60.272025 60.320046 60.512946 60.651393 60.761927 60.990773 61.025572 61.036028 61.129212 61.142649 61.171681 61.283581 61.437606 61.472000 61.525094 61.678586 61.807784 61.849220 61.881085 61.916838 61.924710 61.959433 62.045638 62.195425 62.256928 62.351904 62.369250 62.657407 62.824616 62.887623 62.908553 62.963514 63.119746 63.203826 63.223454 63.277502 63.299747 63.426819 63.433893 63.552283 63.690094 63.698969 63.755030 63.795497 63.819278 64.001776 64.080358 64.124564 64.331287 64.459991 64.503971 64.613633 64.727445 64.763100 64.808610 64.813533 64.886377 64.947867 65.086742 65.090440 65.191981 65.232909 65.401077 65.405514 65.505193 65.606583 65.663449 65.946942 65.953963 66.083134 66.122432 66.175885 66.183457 66.194469 66.238496 66.248361 66.362263 66.577147 66.589883 66.599709 66.659766 66.693437 66.716573 66.751283 66.953387 67.075165 67.147002 67.524128 67.644755 67.767498 67.849519 67.849900 68.062901 68.177881 68.321445 68.461041 68.612972 68.706740 68.782703 68.826486 68.885251 69.016845 69.038593 69.097913 69.113955 69.128623 69.156296 69.167497 69.201511 69.261543 69.276209 69.411319 69.422413 69.442523 69.474495 69.544502 69.548202 69.563794 69.582206 69.663367 69.686480 69.704088 69.738050 69.748536 69.774272 69.795435 69.801605 69.810565 69.857363 69.858872 69.862475 69.871311 69.917825 69.971485 69.973859 69.985015 69.999361 70.000906 70.042065 70.120554 70.159506 70.954251 70.997771 71.141297 71.300765 71.382543 71.469424 71.550057 71.614678 71.675057 71.921358 73.453088 73.881216 74.293689 74.996634 76.848830 77.282842 77.291925 77.321388 78.202771 79.019824 79.568517 79.708777 79.786679 80.101509 80.145864 80.574369 80.751656 80.853310 81.144849 81.217076 81.304844 81.313295 81.366299 81.527316 81.641123 81.648973 81.682011 81.747070 82.137249 82.272450 82.428687 82.466475 82.506100 82.575043 82.652115 82.762787 82.781331 82.831339 82.957098 82.997195 83.122038 83.131977 83.231088 83.262273 83.461079 83.529819 83.601085 83.663321 83.726547 83.862647 83.883632 84.008274 84.020716 84.131222 84.187536 84.317498 84.405483 84.441307 84.536950 84.623648 84.649823 84.831810 84.849588 85.058334 85.126938 85.415287 85.511920 85.590168 85.669443 85.750226 85.899077 86.095244 86.459199 86.490897 86.619292 86.679190 86.842092 87.032270 87.090798 87.163564 87.329685 87.497005 87.735914 87.984359 88.330826 88.393437 88.682383 88.727840 88.767145 88.818237 89.063871 89.107536 89.161963 89.165472 89.349001 89.391379 90.385526 90.737102 90.815827 90.938995 91.152673 91.338147 91.661340 91.744025 91.842629 91.949784 92.039877 92.254970 92.636160 92.841224 92.955507 93.031783 93.054310 93.103468 93.407501 93.515786 93.770209 93.806832 93.922327 94.051161 100.873491 102.744355 103.047852 103.919896 104.061463 104.086894 104.514666 104.538986 104.699721 104.755484 104.978246 105.017049 105.047201 105.397425 105.672325 105.683412 105.700175 105.897777 106.421724 107.088678 107.513511 107.661102 107.993811 108.292208 119.670750 119.727491 121.926234 122.025428 122.122122 122.296142 122.634505 122.999802 123.600078 123.632805 123.911377 123.958098 124.248808 124.514967 124.531092 124.606069 124.805085 124.906786 124.924838 124.927967 125.162516 125.388065 125.446650 125.528528 125.623077 126.024169 126.080062 126.106819 127.074454 127.311489 127.880752 127.898947 127.958362 128.148882 128.248153 128.248810 128.365515 128.383948 128.401581 128.660959 128.761798 128.969924 128.972606 129.074276 129.159826 129.200811 129.207997 129.578838 129.595539 129.796859 129.851658 130.128512 130.487056 130.697566 130.775075 131.024355 131.054691 131.213524 131.252868 131.338484 131.807311 132.162284 132.388997 132.512280 132.930401 132.994004 133.170675 133.194280 133.288838 133.405231 133.580310 133.727904 134.115008 134.266226 135.020214 135.075292 135.176646 135.263042 135.316796 135.344949 135.773519 135.882521 136.038806 136.171945 136.297942 136.455569 136.475602 136.662934 136.852721 136.932190 136.952642 137.164877 137.209467 137.478150 137.491381 137.649776 137.671404 137.963132 137.980240 138.020528 138.171847 138.281972 138.485242 138.535051 138.586734 138.784283 138.863262 138.937718 139.025981 139.038863 139.178136 139.277621 139.316619 139.444824 139.467972 139.519360 139.816734 139.849134 139.951715 139.987553 140.079437 140.369220 140.586116 140.720778 140.798514 140.848688 140.863862 141.029541 141.279268 141.279638 141.430386 141.507834 141.538206 141.921818 142.008435 142.102719 142.342471 142.557428 142.882768 143.233944 143.313153 143.336753 143.453151 143.648474 143.683419 143.987074 144.300263 144.386014 144.519969 144.534898 144.824184 144.863283 145.094750 145.449907 145.521228 145.918293 146.605875 146.966205 147.003529 147.044339 147.211949 147.262651 147.470424 147.544243 147.773694 148.001553 148.260390 148.629323 148.670685 148.804455 148.927792 149.072664 149.211855 149.248450 149.522215 149.608689 149.688637 149.845442 149.912768 149.973365 150.005305 150.135426 150.239123 150.423239 150.537175 150.672431 151.108030 151.187554 151.207911 152.449696 152.927761 153.580879 153.807137 153.938143 154.155728 154.219725 154.356326 154.632727 155.041529 155.289584 155.466403 155.471446 155.668628 155.692368 155.699337 155.835723 155.848659 155.926147 156.019896 156.046058 156.417123 156.522364 156.572091 156.935482 157.228215 157.412333 157.422424 157.629707 157.973564 158.144075 158.252865 158.370683 158.388641 158.504087 158.504073 158.611397 158.636762 158.769328 159.368361 159.537449 159.652837 160.192523 160.336262 160.575770 160.783252 160.952939 161.064875 161.493190 161.631181 161.928774 164.525737 165.004442 165.055589 165.367316 165.422338 165.540442 166.207036 166.318165 166.404307 167.323876 167.462957 167.796206 168.217693 168.335172 168.535631 168.746138 169.260569 169.595272 169.739471 169.751726 169.820193 170.116574 170.521823 170.532428 170.640709 171.480048 171.793859 171.810007 172.055038 172.360026 172.863812 172.985750 173.375727 173.488826 173.785898 174.299606 174.437365 174.448704 174.530881 174.827448 174.945041 175.529971 176.408755 176.592671 176.606721 176.946988 177.334350 178.075287 178.345915 178.423026 178.526846 179.438389 180.252850 181.235170 181.896971 182.089154 182.728970 183.108581 183.533609 183.561813 184.708461 185.085813 186.481694 186.522084 186.666195 187.329775 187.534260 189.344919 191.228750 322.174738 322.669030 324.924336 324.947717 325.542991 326.269241 357.833491 358.916188 474.105334 474.113846 474.114859 474.120617 474.132877 474.137012 474.197861 474.214397 474.224089 474.229693 474.251890 474.256368 474.380541 474.403933 474.461373 474.468668 474.609081 474.613973 474.627950 474.640265 476.754386 476.760523 476.767388 476.777616 476.800474 476.809078 476.828051 476.834995 476.882967 476.890053 476.955337 476.959057 477.105451 477.126960 477.135614 477.140813 477.189043 477.195584 477.218196 477.225153 477.246999 477.263645 477.265815 477.276487 477.346475 477.354259 477.429775 477.441893 477.460179 477.463134 477.488380 477.497722 477.605831 477.611520 477.700753 477.710293 477.742190 477.746710 477.748087 477.758501 479.654805 479.667709 479.793129 479.808826 479.902342 479.927500 479.983265 479.984624 479.992190 479.993741 480.150945 480.169340 480.350318 480.367867 480.468266 480.476100 480.625959 480.643301 481.333651 481.348589 483.836558 483.846357 483.879610 483.882432 484.062634 484.070989 484.238810 484.250615 484.257068 484.277333 484.366994 484.400273 484.782072 484.824977 484.917403 484.955558 485.067993 485.087802 485.115841 485.158624 485.254414 485.271207 485.288101 485.311211 485.316223 485.331355 485.346515 485.376738 485.486282 485.497859 485.595128 485.640755 485.684713 485.750724 486.038890 486.112380 486.120419 486.193282 486.333682 486.380837 488.289917 488.301095 488.393726 488.414481 488.474182 488.500359 488.567892 488.603204 488.794196 488.818429 488.833393 488.864380 488.887673 488.893218 488.918620 488.956952 489.009755 489.042616 489.134790 489.149128 921.843387 927.525711 927.804209 928.324242 928.660527 930.737423 931.721776 931.994584 932.331421 933.394343 933.477750 936.133810 936.565849 937.224910 937.645584 938.205731 938.344212 938.889509 939.758385 940.404947 940.444610 940.849407 941.155250 941.167513 941.792043 942.346133 942.837133 942.921341 943.622736 943.698894 943.782728 943.918984 943.965488 944.457375 944.790152 945.465144 945.744881 945.769559 946.563194 946.782190 946.783938 946.960196 947.749550 950.185153 950.733650 952.369973 952.800733 953.392472 953.939352 953.951495 954.045870 955.025340 955.557285 956.455896 956.839430 957.338208 957.950184 958.182857 958.302706 959.079100 959.662801 960.149559 960.440343 971.505884 971.908661 973.622039 974.596225 975.716218 976.317822 976.484871 977.406394 981.266017 981.727995 983.529060 985.201228 986.681536 987.049851 987.355142 987.859168 82907.603494 82907.735493 82917.306795 82923.741925 82929.106080 82930.250075 82937.454032 82938.206493 82941.028984 82942.810186 82944.878891 82945.622351 82945.657811 82946.888183 82947.842956 82948.789354 82948.883682 82951.106163 82951.232726 82954.384535 -175.402843 -175.401577 -125.758846 -125.757368 -125.745128 -125.743980 -125.741206 -125.739885 -79.933415 -79.932631 -79.932213 -79.930884 -79.849250 -79.847684 -79.844154 -79.842598 -79.840922 -79.839290 -79.837268 -79.835657 -79.794613 -79.793986 -79.793750 -79.793029 -79.789973 -79.789337 -79.789265 -79.788758 -71.588934 -71.587158 -71.586095 -71.574801 -44.754584 -44.753943 -44.752741 -44.752165 -44.678559 -44.673098 -44.660112 -44.656615 -44.656168 -44.651132 -44.636320 -44.632373 -44.616878 -44.616123 -44.611531 -44.610765 -44.605475 -44.605193 -44.601478 -44.601048 -44.577265 -44.576084 -44.571205 -44.570143 -44.556508 -44.554844 -44.547635 -44.546173 -44.504129 -44.499543 -44.499071 -44.495672 -44.472502 -44.470163 -44.467834 -44.465817 -44.452222 -44.448074 -44.446768 -44.446177 -44.442446 -44.441980 -44.437453 -44.435638 -44.433543 -44.431578 -44.427767 -44.427031 -44.422138 -44.418253 -44.414494 -44.413648 -44.409242 -44.408594 -44.391631 -44.391066 -44.369261 -44.368277 -44.362103 -44.361220 -43.853608 -43.842860 -43.775301 -43.772130 -43.682969 -43.679209 -43.677641 -43.677479 -43.656122 -43.641598 -43.635480 -43.629597 -34.894499 -34.893595 -34.893306 -34.891902 -34.871058 -34.870165 -34.870091 -34.869934 -34.869215 -34.868989 -34.868453 -34.867492 -34.863290 -34.862411 -34.862175 -34.860657 -34.855035 -34.854118 -34.853855 -34.852975 -34.852401 -34.852087 -34.851881 -34.850400 -34.846808 -34.845995 -34.845802 -34.844183 -34.817299 -34.815193 -34.812325 -34.810208 -34.808745 -34.806620 -34.805140 -34.803031 -34.797807 -34.795858 -34.792996 -34.791051 -34.790114 -34.788031 -34.786560 -34.784497 -34.781928 -34.781294 -34.780537 -34.778989 -34.776752 -34.776134 -34.775923 -34.775334 -34.775330 -34.774853 -34.774017 -34.773926 -34.773756 -34.772357 -34.772092 -34.771559 -34.770615 -34.770474 -34.769495 -34.769336 -34.769203 -34.769061 -34.768325 -34.768105 -34.765868 -34.765791 -34.765246 -34.764760 -34.764529 -34.764506 -34.764110 -34.763761 -34.763476 -34.762888 -34.762242 -34.762229 -34.761287 -34.761172 -34.760258 -34.759767 -34.759424 -34.758634 -34.758542 -34.758476 -34.758183 -34.757790 -34.754882 -34.754168 -34.745251 -34.744439 -34.743780 -34.742906 -34.742166 -34.741658 -34.740704 -34.740253 -34.729083 -34.728751 -34.728083 -34.727526 -34.723875 -34.723302 -34.723031 -34.722978 -34.722486 -34.722337 -34.722278 -34.721982 -34.719760 -34.719121 -34.718973 -34.718866 -34.718346 -34.718025 -34.717985 -34.717819 -34.717214 -34.717140 -34.716893 -34.716325 -34.714507 -34.713727 -34.713636 -34.713345 -34.712955 -34.712745 -34.712643 -34.712206 -34.711048 -34.710299 -34.710153 -34.709277 -34.706510 -34.705832 -34.705733 -34.705154 -26.919655 -26.918088 -24.613872 -24.613414 -24.576330 -24.575541 -24.499504 -24.496636 -23.704794 -23.702424 -23.447883 -23.445656 -23.338499 -23.337059 -23.330035 -23.329464 -23.322065 -23.311428 -23.181994 -23.180282 -23.106293 -23.103458 -23.094213 -23.091722 -23.058264 -23.056266 -22.894549 -22.894386 -22.788839 -22.787878 -22.754125 -22.749016 -22.663267 -22.661161 -22.646759 -22.645348 -22.590240 -22.588270 -22.574797 -22.572837 -22.564205 -22.560777 -22.471680 -22.469726 -22.459763 -22.457726 -22.398175 -22.396163 -22.395801 -22.392468 -22.378459 -22.375142 -22.374276 -22.372184 -22.353561 -22.353162 -22.351236 -22.350064 -22.330014 -22.329027 -22.325387 -22.325323 -22.316487 -22.316235 -22.310668 -22.308736 -22.272319 -22.271643 -22.268330 -22.262000 -22.256612 -22.254752 -22.101843 -22.095809 -22.010443 -22.008981 -21.958826 -21.939507 -21.937266 -14.659498 -14.657770 -12.485955 -12.481944 -12.409545 -12.408904 -12.375456 -12.365624 -12.078297 -12.076079 -12.015038 -12.013052 -11.597961 -11.592284 -11.584316 -11.581448 -11.383822 -11.382519 -11.293385 -11.290284 -11.262369 -11.260650 -11.231336 -11.229793 -11.105316 -11.104747 -11.080148 -11.078923 -10.842728 -10.833117 -10.798651 -10.791365 -10.760300 -10.759358 -10.680052 -10.675947 -10.665299 -10.618362 -10.601026 -10.598664 -10.581874 -10.577861 -10.515820 -10.490089 -10.396631 -10.393323 -10.391341 -10.389358 -10.330235 -10.328473 -10.173320 -10.169311 -10.125177 -10.115861 -9.893676 -9.888173 -9.885284 -9.840373 -9.814301 -9.812125 -9.805812 -9.799711 -9.785002 -9.781197 -9.766636 -9.762816 -9.690768 -9.673183 -9.666867 -9.658629 -9.635523 -9.576732 -9.508482 -9.500862 -9.497392 -9.497327 -9.488736 -9.484088 -9.443817 -9.378343 -9.376292 -9.349904 -9.348334 -9.328843 -9.327501 -9.279697 -9.274442 -9.237422 -9.236149 -9.233330 -9.213293 -9.183301 -9.182653 -9.163976 -9.132314 -9.124871 -9.105409 -9.083742 -9.081990 -9.055737 -9.052883 -9.033077 -9.029144 -8.996871 -8.989953 -8.963262 -8.960261 -8.955071 -8.949418 -8.934206 -8.931227 -8.925780 -8.923092 -8.902228 -8.901070 -8.897520 -8.868692 -8.781797 -8.774871 -8.752863 -8.751894 -8.618593 -8.616887 -8.599498 -8.590703 -8.585479 -8.583431 -8.582408 -8.581219 -8.520346 -8.468924 -8.426420 -8.423972 -8.399377 -8.386002 -8.378485 -8.374264 -8.316431 -8.314714 -8.266233 -8.263656 -8.143219 -8.138341 -8.109207 -8.104789 -8.075756 -8.073629 -8.071169 -8.057406 -8.050740 -8.016754 -7.993638 -7.930780 -7.886824 -7.852818 -7.835046 -7.817634 -7.765731 -7.761371 -7.719049 -7.717342 -7.676009 -7.653553 -7.642513 -7.540314 -7.520775 -7.471703 -7.460921 -7.402422 -7.397709 -7.394543 -7.386989 -7.380691 -7.343971 -7.331135 -7.297144 -7.282594 -7.272586 -7.259043 -7.237861 -7.217068 -7.184346 -7.162711 -7.128464 -7.070790 -7.021110 -7.020480 -6.992230 -6.990371 -6.986099 -6.965600 -6.953838 -6.906146 -6.898833 -6.887016 -6.884086 -6.879702 -6.863103 -6.861103 -6.833701 -6.823506 -6.787582 -6.784709 -6.769347 -6.752939 -6.743866 -6.729669 -6.728275 -6.719660 -6.712088 -6.707480 -6.706223 -6.689348 -6.687281 -6.679680 -6.641365 -6.639581 -6.634549 -6.460457 -6.453932 -6.450192 -6.442534 -6.440073 -6.437581 -6.406788 -6.391029 -6.388150 -6.288736 -6.282631 -6.261131 -6.259795 -6.252040 -6.249933 -6.071504 -6.068748 -5.943154 -5.941746 -3.587413 -3.577284 -3.568201 -3.495496 -3.378133 -3.367409 -3.328112 -3.321684 -3.190718 -3.185929 -3.124226 -3.119746 -2.942337 -2.890496 -2.884836 -2.779038 -2.774427 -2.683854 -2.566793 -2.502938 -2.440394 -2.373146 -2.372333 -2.357812 -2.356832 -2.266537 -2.262913 -2.249198 -2.246520 -2.101514 -2.091774 -2.041507 -2.040489 -2.006269 -1.996835 -1.971665 -1.948222 -1.944869 -1.924797 -1.866488 -1.805157 -1.778144 -1.773380 -1.768017 -1.732962 -1.633551 -1.629737 -1.573222 -1.565028 -1.559224 -1.545372 -1.540513 -1.514867 -1.325560 -1.321794 -1.290639 -1.284515 -1.219490 -1.177515 -1.150514 -1.130496 -1.127516 -1.111760 -1.109771 -1.086707 -1.081611 -1.030502 -0.995538 -0.910781 -0.902623 -0.863893 -0.854552 -0.849191 -0.766855 -0.686092 -0.681490 -0.522259 -0.509163 -0.388202 -0.382968 -0.211068 -0.115265 0.079662 0.094338 0.118077 0.228230 0.230201 0.313289 0.342244 0.395664 0.486270 0.501469 0.540966 0.697496 0.698575 0.749749 0.881626 0.889195 0.891068 0.949405 0.959792 0.962356 0.968115 1.010986 1.020601 1.023241 1.046955 1.056833 1.151104 1.179669 1.187904 1.192400 1.271639 1.310998 1.367059 1.402629 1.494648 1.553353 1.581980 1.614593 1.626544 1.660672 1.699455 1.740289 1.791808 1.843257 1.908765 1.946592 1.986475 2.215257 2.360174 2.412679 2.494896 2.659277 2.668327 2.686653 2.784565 2.819292 2.989795 2.998212 3.038708 3.087041 3.122026 3.141783 3.216035 3.292591 3.324813 3.335783 3.381092 3.385452 3.402667 3.407698 3.437338 3.442134 3.465978 3.542571 3.608926 3.662386 3.722944 3.731368 3.806312 3.889498 4.043238 4.044706 4.146545 4.166183 4.175260 4.213845 4.270434 4.298341 4.339952 4.381962 4.424840 4.453504 4.463417 4.552355 4.562961 4.617082 4.705476 4.706536 4.713443 4.776102 4.798456 4.851028 4.851454 4.892017 4.928402 4.993071 5.102939 5.192948 5.216124 5.240308 5.265147 5.268264 5.277342 5.323833 5.367402 5.402266 5.488180 5.655515 5.665116 5.703477 5.755877 5.787859 5.824287 5.851752 5.866202 5.920443 5.950108 5.960772 5.980411 6.001962 6.073452 6.095391 6.154828 6.239569 6.367661 6.397910 6.488182 6.547749 6.554242 6.563916 6.614228 6.665750 6.732177 6.753620 6.769250 6.918079 6.968191 6.971255 7.048373 7.066922 7.082683 7.159636 7.166873 7.184897 7.246959 7.285070 7.288716 7.327372 7.359614 7.375709 7.379314 7.413012 7.428423 7.528507 7.547416 7.563968 7.589181 7.621080 7.696184 7.746501 7.751707 7.775316 7.859993 7.887218 7.939178 7.996597 8.014042 8.080696 8.086635 8.167559 8.219005 8.330652 8.397075 8.467560 8.474197 8.536850 8.603764 8.742144 8.756575 8.759750 8.817739 8.855371 8.884411 8.901935 8.922602 8.958205 9.025940 9.046570 9.090456 9.104281 9.130518 9.136175 9.151786 9.214351 9.231182 9.242293 9.295327 9.347880 9.373627 9.431277 9.433689 9.460562 9.487280 9.502921 9.609854 9.707287 9.762761 9.898273 9.994928 10.021195 10.031571 10.084624 10.086080 10.095887 10.160343 10.242547 10.297461 10.361881 10.391848 10.410740 10.434433 10.456793 10.505049 10.517783 10.534832 10.551462 10.589207 10.717081 10.719544 10.768983 10.810800 10.830154 10.894973 10.986887 11.015053 11.023719 11.105542 11.152742 11.175969 11.189897 11.221538 11.238145 11.241478 11.275026 11.380659 11.401432 11.417520 11.525163 11.624738 11.651067 11.675078 11.693847 11.694094 11.814548 11.867525 11.900761 11.920189 11.962922 12.039353 12.046505 12.077878 12.128127 12.165268 12.207770 12.398867 12.423899 12.510688 12.523288 12.626601 12.732419 12.750096 12.827911 12.860491 12.882622 12.995995 13.010702 13.090229 13.107942 13.180349 13.228250 13.258904 13.431464 13.649428 13.656751 13.717590 13.728666 13.863925 13.936024 13.957059 14.131536 14.340578 14.467217 14.537171 14.588530 14.597503 14.661679 14.703803 14.831829 14.915514 15.069541 15.112557 15.239492 15.302111 15.422900 15.492295 15.648729 15.696622 15.813233 15.864153 15.903184 15.992939 16.171458 16.469453 16.715976 16.777922 16.904821 16.934380 17.036085 17.118821 17.223616 17.243067 17.300320 17.425407 17.466279 17.472797 17.536851 17.581988 17.609384 17.646683 17.659635 17.688080 17.744715 17.919716 17.958516 17.963333 17.987314 18.015506 18.066688 18.073110 18.085480 18.165551 18.168516 18.223388 18.225771 18.266111 18.336945 18.344702 18.413595 18.453130 18.545236 18.578799 18.705320 18.728611 18.820383 18.897824 18.979837 19.138897 19.230830 19.331618 19.399107 19.420928 19.440918 19.534641 19.541033 19.577058 19.650113 19.658853 19.700870 19.719145 19.733042 19.792222 19.864589 19.899185 19.906055 19.915901 19.976019 20.017637 20.097183 20.122899 20.157705 20.228078 20.336993 20.349861 20.378026 20.402305 20.417146 20.523994 20.570165 20.621593 20.693671 20.693782 20.739412 20.761393 20.828513 20.887103 20.905671 20.913487 20.975281 21.083613 21.160466 21.161974 21.209107 21.222405 21.314214 21.315120 21.465807 21.498972 21.551906 21.582462 21.651255 21.701820 21.746202 21.873778 21.900944 21.985640 22.005071 22.067347 22.135009 22.155548 22.250780 22.319809 22.328712 22.390110 22.486002 22.554628 22.586782 22.751095 22.787818 22.825466 22.840853 22.872239 22.932388 22.998478 23.003718 23.024088 23.098478 23.125236 23.242281 23.320015 23.371508 23.386232 23.587743 23.664012 23.714577 23.726918 23.813442 23.818594 23.841558 23.847424 23.979868 23.983782 24.148703 24.173577 24.333605 24.357208 24.413740 24.425098 24.475562 24.559968 24.602863 24.808505 24.827313 24.893315 24.929530 24.944897 24.961947 25.104430 25.320878 25.396249 25.462813 25.512817 25.617379 25.679159 25.705508 25.726085 25.798907 25.862228 25.930960 25.988329 26.049412 26.099109 26.143601 26.181393 26.253096 26.258056 26.309030 26.309634 26.416349 26.450773 26.452551 26.501119 26.503474 26.576157 26.634831 26.702284 26.758314 26.770246 26.884731 26.892105 26.907414 27.015016 27.069821 27.152471 27.212164 27.247390 27.319413 27.360649 27.383469 27.490610 27.580819 27.614419 27.628177 27.681144 27.705595 27.768325 27.811243 27.836112 27.856720 27.867315 27.883411 27.957333 28.031299 28.067725 28.078277 28.099620 28.152512 28.229617 28.282007 28.326311 28.339865 28.378660 28.429142 28.429832 28.503339 28.597548 28.606713 28.686198 28.733740 28.857116 28.861831 28.879548 28.891722 28.961143 29.020713 29.140747 29.221357 29.270026 29.278367 29.301864 29.309460 29.353057 29.373728 29.428525 29.438306 29.462132 29.517827 29.527988 29.664221 29.684049 29.742331 29.795682 29.877902 29.883971 29.928749 29.942136 30.000956 30.039934 30.042846 30.157370 30.159600 30.207205 30.259727 30.281639 30.314192 30.387502 30.454264 30.469528 30.496324 30.511070 30.540847 30.556432 30.565145 30.583129 30.703047 30.729888 30.782346 30.809046 30.879921 30.906495 30.992776 31.005540 31.065483 31.145596 31.182861 31.187114 31.199137 31.220864 31.280650 31.288798 31.321623 31.347537 31.408594 31.443868 31.583908 31.614219 31.703932 31.750845 31.771930 31.788368 31.867919 31.888903 31.970133 32.002199 32.023211 32.030872 32.120252 32.154709 32.246637 32.304446 32.314869 32.335141 32.367012 32.377088 32.428134 32.469278 32.488421 32.512816 32.556938 32.625382 32.645128 32.651111 32.698125 32.741131 32.748483 32.753624 32.820168 32.844347 32.856184 32.918353 32.941440 32.948668 32.994964 33.015791 33.085210 33.085816 33.146721 33.175748 33.182573 33.248763 33.323724 33.364488 33.400746 33.423939 33.446300 33.486088 33.486420 33.499451 33.528947 33.578787 33.599766 33.604101 33.685302 33.721295 33.753974 33.773216 33.807853 33.816272 33.825185 33.876088 33.914930 33.959108 33.989950 34.012748 34.013308 34.030680 34.044866 34.051278 34.094910 34.099534 34.151521 34.177773 34.181947 34.186350 34.253555 34.265904 34.317917 34.375699 34.385860 34.403387 34.479010 34.522068 34.532163 34.588667 34.592198 34.669116 34.687411 34.751442 34.767390 34.784423 34.850877 34.856446 34.978196 35.048457 35.128416 35.131523 35.150061 35.150392 35.211235 35.252765 35.268177 35.331197 35.333219 35.369114 35.407033 35.413099 35.439758 35.477886 35.521252 35.539441 35.623437 35.670299 35.732449 35.793236 35.797691 35.856203 35.929498 35.937793 35.990282 35.994453 36.048644 36.062204 36.089324 36.091303 36.200690 36.285834 36.307431 36.379220 36.386820 36.396203 36.414399 36.432309 36.474162 36.481788 36.491064 36.511578 36.576593 36.643826 36.650906 36.766855 36.836752 36.844070 36.895296 36.902860 36.969835 36.973284 37.029255 37.033674 37.060863 37.087800 37.167397 37.202829 37.237316 37.286294 37.313905 37.331698 37.361461 37.396395 37.416623 37.458204 37.460408 37.524238 37.633148 37.649300 37.661643 37.702172 37.732974 37.753509 37.820800 37.849294 37.865550 37.972932 38.001945 38.075638 38.127775 38.184438 38.252747 38.262363 38.288594 38.340034 38.364731 38.426722 38.577276 38.629768 38.719329 38.743131 38.836111 38.880733 38.981855 38.995386 38.999423 39.174724 39.268751 39.401109 39.409648 39.567264 39.584769 39.622937 39.654515 39.728819 39.749687 39.758775 39.764649 39.890732 40.012696 40.014647 40.107536 40.183706 40.279176 40.280579 40.304679 40.308201 40.314802 40.381865 40.476721 40.524371 40.573113 40.628455 40.668320 40.725936 40.755985 40.944028 40.962771 40.974351 41.013093 41.039261 41.068375 41.106763 41.145024 41.183209 41.221049 41.277286 41.395704 41.420922 41.581553 41.618911 41.705293 41.909880 41.927894 41.938371 42.047317 42.111184 42.183164 42.198019 42.268011 42.383487 42.513763 42.563995 42.608485 42.695991 42.870683 42.964927 43.059674 43.080086 43.245979 43.247222 43.292235 43.443811 43.522944 43.599954 43.704891 43.725160 43.740459 43.803199 43.855680 43.875953 43.944609 43.964398 43.976660 44.040908 44.103907 44.179995 44.199881 44.268814 44.284412 44.292835 44.305565 44.523888 44.527261 44.543881 44.611843 44.612922 44.669168 44.713124 44.813256 44.874377 44.910158 45.005237 45.041736 45.199047 45.215703 45.327775 45.391582 45.476977 45.499124 45.510963 45.550718 45.674857 45.768985 45.873898 45.901337 45.988429 46.010044 46.071103 46.133129 46.169424 46.245875 46.318115 46.376340 46.404973 46.428515 46.558170 46.588971 46.610527 46.661234 46.718532 46.743490 46.772152 46.806342 46.926029 47.000484 47.223117 47.360011 47.437616 47.477562 47.721741 47.900985 48.041232 48.055551 48.066553 48.140159 48.158273 48.195190 48.453738 48.595283 48.639651 48.666087 48.761940 48.883408 49.027561 49.044403 49.110476 49.182421 49.242451 49.283333 49.461890 49.627811 49.635004 49.780015 49.791799 49.814555 49.921501 49.933662 50.132474 50.162941 50.290955 50.315249 50.375877 50.405343 50.432005 50.505195 50.604828 50.686900 50.782732 50.889891 50.901795 51.031900 51.042218 51.106119 51.135554 51.183898 51.221931 51.274428 51.389366 51.453821 51.498498 51.567049 51.669406 51.728834 51.734900 51.823582 52.077931 52.122157 52.127320 52.179540 52.235043 52.273903 52.345789 52.361554 52.583823 52.622552 52.657524 52.755477 52.992228 53.163922 53.175308 53.292227 53.345263 53.423965 53.486554 53.491095 53.572168 53.668108 53.742481 53.753950 53.773997 53.874246 53.905240 54.037253 54.045093 54.090074 54.174069 54.230560 54.410621 54.495108 54.515240 54.671661 54.728931 54.814169 54.842048 54.855291 54.870783 55.029815 55.130533 55.176045 55.246440 55.265837 55.343829 55.388925 55.391248 55.537247 55.564628 55.605074 55.840084 55.901013 55.921493 55.936404 56.024694 56.093654 56.144226 56.193420 56.213451 56.249913 56.352840 56.485030 56.509512 56.573793 56.602230 56.618002 56.689662 56.803822 56.869793 56.952835 57.029543 57.044632 57.157351 57.190442 57.199086 57.231286 57.274742 57.331380 57.421293 57.449362 57.572650 57.644249 57.711575 57.754438 57.761441 57.786438 57.804220 57.811517 58.096923 58.163638 58.199998 58.209587 58.313673 58.347365 58.353486 58.382049 58.420318 58.514799 58.547232 58.557792 58.620864 58.674371 58.737724 59.002202 59.002446 59.101800 59.213705 59.228571 59.341828 59.394062 59.440218 59.704544 59.905014 59.969640 60.018229 60.151690 60.190589 60.323402 60.332767 60.464803 60.611231 60.711796 60.841105 61.055473 61.080476 61.113791 61.181262 61.240033 61.243858 61.322816 61.494327 61.527054 61.575363 61.796317 61.841924 61.888114 61.972920 61.989880 62.008321 62.011743 62.101565 62.264570 62.358601 62.442120 62.460609 62.752948 62.937550 62.999214 63.020138 63.020857 63.216507 63.236656 63.274377 63.323308 63.349018 63.473286 63.566674 63.648110 63.745982 63.757636 63.799981 63.865724 63.905588 64.105229 64.187143 64.192561 64.436114 64.520947 64.619823 64.701845 64.810112 64.849559 64.868841 64.877222 65.021297 65.051286 65.175049 65.225624 65.293576 65.413371 65.500229 65.522940 65.626217 65.678272 65.735996 66.016573 66.024522 66.141089 66.184576 66.233188 66.268518 66.278548 66.290663 66.345973 66.464047 66.633360 66.641208 66.657640 66.715107 66.747865 66.802999 66.808030 67.056148 67.123081 67.193225 67.631511 67.687168 67.815593 67.925427 67.936315 68.151098 68.263673 68.401686 68.554872 68.697323 68.776501 68.839814 68.880797 68.954765 69.066538 69.097816 69.142473 69.171622 69.174686 69.212210 69.223861 69.261052 69.317934 69.332647 69.463183 69.478634 69.494074 69.530688 69.593935 69.604475 69.618605 69.640204 69.711704 69.735595 69.752979 69.779883 69.810978 69.818716 69.841351 69.861851 69.877594 69.906796 69.912885 69.920760 69.935438 69.975782 70.017397 70.029789 70.038673 70.042315 70.045116 70.099013 70.169644 70.218810 71.068994 71.128474 71.227756 71.381154 71.477393 71.539256 71.587322 71.655491 71.783515 72.053688 73.505060 73.937313 74.824543 75.546063 77.295702 77.716761 77.790036 77.817187 78.636959 79.068681 79.614906 79.809566 79.887497 80.151091 80.196767 80.610088 80.786873 80.926251 81.186405 81.264817 81.347577 81.361763 81.416534 81.583915 81.679554 81.720907 81.760165 81.793879 82.182851 82.468785 82.470275 82.507810 82.572501 82.618838 82.693714 82.804760 82.822526 82.872885 83.002554 83.044822 83.167589 83.239633 83.280260 83.311443 83.500304 83.569322 83.652189 83.722499 83.769996 83.916684 84.054369 84.062032 84.064941 84.175211 84.228481 84.357814 84.450069 84.533586 84.584108 84.668527 84.706732 84.876389 84.912816 85.120610 85.211329 85.491784 85.559299 85.629574 85.710150 85.795904 86.006865 86.190360 86.521047 86.540311 86.669134 86.738222 86.920971 87.086588 87.142944 87.237497 87.402063 87.562737 87.841347 88.092074 88.438802 88.497170 88.756859 88.827016 88.852034 88.863282 89.140758 89.152852 89.259785 89.299863 89.460088 89.504945 90.495956 90.786738 90.941305 91.001333 91.272021 91.457194 91.751438 91.792317 91.901735 92.049746 92.126809 92.343963 92.724300 92.914344 93.033989 93.101765 93.120725 93.175901 93.465698 93.573291 93.853914 93.884246 93.980568 94.110703 101.867182 103.592186 103.933483 104.007785 104.150434 104.175835 104.600768 104.625263 104.803209 104.847652 105.087386 105.103831 105.254522 105.489022 105.774316 105.843447 105.989576 106.090192 106.591813 107.177046 107.602845 108.089522 108.305930 108.501599 119.969140 120.025104 122.023666 122.123138 122.209571 122.390959 122.692705 123.062334 123.720243 123.721893 123.994276 124.070159 124.356613 124.632726 124.673939 124.715531 124.891465 125.001692 125.012345 125.023909 125.272382 125.501414 125.534245 125.671675 125.710430 126.148055 126.202867 126.231380 127.178264 127.452959 127.979189 128.004231 128.042162 128.234207 128.337600 128.337966 128.447929 128.459982 128.514322 128.767359 128.866498 129.069650 129.078346 129.191926 129.273228 129.307653 129.314444 129.682666 129.692401 129.910043 129.941144 130.266835 130.612759 130.829911 130.883222 131.129719 131.148197 131.316503 131.355100 131.470850 131.922194 132.290591 132.529699 132.591704 133.055720 133.131603 133.325141 133.332056 133.400599 133.552785 133.671403 133.938123 134.230849 134.393361 135.146204 135.204037 135.311159 135.396086 135.443930 135.476902 135.921432 135.989047 136.185592 136.333442 136.432852 136.556461 136.617257 136.801887 136.999526 137.045382 137.130959 137.271399 137.361151 137.604640 137.611440 137.790054 137.862051 138.075022 138.111766 138.153068 138.314828 138.388861 138.579714 138.681709 138.716449 138.881608 139.023433 139.046119 139.135877 139.162942 139.314475 139.384532 139.405500 139.541627 139.594938 139.636693 139.926044 140.006825 140.037952 140.112980 140.195475 140.532652 140.736418 140.848915 140.952819 140.996025 140.998974 141.174389 141.377865 141.478037 141.572865 141.644353 141.686986 142.138848 142.150242 142.263224 142.564202 142.752306 143.073956 143.361427 143.434956 143.552866 143.563825 143.746149 143.825501 144.131775 144.438426 144.513664 144.639283 144.673440 144.980571 145.174402 145.250136 145.583592 145.658964 146.093229 147.060280 147.182681 147.277657 147.354305 147.418901 147.480212 147.650478 147.761932 147.939582 148.231669 148.408391 148.806171 148.995534 149.103577 149.138100 149.398046 149.524855 149.564608 149.748865 149.809273 149.832116 150.013433 150.176175 150.273245 150.338564 150.361168 150.524365 150.593612 150.685361 150.865421 151.270636 151.324180 151.582113 152.890615 153.135304 153.864614 154.047835 154.162949 154.421595 154.429688 154.745841 154.920070 155.422908 155.655006 155.719057 155.815979 155.869913 155.889373 155.983105 156.025849 156.182707 156.201993 156.259571 156.356496 156.580500 156.664933 156.862540 157.080653 157.368703 157.729511 157.786047 158.094762 158.228451 158.269011 158.394117 158.505663 158.573922 158.648976 158.673363 158.743979 158.852284 158.982142 159.549998 159.737006 159.807266 160.381120 160.499066 160.713599 160.951044 161.126745 161.205077 161.740165 161.879786 162.160162 164.655461 165.136773 165.166122 165.495092 165.524026 165.645349 166.303932 166.454556 166.502388 167.421449 167.563078 167.894174 168.327699 168.424636 168.630551 168.849125 169.354323 169.696775 169.847979 169.862253 169.941656 170.232076 170.633768 170.640969 170.754915 171.588416 171.892360 171.953145 172.152672 172.458540 172.964919 173.109211 173.521468 173.597646 173.924290 174.415818 174.522468 174.567746 174.623279 174.950099 175.048967 175.638752 176.516726 176.703977 176.712293 177.055218 177.456664 178.198156 178.478961 178.521247 178.619542 179.559154 180.370525 181.360479 182.019391 182.229061 182.842765 183.228138 183.647490 183.681766 184.826348 185.202684 186.591594 186.633433 186.772688 187.437235 187.663847 189.451636 191.344229 322.522479 323.017581 325.274327 325.297875 325.894122 326.622058 358.344307 359.429691 475.258330 475.266606 475.267312 475.272997 475.286047 475.290344 475.351397 475.367941 475.377713 475.383376 475.405609 475.410103 475.535022 475.558461 475.615917 475.623274 475.763332 475.768228 475.782237 475.794582 477.913455 477.919975 477.926487 477.937087 477.960129 477.968732 477.987387 477.994332 478.042576 478.049662 478.115976 478.119737 478.266172 478.287662 478.295598 478.300832 478.350320 478.356803 478.379655 478.386668 478.408044 478.424621 478.426956 478.437550 478.508242 478.516079 478.591104 478.603284 478.622123 478.625082 478.649422 478.658734 478.766815 478.772512 478.862537 478.872130 478.903933 478.908475 478.909648 478.920066 480.820907 480.833844 480.958711 480.974430 481.069126 481.094358 481.149216 481.151428 481.159023 481.159680 481.317944 481.336357 481.518187 481.535817 481.636492 481.644350 481.794142 481.811585 482.503810 482.518807 485.012738 485.022563 485.055757 485.058589 485.240019 485.248397 485.416641 485.428169 485.434954 485.454909 485.545259 485.578626 485.961228 486.004258 486.096866 486.135088 486.247726 486.267577 486.295913 486.338842 486.435164 486.452020 486.468974 486.492013 486.496708 486.511955 486.527007 486.557531 486.667715 486.679341 486.776741 486.822487 486.866859 486.933091 487.222295 487.296029 487.304038 487.377106 487.517826 487.565096 489.477008 489.488210 489.581262 489.602061 489.662291 489.688532 489.756238 489.791649 489.983001 490.007398 490.022418 490.053525 490.076891 490.082348 490.107265 490.145728 490.199289 490.232259 490.324123 490.338538 924.230964 929.810495 930.088823 930.608184 930.945407 933.038516 934.024246 934.301966 934.637336 935.704478 935.787651 938.452201 938.891071 939.558057 939.982292 940.531551 940.684634 941.241318 942.107204 942.764991 942.793284 943.205085 943.510232 943.513602 944.141922 944.713224 945.207079 945.283500 946.009286 946.072990 946.145579 946.272287 946.336388 946.817112 947.146428 947.813089 948.122835 948.161464 948.931524 949.137057 949.174798 949.339884 950.136711 952.587897 953.138283 954.772981 955.204999 955.794526 956.351313 956.362435 956.463577 957.431898 957.968462 958.859914 959.272974 959.749640 960.380023 960.596461 960.697566 961.495719 962.064312 962.573459 962.866188 973.961051 974.364329 976.122380 977.096855 978.180048 978.796804 978.951419 979.892087 983.765266 984.229880 986.040561 987.721629 989.189379 989.560280 989.866109 990.376247 105112.133615 105112.320140 105125.829937 105134.913933 105142.487685 105144.103148 105154.278936 105155.340867 105159.324871 105161.840696 105164.757601 105165.808036 105165.856653 105167.597388 105168.943738 105170.278641 105170.420495 105173.560724 105173.739219 105178.187992</array>
                     <array dataType="xsd:string" dictRef="cc:irrep" size="5226">A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A</array>
                     <array dataType="xsd:string" dictRef="cc:spin" size="5226">A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B B</array>
                  </list>
               </module>
               <module cmlx:templateRef="logfile" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double"
                          dictRef="cc:potentialEnergy"
                          units="nonsi:hartree">-34.23305352</scalar>
                  <scalar dataType="xsd:double"
                          dictRef="cc:potentialEnergy"
                          units="nonsi:electronvolt">-931.529278</scalar>
                  <scalar dataType="xsd:integer" dictRef="a:charge">-10</scalar>
                  <scalar dataType="xsd:string" dictRef="a:converged">GEOMETRY CONVERGED</scalar>
               </module>
               <module cmlx:templateRef="fit.test">
                  <scalar dataType="xsd:double" dictRef="cc:sumfragments">0.00000000147974</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:ortho">0.00099192272428</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:fitscf">0.00034650847764</scalar>
               </module>
               <module cmlx:templateRef="mulliken">
                  <module cmlx:templateRef="charges">
                     <list cmlx:templateRef="row" id="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="107">1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="107">W W W W W O O Tc O Tc O P O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O W W Tc W W O O W O W W W W W W W W W W O O O O O O O Tc O O O O O O O O O P O O O O O O O O O H H</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="107">2.4789 2.4324 2.4615 2.4538 2.4450 -0.7817 -0.7837 1.9799 -1.0198 1.9603 -0.9685 2.3897 -0.9579 -0.9660 -0.9719 -0.9663 -0.9684 -0.9635 -0.7833 -0.9590 -0.9684 -0.9588 -0.9449 -0.9371 -0.9632 -1.0198 -0.8972 -1.0458 -0.9368 -0.7858 -0.9405 -0.7837 -0.9368 -1.0446 -0.7781 -0.7833 -0.7830 -0.7833 -0.9447 -1.0446 -0.9590 -0.9405 -0.7833 -0.9407 -0.9368 -0.7782 -0.9352 -0.9579 -0.9720 -0.9684 -0.7781 -0.7834 -0.9590 -0.9683 -0.9587 -0.7858 -0.7837 -0.7780 -0.7831 2.4787 2.4455 1.9850 2.4551 2.4611 -1.0443 -0.9663 2.4316 -0.9715 2.4789 2.4452 2.4551 2.4787 2.4326 2.4616 2.4538 2.4451 2.4611 2.4314 -0.9581 -0.9715 -0.9684 -0.7856 -0.9686 -0.9590 -0.9407 1.9656 -0.9369 -0.9352 -0.7842 -0.9661 -0.9632 -0.9587 -0.7857 -0.7843 -1.0443 2.3822 -0.9582 -0.7833 -0.9636 -0.9587 -0.9447 -1.0466 -0.9449 -0.9372 -0.9684 0.2857 0.2831</array>
                        <array dataType="xsd:double" dictRef="a:spinDensity" size="107">0.0176 0.0275 0.0291 0.0283 0.0298 0.0597 0.0644 2.4062 -0.0023 2.4196 0.0017 0.0076 0.0026 0.0363 0.0092 0.0338 0.0017 0.0314 0.0160 0.0016 0.0019 0.0019 0.0615 0.0587 0.0319 -0.0020 0.0981 -0.0106 0.0640 0.0218 0.0689 0.0122 0.0640 -0.0001 -0.0011 0.0157 0.0149 0.0147 0.0605 -0.0001 0.0016 0.0688 0.0147 0.0687 0.0644 -0.0011 0.0601 0.0026 0.0092 0.0017 -0.0011 0.0161 0.0016 0.0019 0.0019 0.0218 0.0122 -0.0011 0.0149 0.0176 0.0295 2.4087 0.0286 0.0291 -0.0000 0.0333 0.0273 0.0090 0.0175 0.0295 0.0287 0.0176 0.0274 0.0291 0.0283 0.0297 0.0291 0.0273 0.0026 0.0090 0.0020 0.0222 0.0017 0.0016 0.0688 2.3998 0.0644 0.0601 0.0131 0.0365 0.0321 0.0019 0.0222 0.0131 -0.0000 0.0060 0.0026 0.0157 0.0313 0.0019 0.0606 -0.0113 0.0615 0.0586 0.0020 0.0075 0.0076</array>
                        <array dataType="xsd:string" dictRef="a:spin" size="214">A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B A B</array>
                        <array dataType="xsd:double" dictRef="a:orbitalS" size="214">1.0438 1.0433 1.0491 1.0486 1.0440 1.0437 1.0458 1.0457 1.0467 1.0463 0.9476 0.9448 0.9473 0.9449 1.0383 0.9932 0.9481 0.9473 1.0485 1.0015 0.9709 0.9710 1.2499 1.2481 0.9655 0.9657 0.9715 0.9711 0.9700 0.9699 0.9709 0.9705 0.9709 0.9710 0.9661 0.9657 0.9840 0.9838 0.9660 0.9661 0.9709 0.9709 0.9662 0.9662 0.9710 0.9708 0.9721 0.9734 0.9659 0.9655 0.9482 0.9473 0.9815 0.9725 0.9490 0.9490 0.9737 0.9747 0.9836 0.9833 0.9691 0.9702 0.9837 0.9835 0.9737 0.9747 0.9474 0.9474 0.9841 0.9842 0.9839 0.9838 0.9840 0.9838 0.9839 0.9838 0.9710 0.9708 0.9474 0.9474 0.9660 0.9661 0.9691 0.9702 0.9839 0.9838 0.9689 0.9702 0.9737 0.9747 0.9841 0.9842 0.9725 0.9737 0.9655 0.9657 0.9700 0.9699 0.9709 0.9710 0.9841 0.9842 0.9840 0.9838 0.9660 0.9661 0.9709 0.9709 0.9662 0.9663 0.9836 0.9833 0.9837 0.9835 0.9841 0.9842 0.9840 0.9838 1.0439 1.0433 1.0466 1.0462 1.0383 0.9923 1.0454 1.0452 1.0442 1.0439 0.9474 0.9474 0.9709 0.9705 1.0496 1.0493 0.9700 0.9699 1.0438 1.0433 1.0466 1.0462 1.0454 1.0452 1.0439 1.0433 1.0491 1.0485 1.0440 1.0437 1.0458 1.0457 1.0467 1.0463 1.0442 1.0439 1.0497 1.0493 0.9656 0.9657 0.9700 0.9699 0.9709 0.9709 0.9835 0.9832 0.9709 0.9710 0.9660 0.9661 0.9689 0.9702 1.0468 1.0005 0.9737 0.9747 0.9725 0.9737 0.9838 0.9836 0.9715 0.9711 0.9658 0.9655 0.9662 0.9663 0.9835 0.9832 0.9838 0.9836 0.9474 0.9474 1.2497 1.2485 0.9655 0.9657 0.9839 0.9838 0.9661 0.9657 0.9662 0.9663 0.9710 0.9708 0.9490 0.9492 0.9710 0.9708 0.9721 0.9734 0.9708 0.9709 0.3051 0.2990 0.3063 0.3001</array>
                        <array dataType="xsd:double" dictRef="a:orbitalP" size="214">3.0466 3.0458 3.0554 3.0530 3.0511 3.0473 3.0506 3.0472 3.0542 3.0515 2.4560 2.4026 2.4599 2.4012 3.0749 3.0262 2.5402 2.5441 3.0846 3.0306 2.4979 2.4964 3.6456 3.6405 2.5004 2.4976 2.5135 2.4776 2.5058 2.4966 2.5132 2.4798 2.4979 2.4964 2.5160 2.4851 2.3978 2.3817 2.4990 2.4977 2.4980 2.4963 2.4989 2.4972 2.5141 2.4582 2.5072 2.4514 2.5164 2.4849 2.5402 2.5440 2.4967 2.4203 2.5479 2.5594 2.5078 2.4474 2.4024 2.3806 2.5172 2.4529 2.3963 2.3841 2.5078 2.4475 2.5542 2.5542 2.3861 2.3872 2.3976 2.3819 2.3970 2.3822 2.3971 2.3825 2.5135 2.4585 2.5542 2.5542 2.4990 2.4977 2.5172 2.4530 2.3971 2.3825 2.5173 2.4531 2.5080 2.4473 2.3862 2.3873 2.5067 2.4494 2.5004 2.4976 2.5058 2.4966 2.4979 2.4964 2.3862 2.3873 2.3978 2.3818 2.4990 2.4977 2.4980 2.4963 2.4988 2.4972 2.4024 2.3807 2.3963 2.3841 2.3861 2.3872 2.3971 2.3822 3.0467 3.0459 3.0542 3.0514 3.0798 3.0302 3.0505 3.0473 3.0511 3.0474 2.5541 2.5541 2.5129 2.4800 3.0550 3.0524 2.5055 2.4965 3.0466 3.0458 3.0542 3.0515 3.0505 3.0473 3.0466 3.0458 3.0553 3.0530 3.0511 3.0473 3.0506 3.0471 3.0542 3.0515 3.0511 3.0474 3.0551 3.0525 2.5005 2.4977 2.5055 2.4964 2.4981 2.4963 2.4026 2.3805 2.4980 2.4964 2.4990 2.4977 2.5173 2.4531 3.0841 3.0309 2.5080 2.4473 2.5067 2.4494 2.3969 2.3838 2.5136 2.4776 2.5165 2.4848 2.4988 2.4972 2.4026 2.3805 2.3969 2.3839 2.5541 2.5541 3.6490 3.6446 2.5005 2.4977 2.3976 2.3819 2.5160 2.4851 2.4988 2.4971 2.5136 2.4585 2.5480 2.5598 2.5141 2.4582 2.5072 2.4514 2.4981 2.4963 0.0558 0.0544 0.0560 0.0545</array>
                        <array dataType="xsd:double" dictRef="a:orbitalD" size="214">1.6643 1.6481 1.6785 1.6541 1.6741 1.6494 1.6763 1.6518 1.6769 1.6504 0.0170 0.0135 0.0168 0.0136 3.6000 1.2876 0.0205 0.0197 3.5966 1.2779 0.0163 0.0160 0.4134 0.4127 0.0144 0.0143 0.0161 0.0162 0.0148 0.0149 0.0160 0.0160 0.0163 0.0160 0.0154 0.0153 0.0180 0.0181 0.0153 0.0149 0.0162 0.0160 0.0153 0.0150 0.0181 0.0127 0.0185 0.0144 0.0153 0.0152 0.0205 0.0197 0.0195 0.0068 0.0208 0.0198 0.0189 0.0142 0.0179 0.0181 0.0184 0.0126 0.0180 0.0181 0.0189 0.0142 0.0207 0.0207 0.0182 0.0182 0.0180 0.0181 0.0180 0.0181 0.0180 0.0181 0.0181 0.0127 0.0207 0.0207 0.0153 0.0149 0.0184 0.0126 0.0180 0.0181 0.0185 0.0127 0.0189 0.0142 0.0182 0.0182 0.0184 0.0144 0.0144 0.0143 0.0148 0.0149 0.0163 0.0160 0.0182 0.0182 0.0180 0.0181 0.0153 0.0149 0.0162 0.0160 0.0153 0.0150 0.0179 0.0181 0.0180 0.0181 0.0182 0.0182 0.0180 0.0181 1.6642 1.6481 1.6767 1.6505 3.5937 1.2806 1.6763 1.6514 1.6741 1.6494 0.0207 0.0207 0.0160 0.0160 1.6787 1.6545 0.0148 0.0149 1.6642 1.6481 1.6767 1.6505 1.6763 1.6513 1.6643 1.6481 1.6785 1.6541 1.6741 1.6494 1.6763 1.6518 1.6769 1.6505 1.6741 1.6494 1.6787 1.6545 0.0143 0.0143 0.0148 0.0149 0.0162 0.0160 0.0178 0.0180 0.0163 0.0160 0.0153 0.0149 0.0185 0.0127 3.5862 1.2859 0.0189 0.0142 0.0185 0.0144 0.0180 0.0181 0.0161 0.0162 0.0153 0.0152 0.0153 0.0150 0.0178 0.0180 0.0180 0.0181 0.0207 0.0207 0.4133 0.4128 0.0143 0.0143 0.0180 0.0181 0.0154 0.0153 0.0153 0.0150 0.0181 0.0127 0.0206 0.0199 0.0181 0.0127 0.0185 0.0144 0.0162 0.0160 0.0000 0.0000 0.0000 0.0000</array>
                        <array dataType="xsd:double" dictRef="a:orbitalF" size="214">7.0147 7.0146 7.0145 7.0144 7.0146 7.0142 7.0146 7.0142 7.0146 7.0144 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 7.0147 7.0146 7.0146 7.0144 0.0000 0.0000 7.0146 7.0143 7.0145 7.0142 0.0000 0.0000 0.0000 0.0000 7.0145 7.0143 0.0000 0.0000 7.0147 7.0146 7.0146 7.0144 7.0146 7.0143 7.0147 7.0146 7.0145 7.0144 7.0146 7.0142 7.0146 7.0142 7.0146 7.0144 7.0145 7.0142 7.0145 7.0143 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000 0.0000</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="sfo.population">
                  <module cmlx:templateRef="molecular.orbitals">
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.612</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">247</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="6">57.41 21.75 7.04 2.23 2.02 1.97</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="6">1 1 2 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="6">S S P:x S S D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="6"
                               units="nonsi:electronvolt">-24.020 -24.020 -5.506 -24.020 -24.020 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="6">2.00 2.00 1.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="6">40 38 104 52 46 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="6">O O P O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.611</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">248</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="6">58.23 20.32 7.13 2.56 2.31 1.94</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="6">1 1 2 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="6">S S P:x S S D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="6"
                               units="nonsi:electronvolt">-24.020 -24.020 -5.506 -24.020 -24.020 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="6">2.00 2.00 1.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="6">96 23 105 90 72 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="6">O O P O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.576</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">249</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">40.88 40.64 8.23 2.29</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 2 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S P:y D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -24.020 -5.506 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 2.00 1.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">52 46 104 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O O P P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.575</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">250</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">40.99 40.52 8.23 2.29</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 2 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S P:y D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -24.020 -5.506 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 2.00 1.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">90 72 105 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O O P P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.502</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">251</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="6">41.16 17.92 17.43 6.66 5.23 2.18</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="6">1 1 1 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="6">S S S P:z S D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="6"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -5.506 -24.020 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="6">2.00 2.00 2.00 1.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="6">38 46 52 104 40 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="6">O O O P O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.499</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">252</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="6">42.62 17.72 16.97 6.55 4.44 2.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="6">1 1 1 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="6">S S S P:z S D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="6"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -5.506 -24.020 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="6">2.00 2.00 2.00 1.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="6">23 72 90 105 96 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="6">O O O P O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.728</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">253</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">7.40 7.37 7.27 7.26 5.60 5.59 5.56 5.54 5.43 5.31 3.68 3.61 3.42 3.41 1.61 1.60 1.48 1.48 1.48 1.48 1.05 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">67 34 65 32 62 29 66 33 26 28 30 37 60 25 61 27 45 41 98 36 54 43</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.726</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">254</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">7.38 7.32 7.25 7.22 5.66 5.66 5.58 5.58 5.39 5.22 3.76 3.68 3.36 3.35 1.65 1.65 1.47 1.47 1.43 1.43 1.09 1.08 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">94 87 53 80 24 79 99 77 85 73 93 86 91 75 76 74 57 82 83 59 81 56 95 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.456</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">255</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">11.23 11.14 11.12 11.12 7.56 7.52 7.45 7.43 3.66 3.63 1.93 1.93 1.76</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">S S S S S S S S S S S S P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">32 67 34 65 29 62 66 33 25 60 52 46 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O O O O O O O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.454</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">256</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">11.21 11.20 11.15 10.99 7.69 7.59 7.46 7.42 3.60 3.57 1.95 1.92 1.76</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">S S S S S S S S S S S S P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">53 80 94 87 79 24 77 99 91 75 72 90 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O O O O O O O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.438</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">257</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">82.69 11.73 2.83 1.38</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -6.493 -9.089 11.031</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 1.00 1.33 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">22 106 22 106</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O H O H</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.426</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">258</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">81.57 11.54 2.68 1.49</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -6.493 -9.089 11.031</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 1.00 1.33 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">21 107 21 107</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O H O H</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.363</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">259</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">12.60 8.75 8.61 4.91 4.90 4.78 4.75 4.32 3.84 3.83 2.99 2.97 2.31 2.30 1.97 1.96 1.93 1.93 1.85 1.34 1.33 1.19 1.06 1.06 1.05 1.04 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">S S S S S S S S S S S S S S S S S S P:z S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">37 28 30 61 27 60 25 26 33 66 65 32 54 43 97 35 29 62 104 98 36 40 46 52 67 34 38 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O P O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.361</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">260</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">12.11 9.04 6.91 5.85 4.94 4.92 4.75 4.68 3.40 3.33 2.31 2.30 2.29 2.25 2.20 2.16 1.94 1.93 1.81 1.67 1.62 1.46 1.24 1.21 1.19 1.13 1.11 1.07 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">S S S S S S S S S S S S S S S S S S P:z S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">93 86 85 73 74 76 75 91 24 79 51 95 87 94 99 77 56 81 105 80 53 21 23 82 57 83 59 90 72</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O P O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.359</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">261</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">11.44 10.50 7.37 7.30 7.28 7.26 6.68 6.38 5.39 5.35 5.34 5.33 1.94 1.94</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">S S S S S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">30 26 62 29 34 67 28 37 65 33 32 66 14 1</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.357</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">262</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">9.93 9.07 8.08 7.75 6.97 6.90 6.59 6.51 6.00 6.00 5.95 5.91 1.96 1.96</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">S S S S S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">86 73 93 85 77 99 53 80 94 87 24 79 6 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.228</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">263</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">11.50 10.95 10.81 10.81 3.13 3.12 2.97 2.96 2.90 2.89 2.57 2.56 2.56 2.55 2.52 2.52 2.42 2.41 1.89 1.88 1.42</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">S S S S S S S S S S S S S S S S S S S S P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">37 28 26 30 65 32 66 33 34 67 97 62 35 29 41 45 54 43 98 36 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.226</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">264</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">11.24 11.13 10.98 10.72 3.26 3.18 3.09 3.04 2.75 2.72 2.56 2.51 2.51 2.50 2.50 2.49 2.41 2.40 1.99 1.98 1.34</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">S S S S S S S S S S S S S S S S S S S S P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">73 86 85 93 53 80 94 87 77 99 79 81 56 24 95 51 57 82 59 83 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.160</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">265</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">5.88 5.76 4.98 4.81 4.81 4.70 4.07 3.97 3.96 3.87 2.99 2.88 2.68 2.64 2.29 2.29 2.22 2.15 1.87 1.83 1.52 1.38 1.28 1.22 1.10 1.09 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">41 45 25 36 60 98 97 35 54 43 61 27 67 34 32 65 29 62 33 66 82 57 75 83 91 59 51 56</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.157</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">266</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">6.39 5.67 5.33 5.19 4.41 4.31 4.21 4.21 3.74 3.59 3.38 2.56 2.54 2.45 2.38 2.36 2.28 2.24 1.89 1.80 1.53 1.38 1.32 1.28 1.08 1.07 1.07 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">82 75 57 83 51 56 91 59 95 81 74 94 76 87 79 53 77 80 24 99 41 25 45 36 60 97 98 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.156</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">267</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">12.92 12.43 6.74 6.44 6.15 5.84 5.82 5.47 3.74 3.50 3.47 3.31 3.15 2.92 2.85 2.72</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">60 25 27 61 98 45 36 41 43 54 66 33 35 97 62 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.154</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">268</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">13.23 11.60 7.36 6.42 6.35 6.19 5.28 4.99 4.25 3.56 3.50 3.44 3.02 2.97 2.76 2.45</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">91 75 76 74 59 57 83 82 81 99 95 56 77 24 51 79</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.065</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">269</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">11.62 11.60 11.58 11.58 10.48 10.47 10.05 10.01 3.60 3.59</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">34 65 32 67 62 29 33 66 1 14</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.063</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">270</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">11.64 11.59 11.52 11.52 10.50 10.47 10.10 10.06 3.60 3.60</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">87 94 80 53 24 79 77 99 11 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.944</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">271</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">9.62 9.62 4.89 4.87 4.75 4.73 4.18 4.18 3.90 3.88 2.56 2.55 2.20 2.18 1.96 1.96 1.92 1.92 1.46 1.44 1.28 1.27 1.22 1.20 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">61 27 76 74 25 60 43 54 97 35 91 75 81 56 45 41 95 51 36 98 34 67 32 65 57 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.944</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">272</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">9.41 9.39 4.98 4.98 4.96 4.94 4.23 4.21 3.70 3.69 2.48 2.46 2.17 2.16 2.09 2.06 2.02 2.01 1.50 1.48 1.27 1.26 1.14 1.14 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">76 74 27 61 91 75 81 56 51 95 25 60 43 54 57 82 97 35 83 59 94 87 80 53 45 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.865</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">273</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">6.94 6.93 5.68 5.64 5.08 5.07 4.66 4.64 4.12 4.11 3.20 3.19 3.10 3.00 2.99 2.39 2.31 1.94 1.92 1.83 1.12 1.10 1.08 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">41 45 54 43 98 36 82 57 56 81 97 35 26 83 59 37 85 95 51 86 28 30 66 33</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.861</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">274</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">7.24 7.21 6.42 6.42 4.79 4.79 4.18 4.18 3.95 3.92 3.59 3.23 3.22 2.99 2.73 2.71 2.14 2.05 2.04 1.73 1.27 1.24</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">82 57 56 81 45 41 83 59 54 43 85 98 36 86 95 51 26 97 35 37 99 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.839</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">275</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">7.70 7.12 7.11 6.80 6.78 6.34 6.28 6.23 4.52 3.94 3.94 3.89 2.62 2.59 2.31 2.30 1.53 1.51 1.35 1.33 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">28 97 35 60 25 30 27 61 26 98 36 37 43 54 62 29 65 32 66 33 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.837</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">276</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">8.05 7.97 7.93 6.92 6.74 6.72 6.00 5.98 4.88 4.85 3.71 3.45 2.38 2.36 1.86 1.85 1.71 1.70 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">73 51 95 93 91 75 74 76 83 59 85 86 24 79 56 81 80 53 99 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.694</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">277</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">11.64 11.54 10.72 10.70 7.16 7.09 6.70 6.69 2.84 2.80 2.78 2.76 2.52 2.49 1.93 1.92</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">45 41 98 36 62 29 33 66 32 65 67 34 69 44 49 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.690</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">278</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">10.22 10.17 9.26 9.09 7.96 7.96 7.19 7.01 3.75 3.74 3.47 3.36 2.54 2.53 1.89 1.86</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">82 57 83 59 24 79 77 99 80 53 94 87 89 84 50 55</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.687</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">279</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">18.11 16.72 15.31 15.12 3.98 3.97 1.86 1.81 1.81 1.78 1.32 1.28 1.11 1.09 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">28 30 37 26 70 47 29 65 62 32 66 33 34 67 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.686</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">280</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">18.52 16.79 15.02 14.91 3.97 3.95 1.99 1.88 1.87 1.79 1.31 1.27 1.09 1.09 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">73 93 85 86 58 63 79 53 24 80 99 77 81 56 87 94</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.675</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">281</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">10.33 10.22 10.03 9.94 5.77 5.71 4.69 4.60 4.30 4.27 4.21 4.13 2.11 2.09 1.73 1.73 1.45 1.45 1.45 1.36 1.34 1.22</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S D:yz S S D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.613 -24.020 -24.020 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 2.00 2.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">54 43 97 35 65 32 98 36 67 34 45 41 29 62 31 64 68 42 100 33 66 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O Tc O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.675</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">282</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">10.61 10.59 10.43 10.41 5.90 5.90 5.28 5.28 4.98 4.94 3.42 3.41 1.64 1.63 1.63 1.38 1.37 1.37 1.26 1.25</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S D:yz S S S D:yz S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.613 -24.020 -24.020 -24.020 -6.613 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 2.00 2.00 2.00 1.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">56 81 95 51 83 59 57 82 53 80 87 94 102 48 92 79 103 24 78 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O Tc O O O Tc O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.633</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">283</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">6.13 6.09 6.04 5.58 5.47 5.06 5.06 4.97 4.93 4.20 3.64 3.62 3.57 3.46 3.45 3.43 3.38 2.84 2.78 2.43 1.12 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">35 97 26 43 54 36 41 45 98 37 28 33 66 32 67 34 65 62 29 30 1 14</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.631</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">284</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">6.19 6.04 5.96 5.32 5.32 5.30 5.24 5.19 5.08 4.45 3.66 3.55 3.55 3.48 3.43 3.34 3.25 2.86 2.62 2.26 1.11 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">85 51 95 57 81 59 83 56 82 86 77 99 94 80 87 73 53 24 79 93 6 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.612</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">285</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">11.11 11.04 9.95 9.89 9.63 9.57 7.84 7.79 1.97 1.95 1.95 1.92 1.56 1.54 1.48 1.46</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">66 33 34 67 29 62 65 32 41 35 45 97 98 36 54 43</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.610</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">286</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">11.44 11.16 10.29 10.07 9.38 9.28 7.71 7.58 2.04 1.98 1.93 1.86 1.57 1.50 1.48 1.42</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">99 77 87 94 79 24 53 80 82 95 57 51 59 56 83 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.469</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">287</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">45.31 42.08 2.54 2.35</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">70 47 14 1</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.469</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">288</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">11.31 10.44 10.06 7.61 5.49 5.43 5.36 5.31 4.53 4.46 3.27 3.21 2.45 2.43 1.49 1.47 1.45 1.41 1.23 1.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">28 37 30 26 97 35 54 43 41 45 36 98 65 32 33 66 67 34 29 62</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.468</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">289</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">11.34 10.16 10.01 7.47 5.55 5.14 5.14 4.98 4.70 4.42 3.27 3.26 2.53 2.33 2.17 1.57 1.52 1.40 1.38 1.24 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">73 86 93 85 51 56 81 95 82 57 59 83 80 53 58 99 94 77 79 87 24</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.468</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">290</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">43.93 42.56 2.46 2.37</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">58 63 11 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.460</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">291</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">41.00 37.82 2.61 2.42 2.30 1.74 1.13 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">S S D:x2-y2 D:x2-y2 S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -4.498 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">2.00 2.00 0.80 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">47 70 1 14 26 37 34 67</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.458</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">292</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">41.13 37.60 2.63 2.41 2.38 1.86 1.14 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">S S D:x2-y2 D:x2-y2 S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -4.498 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">2.00 2.00 0.80 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">63 58 6 11 85 86 94 87</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.440</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">293</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">8.39 8.35 7.73 7.68 4.29 4.26 4.24 4.21 3.82 3.73 3.71 3.71 3.70 3.66 3.08 3.08 2.95 2.94 1.80 1.75 1.73 1.73</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">35 97 43 54 62 29 32 65 69 45 41 66 33 44 34 67 36 98 31 42 64 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.440</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">294</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">8.28 8.19 7.58 7.48 4.40 4.39 4.34 4.32 3.99 3.91 3.70 3.64 3.59 3.47 3.24 3.21 3.13 3.05 1.78 1.75 1.57 1.55</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">95 51 81 56 24 80 79 53 57 82 99 89 77 84 59 83 87 94 92 48 78 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.407</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">295</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="11">43.00 30.76 2.62 2.04 1.86 1.81 1.42 1.31 1.30 1.28 1.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="11">1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="11">S S S S D:yz S S S D:yz S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="11"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="11">2.00 2.00 2.00 2.00 0.80 2.00 2.00 2.00 0.80 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="11">69 44 98 36 15 71 49 31 2 64 42</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="11">O O O O W O O O W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.404</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">296</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">44.01 31.88 2.16 1.99 1.68 1.59 1.59 1.34 1.27 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">S S D:yz S S D:yz S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -24.020 -24.020 -4.498 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">2.00 2.00 0.80 2.00 2.00 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">44 69 2 49 36 15 68 71 42 98</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O W O O W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.403</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">297</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="11">42.85 30.93 2.58 2.02 1.94 1.86 1.45 1.42 1.33 1.31 1.24</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="11">1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="11">S S S S S D:yz S S S D:yz S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="11"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020 -24.020 -4.498 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="11">2.00 2.00 2.00 2.00 2.00 0.80 2.00 2.00 2.00 0.80 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="11">89 84 59 83 55 10 48 92 50 20 78</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="11">O O O O O W O O O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.400</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">298</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">43.73 31.52 2.14 1.95 1.87 1.65 1.60 1.58 1.46 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">S S D:yz S S S S D:yz S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">2.00 2.00 0.80 2.00 2.00 2.00 2.00 0.80 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">84 89 20 50 88 83 55 10 78 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O W O O O O W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.385</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">299</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">40.49 36.51 2.50 2.46 1.82 1.77 1.64 1.59 1.45 1.34</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">S S S S S D:yz S D:yz S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -4.498 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">2.00 2.00 2.00 2.00 2.00 0.80 2.00 0.80 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">49 71 42 68 41 5 45 18 64 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O W O W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.382</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">300</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">44.56 31.51 2.79 2.71 2.19 1.96 1.93 1.39 1.36 1.20</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">S S S S S D:yz S S D:yz S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020 -4.498 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">2.00 2.00 2.00 2.00 2.00 0.80 2.00 2.00 0.80 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">55 50 78 88 92 7 57 82 12 48</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O W O O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.379</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">301</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="11">34.15 30.31 4.56 4.07 2.59 2.46 1.77 1.60 1.47 1.43 1.35</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="11">1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="11">S S S S S S S D:yz S D:yz S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="11"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -4.498 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="11">2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 2.00 0.80 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="11">71 49 31 64 44 69 50 18 45 5 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="11">O O O O O O O W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.375</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">302</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">36.40 24.93 6.23 5.28 2.78 2.51 1.89 1.78 1.70 1.56 1.18 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S D:yz S D:yz S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -4.498 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 2.00 0.80 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">50 55 48 92 84 89 71 49 12 82 7 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.360</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">303</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">32.74 30.01 3.23 3.20 2.07 2.01 1.22 1.21 1.12 1.10 1.08 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S D:xz S S D:xz S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020 -4.498 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 0.80 2.00 2.00 0.80 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">42 68 60 25 49 71 4 78 88 17 45 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O W O O W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.358</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">304</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">36.07 32.63 2.23 2.21 1.84 1.73 1.59 1.47 1.40 1.26 1.11 1.07 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">S S S S S S S S D:xz D:xz S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">78 88 91 75 50 42 68 55 13 8 89 84 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O O O O O W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.354</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">305</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">26.28 18.31 10.43 9.03 3.47 2.81 2.68 2.02 1.95 1.32 1.13 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S D:xz S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">31 64 92 48 68 71 49 50 55 42 3 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.353</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">306</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="11">25.98 21.81 12.76 8.48 4.05 3.86 1.13 1.10 1.07 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="11">1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="11">S S S S S S D:xz S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="11"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="11">2.00 2.00 2.00 2.00 2.00 2.00 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="11">92 48 31 64 50 55 19 71 49 95 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="11">O O O O O O W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.351</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">307</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">18.80 17.47 14.00 11.90 7.64 7.06 5.65 3.35</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">88 78 48 92 42 68 64 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.351</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">308</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">19.69 18.69 15.18 8.14 7.47 6.52 5.71 4.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">42 68 64 31 88 78 48 92</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.341</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">309</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">20.15 18.65 12.29 11.21 4.28 4.13 4.00 3.84 2.24 1.98 1.50 1.48 1.37 1.28 1.16 1.09 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">S S S S S S S S S S S S D:xz D:xz S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">48 92 88 78 51 95 56 81 50 55 82 57 9 19 84 89 83</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O O O O O O O O O W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.341</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">310</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">22.18 20.92 11.38 9.22 4.51 4.30 4.02 3.77 1.64 1.62 1.48 1.45 1.43 1.19 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">S S S S S S S S S S S D:xz D:xz S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">64 31 68 42 97 35 54 43 49 71 45 16 3 41 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">O O O O O O O O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.339</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">311</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">7.11 5.32 5.24 5.15 5.08 4.89 4.53 4.19 3.88 3.85 3.58 3.54 3.54 3.53 3.46 3.07 3.06 2.92 2.61 2.35 1.71 1.45</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">30 29 26 64 62 28 37 42 25 60 66 33 68 32 65 34 67 31 98 36 41 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.337</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">312</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">7.62 6.12 6.07 6.00 5.87 4.74 4.25 4.22 4.00 3.98 3.72 3.71 3.59 3.54 2.76 2.64 2.56 2.52 2.12 1.80 1.53 1.47</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">93 79 24 85 73 86 80 53 77 99 75 91 87 94 88 78 59 83 48 92 82 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.314</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">313</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">6.74 6.74 5.43 5.41 5.01 3.01 3.00 2.64 2.63 2.38 2.37 2.11 2.08 2.07 1.77 1.76 1.76 1.60 1.52 1.51 1.44 1.42 1.38 1.35 1.29 1.10 1.08 1.07 1.07 1.02 1.02 1.02 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">25 60 61 27 39 91 75 76 74 98 36 30 65 32 34 67 28 26 62 29 41 45 68 42 37 64 59 93 83 33 66 80 53 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.306</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">314</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">8.77 8.76 6.34 6.31 4.49 4.49 3.25 3.21 3.01 3.00 2.15 2.15 1.63 1.62 1.54 1.53 1.48 1.42 1.40 1.25 1.24 1.20 1.20 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">91 75 76 74 25 60 59 83 61 27 82 57 98 36 80 53 93 88 78 41 45 87 94 73</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.276</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">315</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">9.98 9.21 9.00 8.97 8.36 8.35 8.33 7.35 7.32 6.60 6.51 6.49</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">37 26 33 66 34 30 67 29 62 28 32 65</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.274</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">316</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">10.05 9.39 9.08 9.08 8.50 8.43 8.17 7.22 7.21 6.51 6.42 6.39</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">86 85 99 77 87 94 93 24 79 73 80 53</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.201</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">317</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="3">86.50 1.37 1.32</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="3">1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="3">S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="3"
                               units="nonsi:electronvolt">-24.020 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="3">2.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="3">39 103 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="3">O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.168</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">318</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">20.22 20.18 10.67 10.65 9.05 9.04 4.35 4.35 1.34 1.33 1.10 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">60 25 98 36 41 45 27 61 35 97 100 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.162</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">319</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">19.87 19.77 10.57 10.56 8.71 8.65 4.82 4.79 1.59 1.57 1.12 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">75 91 83 59 82 57 76 74 95 51 102 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.080</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">320</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">18.40 18.25 8.32 8.24 7.93 7.83 4.33 4.25 3.88 3.80 3.10 3.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">76 74 81 56 95 51 91 75 59 83 57 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.079</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">321</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">18.82 18.76 8.51 8.49 7.96 7.95 3.96 3.96 3.61 3.60 2.91 2.90</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">61 27 54 43 97 35 25 60 36 98 41 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.018</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">322</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">18.89 18.63 10.90 10.78 10.71 10.60 3.00 2.98 2.72 2.69 2.23 2.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">74 76 56 81 51 95 83 59 75 91 82 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.016</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">323</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">19.21 19.18 11.21 11.18 10.73 10.69 2.68 2.68 2.36 2.35 2.01 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">27 61 43 54 35 97 98 36 60 25 45 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-14.673</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">324</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">8.59 8.09 7.27 7.25 7.11 6.54 3.90 3.89 3.87 3.77 3.64 3.38 3.36 3.30 1.84 1.71 1.56 1.55 1.53 1.42</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 2 1 1 1 3 1 1 1 1 1 1 1 1 1 2 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:x S P:y P:y P:x S S S S S P:z P:z P:z P:z P:x S P:y P:y P:x S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -13.975 -9.089 -9.089 -9.089 3.091 -24.020 -24.020 -24.020 -24.020 -9.089 -9.089 -9.089 -9.089 -9.089 -13.975 -9.089 -9.089 -9.089 3.091</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 2.00 1.33 1.33 1.33 0.00 2.00 2.00 2.00 2.00 1.33 1.33 1.33 1.33 1.33 2.00 1.33 1.33 1.33 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">40 104 52 46 38 104 52 46 38 40 40 46 52 38 96 105 72 90 23 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O P O O O P O O O O O O O O O P O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-14.670</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">325</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">8.61 8.09 7.30 7.27 7.06 6.54 3.91 3.90 3.87 3.78 3.66 3.40 3.36 3.30 1.84 1.75 1.56 1.56 1.50 1.38</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 2 1 1 1 3 1 1 1 1 1 1 1 1 1 2 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:x S P:y P:y P:x S S S S S P:z P:z P:z P:z P:x S P:y P:y P:x S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -13.975 -9.089 -9.089 -9.089 3.091 -24.020 -24.020 -24.020 -24.020 -9.089 -9.089 -9.089 -9.089 -9.089 -13.975 -9.089 -9.089 -9.089 3.091</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 2.00 1.33 1.33 1.33 0.00 2.00 2.00 2.00 2.00 1.33 1.33 1.33 1.33 1.33 2.00 1.33 1.33 1.33 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">96 105 72 90 23 105 90 72 23 96 96 90 72 23 40 104 52 46 38 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O P O O O P O O O O O O O O O P O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.528</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">326</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">21.00 12.13 10.97 7.33 4.07 4.07 2.85 2.84 2.82 2.29 2.27 2.12 1.77 1.20 1.19 1.19</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 2 1 1 1 1 3 1 1 1 2 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:x P:z P:z P:x P:x P:x P:y P:y P:x S P:x D:xz P:z P:z D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -5.506 -9.089 -9.089 -9.089 -9.089 2.188 -24.020 -9.089 -6.613 -5.506 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 0.00 2.00 1.33 1.00 1.00 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">40 40 38 104 52 46 52 46 104 40 38 100 104 28 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O P O O O O P O O Tc P O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.517</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">327</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">20.52 12.75 11.40 7.59 4.27 4.26 2.92 2.66 2.53 2.53 2.33 1.75 1.54 1.24 1.22 1.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 2 1 1 3 1 1 1 1 1 2 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:x P:z P:z P:x P:x P:x P:x P:x P:y P:y S D:xz P:z P:z D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -5.506 -9.089 -9.089 2.188 -9.089 -9.089 -9.089 -24.020 -6.613 -5.506 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.00 1.33 1.33 0.00 1.33 1.33 1.33 2.00 1.00 1.00 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">96 96 23 105 90 72 105 23 90 72 96 102 105 73 20 10</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O P O O P O O O O Tc P O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.413</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">328</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">13.92 13.86 10.22 10.14 9.70 5.22 5.07 2.53 1.90 1.89 1.51 1.50 1.23 1.22 1.01 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 2 1 1 3 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:z P:z P:y P:y P:y P:y P:y P:y S S D:yz D:yz P:z P:z D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 2.188 -24.020 -24.020 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.00 2.00 2.00 0.80 0.80 1.33 1.33 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">46 52 46 52 104 40 38 104 46 52 1 14 27 61 4 17 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O P O O P O O W W O O W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.412</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">329</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">13.92 13.86 10.56 9.80 9.69 5.23 5.06 2.53 1.93 1.86 1.52 1.47 1.24 1.21 1.03 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 2 1 1 3 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:z P:z P:y P:y P:y P:y P:y P:y S S D:yz D:yz P:z P:z D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 2.188 -24.020 -24.020 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.00 2.00 2.00 0.80 0.80 1.33 1.33 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">90 72 72 90 105 96 23 105 72 90 11 6 76 74 13 8 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O P O O P O O W W O O W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.410</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">330</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">13.26 8.12 7.76 7.65 5.32 5.00 4.75 3.27 2.89 2.36 2.18 1.49 1.31 1.24 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 2 1 2 1 1 1 3 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">P:x P:x P:y P:y P:y P:z P:y P:z P:x P:z P:x P:z S P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -5.506 -9.089 -5.506 -9.089 -9.089 -9.089 2.188 -24.020 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 0.00 2.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">38 23 52 46 90 104 72 105 40 38 96 104 38 23 40</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">O O O O O P O P O O O P O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.393</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">331</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">13.08 8.39 7.88 7.79 5.08 4.79 4.77 3.19 3.09 2.43 1.75 1.72 1.53 1.35</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 2 1 1 1 2 1 1 1 3 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">P:x P:x P:y P:y P:z P:y P:y P:x P:z P:z P:z P:x P:z S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 -9.089 2.188 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 0.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">23 38 90 72 105 52 46 96 104 23 38 40 105 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O P O O O P O O O P O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.087</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">332</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">5.85 5.85 4.76 4.53 4.50 4.37 3.21 3.20 2.82 2.81 1.96 1.96 1.86 1.85 1.77 1.76 1.68 1.68 1.61 1.61 1.58 1.58 1.48 1.47 1.47 1.46 1.40 1.40 1.34 1.34 1.31 1.31 1.11 1.10 1.10 1.09 1.09 1.08 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">D:xz D:xz P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x D:yz D:yz P:x P:x D:yz D:yz P:y P:y P:y P:y D:xz D:xz P:x P:x P:x P:x P:y P:y D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">1 14 28 30 26 37 32 65 34 67 62 29 66 33 67 34 2 15 32 65 5 18 65 32 67 34 1 14 66 33 29 62 29 62 3 16 4 17 33 66</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">W W O O O O O O O O O O O O O O W W O O W W O O O O W W O O O O O O W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.085</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">333</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">5.87 5.84 4.76 4.59 4.45 4.36 3.22 3.20 2.81 2.78 1.98 1.97 1.86 1.85 1.75 1.74 1.69 1.68 1.63 1.63 1.57 1.56 1.50 1.48 1.46 1.45 1.40 1.40 1.33 1.33 1.32 1.32 1.12 1.11 1.11 1.11 1.09 1.08 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">D:xz D:xz P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x D:yz D:yz P:x P:x D:yz D:yz P:y P:y P:y P:y D:xz D:xz P:x P:x P:x P:x P:y D:x2-y2 P:y D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">6 11 73 93 85 86 53 80 94 87 79 24 77 99 94 87 10 20 53 80 7 12 80 53 87 94 6 11 79 24 99 77 24 9 79 19 8 13 99 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">W W O O O O O O O O O O O O O O W W O O W W O O O O W W O O O O O W O W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.024</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">334</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">6.01 5.87 4.78 4.64 3.10 3.09 2.99 2.99 2.70 2.69 2.63 2.62 1.87 1.87 1.79 1.77 1.74 1.74 1.69 1.68 1.52 1.52 1.47 1.47 1.46 1.46 1.38 1.38 1.24 1.23 1.22 1.21 1.20 1.20 1.17 1.16 1.15 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:y P:y P:x P:x P:y P:y D:yz D:yz D:yz D:yz P:x P:x P:x P:x P:x P:x P:y P:y D:x2-y2 D:x2-y2 P:y P:y D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">37 30 26 28 32 65 67 34 62 29 66 33 1 14 67 34 67 34 65 32 18 5 2 15 65 32 66 33 29 62 33 66 4 17 29 62 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O W W O O O O O O W W W W O O O O O O O O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.022</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">335</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">6.08 5.88 4.79 4.58 3.07 3.05 3.02 2.99 2.69 2.68 2.65 2.64 1.88 1.87 1.79 1.78 1.74 1.73 1.67 1.66 1.52 1.52 1.46 1.46 1.45 1.45 1.39 1.38 1.24 1.24 1.23 1.22 1.22 1.21 1.18 1.16 1.15 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:y P:y P:x P:x P:y P:y D:yz D:yz D:yz P:x D:yz P:x P:x P:x P:y P:x P:x P:y D:x2-y2 D:x2-y2 P:y P:y D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">86 93 85 73 53 80 94 87 79 24 77 99 6 11 87 94 94 87 80 53 7 12 10 53 20 80 99 77 99 79 24 77 8 13 24 79 9 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O W W O O O O O O W W W O W O O O O O O O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.728</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">336</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">6.22 6.18 6.16 5.92 3.76 3.72 2.15 2.14 1.97 1.96 1.95 1.94 1.82 1.81 1.15 1.14 1.14 1.14 1.13 1.13 1.13 1.13 1.12 1.12 1.10 1.08 1.08 1.07 1.04 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:x D:yz P:x D:yz P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 P:x D:xz D:x2-y2 D:xz P:x P:x D:xz P:x D:xz D:x2-y2 D:x2-y2 P:y P:y P:y P:y D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -6.613 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">25 101 60 100 61 27 54 43 41 45 97 35 36 98 2 97 16 15 3 35 41 17 45 4 5 18 41 45 36 98 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O Tc O Tc O O O O O O O O O O W O W W W O O W O W W W O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.725</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">337</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">6.07 6.07 6.06 5.96 3.85 3.83 2.20 2.20 1.99 1.98 1.95 1.95 1.80 1.80 1.16 1.15 1.15 1.15 1.15 1.15 1.12 1.12 1.11 1.11 1.08 1.07 1.06 1.05 1.03 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">D:yz P:x P:x D:yz P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x D:xz D:xz D:xz D:xz D:x2-y2 D:x2-y2 P:x P:x P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">103 91 75 102 76 74 56 81 51 95 82 57 83 59 95 51 19 9 13 8 10 20 57 82 57 82 7 12 59 83 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">Tc O O Tc O O O O O O O O O O O O W W W W W W O O O O W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.687</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">338</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">9.79 9.69 3.78 3.75 2.45 2.41 2.22 2.19 2.05 2.03 2.01 1.99 1.90 1.89 1.83 1.81 1.70 1.64 1.41 1.40 1.32 1.31 1.30 1.29 1.21 1.21 1.11 1.10 1.10 1.10 1.09 1.08 1.08 1.08 1.07 1.06 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:z P:z D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x P:x P:x P:y P:y P:y P:y D:xz P:y D:xz P:y D:xz P:y D:xz P:y P:x P:x D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">60 25 27 61 45 41 98 36 43 54 15 2 35 97 18 5 100 101 45 41 98 36 98 36 45 41 3 54 16 43 4 35 17 97 35 97 18 5</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O W W O O W W Tc Tc O O O O O O O O W O W O W O W O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.680</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">339</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">9.61 9.58 3.97 3.96 2.46 2.44 2.20 2.18 2.11 2.09 2.00 1.98 1.90 1.90 1.82 1.81 1.68 1.47 1.41 1.40 1.23 1.22 1.22 1.22 1.21 1.21 1.16 1.16 1.15 1.15 1.14 1.13 1.12 1.12 1.09 1.09 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x P:y P:y P:x P:y P:x P:y D:xz D:xz D:xz D:xz P:y P:y P:y P:y P:x P:x D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">75 91 74 76 82 57 83 59 56 81 51 95 20 10 12 7 103 102 82 57 57 82 83 59 59 83 8 9 13 19 95 51 81 56 51 95 12 7</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O W W W W Tc Tc O O O O O O O O W W W W O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.398</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">340</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">8.25 8.24 4.77 4.74 3.48 3.47 2.73 2.71 2.62 2.61 2.49 2.49 2.39 2.38 1.98 1.98 1.83 1.83 1.81 1.80 1.64 1.63 1.60 1.60 1.44 1.44 1.10 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:xz D:xz P:z P:z P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:z P:z P:x P:x P:y P:y P:x P:x D:xz D:xz P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">1 14 32 65 34 67 62 29 32 65 67 34 65 32 66 33 62 29 67 34 33 66 1 14 29 62 33 66</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W O O O O O O O O O O O O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.396</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">341</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">8.18 8.17 4.87 4.81 3.35 3.30 2.81 2.76 2.65 2.64 2.43 2.43 2.42 2.41 1.91 1.87 1.85 1.84 1.73 1.72 1.58 1.58 1.58 1.56 1.47 1.46 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:xz D:xz P:z P:z P:z P:z P:z P:z P:x P:x P:y P:x P:y P:x P:z P:z P:x P:x P:y P:y P:x D:xz D:xz P:x P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">6 11 53 80 94 87 79 24 53 80 80 94 53 87 77 99 79 24 87 94 77 6 11 99 24 79 77 99</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W O O O O O O O O O O O O O O O O O O O W W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.305</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">342</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.59 4.58 4.01 3.99 3.83 3.78 3.72 3.68 3.60 3.59 3.02 2.99 2.57 2.56 1.97 1.96 1.52 1.50 1.31 1.30 1.22 1.21 1.15 1.15</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:y P:y P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">67 34 33 66 32 65 62 29 1 14 67 34 65 32 67 34 33 66 32 65 33 66 62 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O W W O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.300</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">343</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.96 4.76 4.30 4.16 3.72 3.68 3.61 3.61 3.61 3.60 3.18 3.14 2.45 2.44 2.12 2.06 1.56 1.51 1.33 1.28 1.22 1.21 1.10 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:z P:z P:z D:x2-y2 P:z D:x2-y2 P:y P:y P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">94 87 77 99 53 80 24 6 79 11 94 87 80 53 94 87 77 99 77 99 53 80 79 24</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O W O W O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.275</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">344</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">13.94 10.26 7.69 5.28 2.34 2.31 2.27 2.23 1.88 1.87 1.85 1.85 1.81 1.78 1.62 1.59 1.57 1.53 1.39 1.38 1.31 1.30 1.05 1.03 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:z P:z D:yz D:yz D:x2-y2 D:x2-y2 P:z P:z P:z P:z P:z P:z D:yz D:yz D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">30 37 28 26 3 16 65 32 15 2 17 4 29 62 34 67 66 33 16 3 5 18 17 4 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O W W O O W W W W O O O O O O W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.273</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">345</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">12.95 11.22 7.11 5.83 2.18 2.17 2.12 2.08 2.01 1.95 1.80 1.75 1.75 1.74 1.71 1.71 1.65 1.57 1.44 1.42 1.30 1.27 1.13 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:z P:z D:x2-y2 D:x2-y2 P:z D:yz P:z D:yz P:z P:z P:z P:z D:yz D:yz D:yz D:yz D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">93 86 73 85 9 19 53 80 8 13 87 10 79 20 24 94 99 77 12 7 19 9 13 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O W W O O W W O W O W O O O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.250</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">346</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">14.66 11.16 8.99 7.13 1.95 1.95 1.94 1.93 1.71 1.71 1.54 1.54 1.50 1.50 1.49 1.47 1.10 1.10 1.07 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:y P:y P:z D:yz D:yz P:z D:x2-y2 D:x2-y2 P:z P:z D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2 D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">37 30 26 28 34 5 18 67 4 17 32 65 2 15 17 4 3 16 16 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O W W O W W O O W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.248</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">347</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">13.52 12.22 8.35 7.80 1.84 1.81 1.78 1.75 1.75 1.69 1.67 1.65 1.61 1.55 1.37 1.37 1.23 1.20 1.16 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:y P:y P:z D:yz D:yz P:z P:z P:z D:yz D:yz D:x2-y2 D:x2-y2 D:yz D:yz D:x2-y2 D:x2-y2 D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">86 93 85 73 87 12 7 80 94 53 20 10 8 13 8 13 9 19 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O W W O O O W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.144</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">348</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">8.68 8.60 7.45 7.39 2.62 2.61 2.45 2.44 2.09 2.08 1.86 1.85 1.57 1.57 1.36 1.16 1.15 1.06 1.06 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:x P:x P:x P:x P:z P:z P:z P:z D:xz D:xz D:xz D:xz P:z P:z P:y P:z P:z P:x P:x D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">25 60 61 27 54 43 97 35 17 4 16 3 41 45 40 36 98 52 46 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O W W W W O O O O O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.143</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">349</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">8.80 8.68 7.37 7.27 2.64 2.62 2.35 2.34 2.09 2.07 1.81 1.80 1.64 1.64 1.37 1.15 1.15 1.06 1.06 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:x P:x P:x P:x P:z P:z P:z P:z D:xz D:xz D:xz D:xz P:z P:z P:y P:z P:z P:x P:x D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">91 75 76 74 81 56 95 51 13 8 19 9 57 82 96 59 83 90 72 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O W W W W O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.120</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">350</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">9.05 8.95 7.76 7.66 6.46 1.71 1.70 1.69 1.68 1.64 1.56 1.53 1.47 1.44 1.43 1.41 1.40 1.32 1.11 1.11 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:x P:x P:z D:xz P:x P:x D:xz S P:z P:z P:z P:z D:xz D:x2-y2 D:xz P:x P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -6.493 -9.089 -9.089 -9.089 -9.089 -4.498 -6.613 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.00 1.33 1.33 1.33 1.33 0.80 1.00 0.80 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">75 91 74 76 21 8 56 81 13 107 56 81 51 95 9 102 19 21 81 56 83 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O W O O W H O O O O W Tc W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.114</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">351</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">9.19 9.11 8.72 8.66 2.91 2.25 2.22 2.04 2.02 1.86 1.84 1.72 1.71 1.71 1.68 1.24 1.24 1.12 1.11 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:x P:x P:x P:x P:z P:z P:z D:xz D:xz D:xz D:xz P:y P:y P:z P:z P:x P:x P:x P:x D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">27 61 60 25 22 35 97 3 16 4 17 97 35 43 54 98 36 35 97 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O W W W W O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.998</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">352</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">27.14 7.47 7.33 5.82 4.36 2.74 2.60 2.24 2.11 1.78 1.51 1.51 1.44 1.44 1.30</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">P:z P:x S D:x2-y2 D:z2 S P:z P:z P:x D:xz P:x P:x P:x P:x S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.493 -6.613 -6.613 -24.020 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 2.471</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">1.33 1.33 1.00 1.00 1.00 2.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">21 21 107 102 102 21 23 96 96 102 74 76 75 91 107</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">O O H Tc Tc O O O O Tc O O O O H</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.986</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">353</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">16.27 7.22 5.06 4.98 3.72 3.50 3.17 1.94 1.85 1.84 1.56 1.56 1.44 1.44 1.27 1.14 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:z P:x S P:z D:x2-y2 D:z2 D:xz S P:y P:y P:y P:y P:x P:x P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.493 -9.089 -6.613 -6.613 -6.613 -24.020 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.00 1.33 1.00 1.00 1.00 2.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">22 22 106 40 100 100 100 22 54 43 41 45 25 60 28 32 65</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O H O Tc Tc Tc O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.912</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">354</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">7.02 6.69 4.33 4.15 2.02 2.02 1.94 1.93 1.85 1.85 1.70 1.70 1.28 1.27 1.26 1.25 1.25 1.25 1.22 1.21 1.21 1.21 1.18 1.18 1.17 1.17 1.12 1.12 1.04 1.03 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:yz D:yz D:yz D:yz P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:x P:y P:x P:y P:z P:z P:z P:z P:y P:z P:y P:z P:y P:y P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">100 101 102 103 54 43 36 98 35 97 41 45 54 43 97 36 35 98 56 83 81 59 97 51 35 95 41 45 54 43 82 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">Tc Tc Tc Tc O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.910</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">355</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">6.98 6.41 4.33 3.96 1.97 1.96 1.95 1.94 1.93 1.92 1.69 1.68 1.30 1.30 1.28 1.26 1.25 1.25 1.24 1.22 1.22 1.19 1.18 1.18 1.17 1.16 1.14 1.10 1.10 1.09 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:yz D:yz D:yz D:yz P:z P:z P:z P:z P:z P:z P:z P:z P:y P:x P:x P:y P:z P:y P:z P:y P:y P:z P:z P:y P:z P:z P:y P:y P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">102 103 100 101 56 81 83 51 59 95 82 57 81 95 51 59 54 56 43 95 83 36 98 51 97 35 57 82 41 45 81 56</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">Tc Tc Tc Tc O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.901</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">356</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">3.84 3.18 3.16 2.79 2.79 2.79 2.75 2.51 2.51 2.50 2.16 2.16 2.00 1.98 1.98 1.96 1.53 1.52 1.49 1.49 1.46 1.46 1.45 1.22 1.22 1.14 1.14 1.07 1.07 1.07 1.01 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:z D:z2 D:z2 P:y P:x P:x P:y P:x D:z2 P:x P:x P:x P:y P:x P:x P:y P:y P:y P:y P:y P:x P:z P:x P:y P:y D:xy D:xy D:xy D:xy D:z2 P:z P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -6.613 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.00 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">21 6 11 56 80 53 81 87 103 94 99 77 51 24 79 95 83 82 59 57 73 86 85 75 91 20 10 12 7 102 91 74 75</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O W W O O O O O Tc O O O O O O O O O O O O O O O O W W W W Tc O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.885</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">357</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.50 3.41 3.41 2.99 2.87 2.87 2.78 2.78 2.43 2.42 2.41 2.40 2.22 2.22 2.22 2.21 2.21 1.99 1.93 1.69 1.69 1.56 1.35 1.34 1.28 1.28 1.24 1.19 1.07 1.06 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:z P:x P:x P:x P:x P:x D:z2 D:z2 D:xy D:xy P:y P:y P:x P:x P:x P:x D:x2-y2 P:x P:x D:xy D:xy D:z2 P:y P:y P:z P:z S P:x P:y P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -6.613 -9.089 -9.089 -9.089 -9.089 -6.493 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.80 0.80 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">22 65 32 28 67 34 1 14 15 2 60 25 62 29 66 33 100 26 22 18 5 101 97 35 45 41 106 30 36 98 40</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O W W W W O O O O O O Tc O O W W Tc O O O O H O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.830</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">358</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">6.09 5.62 2.95 2.44 2.28 2.24 1.78 1.78 1.78 1.77 1.68 1.67 1.66 1.61 1.61 1.56 1.55 1.43 1.43 1.42 1.36 1.26 1.21 1.16 1.11 1.06 1.06 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:x D:x2-y2 D:x2-y2 P:z P:z P:z P:y P:z P:y P:z P:x P:z P:z D:xy D:xy P:z P:z P:x P:x P:x P:z P:z P:x D:xz P:x D:xy D:xy P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">39 103 101 21 22 23 91 56 75 81 85 82 57 7 12 83 59 82 23 57 38 96 73 103 38 10 20 51 95</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O Tc Tc O O O O O O O O O O W W O O O O O O O O Tc O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.745</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">359</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">6.77 3.11 2.33 2.25 2.19 2.10 1.79 1.76 1.74 1.42 1.40 1.24 1.21 1.19 1.19 1.10 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:z D:x2-y2 P:x P:x P:z P:z S P:x P:x P:x P:x P:x P:x P:z P:z P:x D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.493 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">22 101 38 22 21 38 106 97 35 41 45 52 46 98 36 26 18 5</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O Tc O O O O H O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.738</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">360</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">10.33 6.46 5.12 5.04 2.68 2.66 2.47 2.47 2.09 -1.65 1.61 1.59 1.57 1.54 1.53 1.30 1.29 1.28</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:y D:yz P:y P:y P:y P:y P:y P:y P:z P:z D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 10.422 2.188 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">40 38 52 46 14 1 32 65 104 104 70 47 30 67 34 25 60 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O W W O O P P O O O O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.736</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">361</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">10.35 6.38 5.04 5.04 2.67 2.66 2.48 2.45 2.08 -1.63 1.60 1.59 1.57 1.52 1.50 1.31 1.28 1.27</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:y D:yz P:y P:y P:y P:y P:y P:y P:z P:z D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 10.422 2.188 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">96 23 90 72 6 11 53 80 105 105 63 58 93 94 87 91 75 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O W W O O P P O O O O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.704</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">362</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">10.73 10.72 5.78 5.60 2.58 -2.06 1.84 1.84 1.68 1.52 1.35 1.35 1.14 1.12 1.12 1.10 1.09 1.09 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:z P:z P:z P:z D:x2-y2 P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 10.422 2.188 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">52 46 38 40 104 104 27 61 37 30 25 60 26 42 68 28 31 64 34 67</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O P P O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.691</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">363</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">10.53 10.47 5.48 4.78 2.42 2.14 2.03 2.02 -1.94 1.56 1.32 1.29 1.24 1.16 1.16 1.10 1.10 1.06 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:z P:z P:z P:z D:x2-y2 P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089 2.188 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">72 90 96 23 105 21 74 76 105 93 75 91 86 48 92 88 78 73 87 94</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O P O O O P O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.622</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">364</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">5.99 4.72 4.72 4.48 3.52 2.81 2.79 2.67 1.83 1.83 1.62 1.55 1.54 1.48 1.44 1.44 1.18 1.12 1.12 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:y P:x P:x P:y P:y P:x P:x P:y P:y P:y P:y D:xy D:xy D:xy P:x P:x P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">38 52 46 40 23 72 90 96 67 34 37 1 14 104 60 25 30 29 62 87 94</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O W W P O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.615</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">365</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">6.06 4.77 4.74 4.31 3.60 2.81 2.81 2.54 1.89 1.89 1.61 1.57 1.56 1.48 1.47 1.46 1.14 1.13 1.13 1.13 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:y P:x P:x P:y P:y P:x P:x P:y P:y P:y P:y D:xy D:xy D:xy P:x P:x P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">23 72 90 96 38 52 46 40 94 87 86 11 6 105 91 75 79 67 93 34 24</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O W W P O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.596</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">366</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">7.83 7.76 5.78 3.62 3.59 3.21 2.21 2.13 2.11 1.75 1.51 1.50 1.49 1.44 -1.36 1.27 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:x P:x P:x P:z P:z P:x P:x D:xy D:xy D:xz P:x P:x P:x D:x2-y2 P:x D:xz P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 10.422 -9.089 -9.089 -9.089 -6.613 2.188 -6.613 -1.119</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.00 1.33 1.33 1.33 1.00 0.00 1.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">90 72 96 21 22 23 39 6 11 105 40 59 83 103 105 102 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O O O O W W P O O O Tc P Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.551</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">367</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">7.74 6.51 6.09 6.08 1.82 1.81 1.74 1.73 1.67 1.66 1.53 1.52 1.46 1.45 1.39 1.28 1.28 1.09 -1.09 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 3 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:x P:z P:x P:x P:x P:x D:xy D:xy P:x P:x D:z2 D:z2 S D:xz P:x P:z P:z P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -6.493 10.422 -9.089 -9.089 -9.089 -1.119 2.188 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.00 0.00 1.33 1.33 1.33 0.00 0.00 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">40 22 46 52 43 54 1 14 90 72 4 17 106 104 38 32 65 100 104 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O W W O O W W H P O O O Tc P O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.497</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">368</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">2.50 2.39 2.38 2.37 2.31 2.30 2.03 1.86 1.85 1.81 1.80 1.79 1.78 1.68 1.68 1.46 1.46 1.24 1.15 1.15 1.08 1.08 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:z P:x P:z P:z P:z P:z P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:z D:z2 D:z2 P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">40 35 38 97 43 54 38 97 35 54 43 98 36 45 41 52 46 28 34 67 5 18 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.495</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">369</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.25 2.71 2.44 2.32 2.30 2.23 2.21 1.68 1.67 1.67 1.65 1.55 1.55 1.52 1.51 1.51 1.50 1.48 1.21 1.21 1.19 1.13 1.13 1.10 1.09 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:x P:z P:z P:z P:z P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z D:z2 D:z2 P:x P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">96 23 23 51 95 56 81 81 95 56 51 83 59 82 57 72 90 73 12 7 38 94 87 91 75 85</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O W W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.444</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">370</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">3.52 3.51 3.06 3.05 2.89 2.89 1.73 1.73 1.72 1.72 1.56 1.55 1.54 1.53 1.51 1.50 1.47 1.46 1.45 1.43 1.21 1.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">D:z2 D:z2 P:x P:x P:x P:x D:z2 D:z2 P:z P:z P:z P:z P:z P:z P:x P:x P:z P:z P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">1 14 32 65 34 67 6 11 29 62 67 34 33 66 53 80 25 60 94 87 32 65</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">W W O O O O W W O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.437</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">371</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">3.57 3.56 3.04 3.02 2.90 2.87 1.78 1.78 1.77 1.77 1.59 1.58 1.52 1.51 1.51 1.51 1.42 1.42 1.40 1.38 1.22 1.22</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">D:z2 D:z2 P:x P:x P:x P:x D:z2 P:z P:z D:z2 P:z P:z P:z P:x P:z P:x P:x P:x P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">6 11 53 80 94 87 1 79 24 14 94 87 77 32 99 65 34 67 91 75 53 80</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">W W O O O O W O O W O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.388</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">372</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.84 4.79 3.53 3.53 3.25 3.24 3.22 3.21 3.18 3.05 2.62 2.60 1.92 1.91 1.77 1.76 1.15 1.15 1.05 1.04 1.03 1.03 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:y P:y D:xy D:xy D:xy D:xy P:x P:x P:y P:y D:xy D:xy D:xy D:xy P:y P:y P:y P:y P:y P:y D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">37 30 27 61 17 4 3 16 26 28 60 25 18 5 15 2 32 65 34 67 41 45 1 14</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O W W W W O O O O W W W W O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.386</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">373</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">4.87 4.85 3.54 3.50 3.28 3.25 3.25 3.22 3.21 3.01 2.55 2.51 1.90 1.88 1.66 1.63 1.17 1.16 1.12 1.12 1.08 1.07 1.03 1.03 1.03 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:x P:x P:y P:y D:xy D:xy P:x D:xy D:xy P:x P:y P:y D:xy D:xy D:xy D:xy P:y P:y P:y P:y D:yz D:yz D:xz P:x P:y P:y D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">86 93 74 76 8 13 85 9 19 73 75 91 12 7 20 10 80 53 94 87 11 6 20 87 82 57 10</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O W W O W W O O O W W W W O O O O W W W O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.316</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">374</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">3.93 3.82 3.09 3.09 2.80 2.67 2.61 2.61 1.90 1.79 1.73 1.72 1.61 1.60 1.52 1.52 1.46 1.45 1.42 1.40 1.39 1.38 1.38 1.37 1.37 1.35 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:z P:y P:y D:z2 D:z2 P:y P:y D:x2-y2 D:x2-y2 D:yz D:yz D:yz D:yz D:xy D:xy P:z P:z P:z P:y P:y P:y P:z P:z P:y P:z D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">30 37 35 97 100 101 43 54 100 101 3 16 4 17 1 14 36 98 26 45 41 98 41 45 36 28 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O Tc Tc O O Tc Tc W W W W W W O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.314</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">375</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.10 3.77 3.29 3.18 3.17 2.64 2.59 2.58 1.85 1.83 1.81 1.63 1.61 1.53 1.50 1.50 1.49 1.48 1.47 1.43 1.42 1.35 1.35 1.34 1.33 1.32 1.08 1.06 1.05 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:z P:z D:z2 P:y P:y D:z2 P:y P:y D:x2-y2 D:yz D:yz D:yz D:yz P:z D:x2-y2 P:z P:y P:z P:y P:y P:y D:xy D:xy P:z P:z P:z P:x P:z P:z D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.00 0.80 0.80 0.80 0.80 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">93 86 102 51 95 103 56 81 103 9 19 8 13 85 102 59 83 83 59 82 57 11 6 57 82 73 73 81 56 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O Tc O O Tc O O Tc W W W W O Tc O O O O O O W W O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.187</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">376</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.16 2.70 2.55 2.55 2.16 2.00 2.00 1.95 1.95 1.56 1.56 1.54 1.54 1.45 1.41 1.41 1.35 1.20 1.20 1.12 1.12 1.10 1.10 1.04 1.04 1.04 1.03 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:z P:z D:yz D:yz P:z D:yz D:yz P:z P:z P:y P:y P:y P:y P:z D:yz D:yz D:xz P:x P:x P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:y P:y D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -6.613 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.00 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">30 37 1 14 28 3 16 70 47 34 67 32 65 26 4 17 101 35 97 66 33 2 15 41 45 36 98 5 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O W W O W W O O O O O O O W W Tc O O O O W W O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.165</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">377</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.40 3.08 2.69 2.67 2.22 2.11 2.11 2.04 1.93 1.91 1.67 1.67 1.64 1.63 1.55 1.55 1.39 1.39 1.13 1.13 1.12 1.11 1.06 1.05 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z D:yz D:yz P:z P:z P:z P:z D:yz D:yz P:y P:y D:yz D:yz P:y P:y P:y P:y P:y P:y D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">93 86 6 11 85 58 63 73 9 19 53 80 8 13 94 87 57 82 79 24 7 12 10 20 77 99</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O W W O O O O W W O O W W O O O O O O W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.094</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">378</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">30.28 2.04 1.97 1.87 1.84 1.63 1.57 1.33 1.12 1.12 1.11 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">P:x D:xz D:x2-y2 D:x2-y2 D:z2 D:xz D:z2 P:z P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">39 103 103 101 101 101 103 96 72 90 73 40</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O Tc Tc Tc Tc Tc Tc O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.936</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">379</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">2.68 2.28 2.21 2.15 2.07 2.06 1.63 1.62 1.53 1.53 1.49 1.48 1.47 1.46 1.43 1.43 1.32 1.31 1.29 1.29 1.28 1.22 1.22 1.21 1.14 1.14 1.12 1.11 1.08 1.08 1.05 1.04 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:x D:z2 P:x P:x D:z2 P:x P:x P:x D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy P:y P:y P:y P:z P:y P:z P:y P:y D:yz D:yz P:y P:y P:y P:y D:xy D:xy P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">28 101 26 30 100 37 70 47 14 1 3 16 17 4 15 2 66 33 29 37 62 30 67 34 3 16 45 41 32 65 18 5 98 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O Tc O O Tc O O O W W W W W W W W O O O O O O O O W W O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.928</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">380</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">1.71 1.70 1.57 1.57 1.53 1.51 1.49 1.48 1.32 1.31 1.30 1.29 1.29 1.29 1.18 1.18 1.09 1.09 1.04 1.04 1.01 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:z P:x P:x D:yz D:yz P:z P:z D:xz D:xz D:z2 D:z2 P:y P:y P:x P:x D:xz D:xz P:x P:x P:y P:y D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">47 70 69 44 1 14 60 25 15 2 14 1 27 61 36 98 18 5 71 49 29 62 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O W W O O W W W W O O O O W W O O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.927</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">381</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">2.65 2.34 2.33 2.19 1.93 1.57 1.57 1.55 1.55 1.54 1.50 1.42 1.40 1.38 1.34 1.34 1.34 1.34 1.32 1.29 1.28 1.19 1.18 1.16 1.16 1.13 1.12 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:x P:x P:x P:x D:z2 D:xy D:xy D:xy D:xy P:x P:x P:y P:y D:xy P:y D:xy D:z2 P:z P:y D:xy D:xy P:y P:y P:y P:y D:xy D:xy D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.00 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">73 93 85 86 103 8 19 13 9 58 63 94 87 11 77 6 102 86 99 10 20 79 80 53 24 12 7 13 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O Tc W W W W O O O O W O W Tc O O W W O O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.919</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">382</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">1.80 1.79 1.72 1.71 1.70 1.68 1.66 1.64 1.43 1.42 1.36 1.36 1.36 1.35 1.29 1.29 1.14 1.13 1.11 1.11 1.10 1.09 1.09 1.08 1.07 1.06 1.02 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:z P:z P:x P:x D:yz D:yz P:y P:y P:x P:x P:z D:xz P:z D:xz P:y P:y D:z2 D:xy P:y D:z2 P:y D:xy P:x P:x D:xy P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -6.613 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 0.80 1.00 1.33 0.80 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">58 63 89 84 6 11 24 79 83 59 91 10 75 20 74 76 11 102 29 6 62 9 69 44 19 53 80 47 70</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O W W O O O O O W O W O O W Tc O W O W O O W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.874</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">383</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">6.05 3.13 3.01 2.01 1.82 1.81 1.75 1.70 1.64 1.59 1.58 1.54 1.52 1.52 1.45 1.40 1.38 1.35 1.32 1.27 1.22 1.18 1.17 1.14 1.14 1.12 1.12 1.11 1.10 1.09 1.07 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:z D:z2 D:z2 P:z D:z2 P:x D:x2-y2 D:z2 D:x2-y2 P:x P:z P:x P:z P:z P:y P:x P:x P:y D:xz P:x P:x P:x P:x P:z D:yz P:z D:z2 P:z D:yz P:y D:z2 P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 0.80 1.33 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">73 20 10 93 13 96 19 8 9 78 76 88 26 74 84 92 48 89 102 95 51 79 24 77 19 99 18 89 9 92 5 28 84</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O W W O W O W W W O O O O O O O O O Tc O O O O O W O W O W O W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.874</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">384</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">3.61 2.64 2.63 2.61 2.46 2.44 1.99 1.94 1.88 1.86 1.63 1.58 1.58 1.41 1.38 1.30 1.30 1.25 1.22 1.21 1.18 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:y D:xy D:xy P:y P:y P:y D:xy D:xy P:x P:x P:y P:y P:y P:x P:x D:xy D:xy P:x P:y P:x P:y D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">40 14 1 96 33 66 6 11 70 47 99 38 77 63 58 101 100 36 26 98 23 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O W W O O O W W O O O O O O O Tc Tc O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.870</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">385</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.49 2.48 2.36 2.20 2.14 1.99 1.97 1.85 1.78 1.52 1.52 1.52 1.39 1.29 1.27 1.26 1.26 1.24 1.21 1.15 1.12 1.12 1.11 1.08 1.05 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">D:xz D:xz P:z D:z2 D:z2 D:z2 D:z2 P:z P:z P:x P:z P:x P:x D:z2 P:x P:z D:z2 D:z2 D:z2 P:x P:z P:z P:x D:z2 P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.00 1.00 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">101 103 26 5 18 3 16 61 27 64 39 31 41 9 45 85 19 7 12 68 76 74 42 17 97 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">Tc Tc O W W W W O O O O O O W O O W W W O O O O W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.862</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">386</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">4.12 2.86 2.85 2.84 2.12 2.11 1.66 1.62 1.39 1.33 1.32 1.17 1.17 1.14 1.07 1.06 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:y P:y P:y P:y P:y P:y D:xy D:xy P:y D:z2 D:z2 D:xy P:x P:x D:xy D:xy P:y D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.00 1.33 1.33 0.80 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">96 99 77 40 33 66 6 11 85 13 8 102 63 58 14 1 26 4</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O O W W O W W Tc O O W W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.843</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">387</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">2.25 1.79 1.60 1.60 1.43 1.35 1.35 1.35 1.34 1.31 1.31 1.26 1.19 1.18 1.15 1.15 1.15 1.13 1.12 1.11 1.06 1.06 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:y P:y D:xy P:z P:y P:z P:y P:z P:z D:xy P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">38 23 47 70 101 27 58 61 63 46 52 103 71 49 68 76 42 74 90 72 41 45 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O Tc O O O O O O Tc O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.838</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">388</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">7.24 3.82 3.79 2.65 2.17 2.14 1.84 1.82 1.76 1.70 1.69 1.54 1.51 1.50 1.50 1.50 1.47 1.30 1.29 1.16 1.15 1.14 1.13 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z D:z2 D:z2 P:z P:y P:y D:x2-y2 D:x2-y2 P:x P:x P:x P:z D:yz D:yz P:z D:z2 D:z2 P:x P:x P:x P:x P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">28 15 2 30 69 44 16 3 40 64 31 61 3 16 27 17 4 97 35 68 42 31 64 44 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O W W O O O W W O O O O W W O W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.827</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">389</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">4.43 3.79 1.82 1.80 1.48 1.48 1.29 1.19 1.19 1.12 1.11 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">P:y P:y P:x P:x P:x P:x D:xy P:z P:z D:z2 D:z2 P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">23 38 55 50 49 71 103 57 82 9 19 74 76</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O O O Tc O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.777</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">390</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">5.88 5.59 3.37 3.34 2.92 2.34 2.33 2.32 1.90 1.90 1.89 1.26 1.25 1.24 1.23 1.23 1.22 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:z P:x D:z2 D:z2 P:z P:y P:y P:z D:z2 D:z2 P:z P:z D:yz D:yz P:z P:y P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">85 39 7 12 26 55 50 86 18 5 73 93 13 8 30 71 49 28</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O W W O O O O W W O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.752</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">391</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">3.60 2.90 2.90 1.61 1.59 1.59 1.58 1.42 1.32 1.30 1.28 1.28 1.25 1.12 1.08 1.07 1.05 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:z P:z P:z D:yz P:y P:y D:yz P:z P:x D:xz P:y P:y P:x D:xz D:xz P:x D:yz D:yz P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.00 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">37 26 86 17 49 71 4 85 82 103 43 54 57 12 7 50 13 8 55</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O W O O W O O Tc O O O W W O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.746</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">392</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">2.57 2.54 2.28 2.25 2.21 2.20 1.98 1.96 1.34 1.32 1.16 1.12 1.11 1.11 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:z P:z D:yz D:yz P:z P:z D:yz D:yz P:y P:y D:xy P:y D:xy P:y D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 1.33 0.80 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">47 70 1 14 63 58 6 11 25 60 5 91 18 75 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O W W O O W W O O W O W O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.723</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">393</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">3.09 2.18 1.92 1.89 1.62 1.56 1.49 1.42 1.38 1.38 1.31 1.30 1.23 1.23 1.21 1.19 1.18 1.16 1.14 1.11 1.08 1.04 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:x P:x P:z P:x P:x P:y D:xz P:y D:xz D:z2 P:x P:z D:xz P:x D:z2 D:xz P:x P:x D:z2 P:x D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -6.613 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.00 1.33 1.33 0.80 1.33 0.80 0.80 1.33 1.33 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">37 60 25 69 44 86 98 71 68 15 42 18 100 36 30 2 82 4 5 49 50 14 40 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O W O W Tc O O W O W W O O W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.722</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">394</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">2.28 2.06 2.04 2.04 1.88 1.76 1.69 1.59 1.55 1.52 1.43 1.36 1.32 1.29 1.27 1.26 1.25 1.08 1.07 1.06 1.04 1.03 1.03 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z D:yz P:z D:yz D:yz P:z P:y D:yz P:y P:y D:xy D:xy P:y D:xy D:xy P:x D:xy P:x D:xy D:xy P:z P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 0.80 1.33 0.80 0.80 1.33 1.33 0.80 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">63 58 6 47 11 1 70 91 14 75 25 20 7 60 10 2 57 5 41 15 12 84 55 89 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O W O W W O O W O O W W O W W O W O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.667</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">395</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">2.56 1.81 1.81 1.57 1.57 1.51 1.51 1.47 1.46 1.46 1.45 1.18 1.18 1.11 1.10 1.07 1.03 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:z P:x P:x P:x P:x D:xy D:xy D:xz P:z P:z D:xz P:x P:x D:z2 D:z2 D:xz P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -6.613 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 1.33 0.80 1.33 1.33 0.80 0.80 1.00 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">93 98 36 89 84 2 15 20 75 91 10 59 83 19 9 100 38 99 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O W W W O O W O O W W Tc O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.616</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">396</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">4.77 2.05 1.54 1.44 1.43 1.40 1.40 1.39 1.33 1.32 1.26 1.25 1.19 1.15 1.15 1.10 1.10 1.06 1.05 1.05 1.05 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:x P:x P:x P:x D:xy D:xy D:xy D:xy P:y P:y P:z P:x P:x P:y P:y D:xy D:xy P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">39 37 30 26 28 85 4 17 10 20 45 41 93 59 83 51 95 15 2 98 36 86</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O W W W W O O O O O O O W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.580</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">397</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">2.75 2.74 2.42 2.39 2.39 2.18 1.92 1.72 1.47 1.46 1.29 1.29 1.26 1.26 1.26 1.25 1.20 1.09 1.09 1.08 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:y P:x P:x P:y P:y P:y D:z2 D:z2 D:z2 D:z2 P:z P:z P:z P:z D:xy P:z P:z P:z P:z D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">64 31 26 48 92 85 37 86 16 3 9 19 97 27 35 61 101 95 51 74 76 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O W W W W O O O O Tc O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.571</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">398</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">2.27 2.27 1.80 1.78 1.74 1.62 1.61 1.61 1.61 1.47 1.46 1.41 1.40 1.40 1.40 1.40 1.34 1.34 1.28 1.22 1.22 1.19 1.19 1.18 1.18</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z P:y P:y P:x P:z P:z P:z P:z P:y P:y P:z P:z P:z P:x P:z P:z P:z P:x P:y P:y D:xy D:xy P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">79 24 99 77 86 66 77 99 33 24 79 62 29 67 93 34 53 80 85 29 62 8 13 32 65</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.568</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">399</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.50 2.50 2.26 2.26 1.85 1.84 1.82 1.81 1.67 1.66 1.65 1.64 1.33 1.32 1.26 1.26 1.24 1.23 1.20 1.20 1.14 1.13 1.10 1.09 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:x P:x P:x P:x P:x P:x P:z P:z P:x P:x P:z P:z P:z P:z D:z2 D:z2 P:y P:y P:z P:z D:z2 D:z2 P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">92 48 31 64 88 78 74 76 42 68 27 61 51 95 9 19 85 86 35 97 3 16 26 37 56 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O W W O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.551</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">400</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">4.82 4.04 2.83 2.71 2.70 2.39 2.35 2.34 1.35 1.34 1.22 1.22 1.18 1.18 1.08 1.06 1.05 1.05 1.05 1.04 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:y P:y P:y P:x P:x P:y P:x P:x P:x P:x D:z2 D:z2 P:x P:x D:xz D:xz D:z2 D:z2 P:y P:y P:y D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">28 73 30 42 68 93 78 88 54 43 17 4 81 56 14 1 13 8 32 26 65 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O W W O O W W W W O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.541</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">401</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">4.54 3.91 2.31 2.05 1.97 1.79 1.45 1.44 1.36 1.36 1.18 1.17 1.17 1.17 1.17 1.17 1.14 1.13 1.09 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:y P:y P:y P:y P:x P:x D:xz D:xz D:xz P:x D:xz P:x P:x P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">73 28 93 85 30 26 78 88 11 6 1 42 14 68 81 56 63 58 53 80</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O W W W O W O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.534</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">402</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">5.96 2.33 2.30 2.18 2.13 1.98 1.98 1.62 1.59 1.56 1.56 1.52 1.51 1.43 1.43 1.38 1.36 1.20 1.20 1.20 1.20 1.07 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:x P:z P:z P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:y P:z P:y P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">39 77 99 79 24 33 66 24 79 53 80 62 29 34 67 94 87 29 32 62 65 99 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.412</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">403</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">5.07 5.06 4.68 4.67 4.06 4.04 3.68 3.67 3.44 3.44 2.76 2.75 1.74 1.74 1.34 1.34 1.29 1.29 1.07 1.07 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:x P:x P:y P:y P:y P:y P:z P:z P:z P:z D:z2 D:z2 P:y P:y P:y P:y P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">29 62 66 33 62 29 66 33 32 65 34 67 1 14 34 67 32 65 62 29 36 98</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.409</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">404</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">4.91 4.91 4.68 4.68 4.37 4.37 3.87 3.87 3.13 3.11 3.04 3.01 1.69 1.67 1.46 1.45 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:x P:x P:x P:x P:y P:y P:y P:y P:z P:z P:z P:z D:z2 D:z2 P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">24 79 99 77 77 99 24 79 53 80 94 87 6 11 87 94 72 90</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.370</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">405</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">9.33 6.29 5.16 3.66 3.62 3.06 3.04 2.78 2.75 2.31 2.30 1.97 1.95 1.84 1.82 1.80 1.69 1.68 1.43 1.42 1.30 1.28 1.25 1.24</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:y P:z P:z P:z P:z P:x P:x P:y P:y P:x P:x P:y P:x P:x D:yz D:yz D:xy D:xy P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">28 26 30 62 29 66 33 32 65 27 61 67 34 37 68 42 4 17 2 15 69 44 52 46</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O W W W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.369</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">406</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">9.76 5.81 5.51 3.78 3.67 2.88 2.86 2.83 2.82 2.24 2.23 1.92 1.91 1.87 1.85 1.70 1.68 1.58 1.40 1.38 1.29 1.28 1.27 1.26</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:y P:z P:z P:z P:x P:x P:z P:y P:y P:x P:x P:x P:x D:yz D:yz P:y D:xy D:xy P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">73 85 93 79 24 77 53 80 99 74 76 94 88 78 87 8 13 86 20 10 84 72 89 90</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O W W O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.347</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">407</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">8.64 8.37 4.31 2.72 2.70 2.52 2.33 2.31 1.68 1.67 1.64 1.64 1.61 1.58 1.57 1.56 1.46 1.44 1.29 1.28 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:y P:y P:y P:x P:x P:y P:x P:x P:y P:z P:z P:y P:y P:y P:x P:x P:x P:x P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">37 26 30 64 31 28 46 52 69 66 33 44 49 71 67 34 42 68 86 85 38</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.346</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">408</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">8.88 8.80 4.07 2.79 2.77 2.28 2.25 2.25 1.83 1.83 1.65 1.64 1.64 1.64 1.58 1.57 1.32 1.31 1.27 1.23 1.19</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:y P:y P:y P:x P:x P:y P:x P:x P:z P:z P:x P:y P:y P:x P:y P:y P:x P:x P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">86 85 93 92 48 73 90 72 77 99 94 89 84 87 50 55 78 88 37 26 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.339</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">409</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">3.67 2.60 2.58 2.37 2.33 2.31 2.27 1.96 1.94 1.88 1.87 1.72 1.70 1.65 1.63 1.58 1.47 1.45 1.41 1.40 1.40 1.38 1.36 1.34 1.29 1.29 1.29 1.27 1.27 1.22 1.18 1.16 1.15 1.14 1.12 1.11 1.08 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:x D:z2 D:z2 P:y P:y P:z P:x P:z P:z D:z2 D:z2 P:x P:x P:x P:x P:x P:y P:y D:x2-y2 P:z D:z2 P:z P:y P:y P:y P:y P:z P:y P:y P:x P:x P:x P:x P:x P:x D:xz P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">26 3 16 44 69 40 40 29 62 2 15 44 69 36 98 22 71 49 100 41 100 45 33 66 32 31 30 65 64 31 64 35 61 97 27 100 52 46</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O W W O O O O O O W W O O O O O O O Tc O Tc O O O O O O O O O O O O O O Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.324</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">410</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">3.75 3.73 2.54 2.53 2.12 1.93 1.93 1.88 1.81 1.80 1.75 1.75 1.68 1.68 1.64 1.58 1.56 1.53 1.52 1.51 1.50 1.44 1.39 1.24 1.24 1.16 1.12 1.12 1.11 1.10 1.06 1.03 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:y P:y P:y P:y P:x P:z P:z P:x P:y P:y D:z2 D:z2 D:z2 D:z2 P:z P:z P:z P:y P:y P:y P:y D:z2 P:z P:x P:x P:x D:xy D:xy P:x P:x P:x P:z P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">89 84 59 83 73 51 95 93 50 55 12 7 20 10 24 79 96 57 80 53 82 103 85 81 56 96 9 19 51 95 87 82 94 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O O O O O O O O O W W W W O O O O O O O Tc O O O O W W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.312</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">411</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.44 2.00 1.99 1.88 1.77 1.72 1.61 1.56 1.53 1.49 1.49 1.48 1.48 1.26 1.26 1.20 1.18 1.16 1.11 1.11 1.11 1.10 1.09 1.05 1.04 1.04 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:y P:z P:z D:xy P:x P:x P:y P:y D:xy D:xy P:z P:z P:y P:z P:z P:x P:x P:y P:x P:z P:x P:z D:xz P:x P:x P:z D:xz P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">38 71 49 101 98 36 39 23 100 103 64 31 40 50 55 45 41 96 46 69 52 44 15 83 59 48 2 92</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O Tc O O O O Tc Tc O O O O O O O O O O O O W O O O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.305</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">412</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">3.97 3.24 3.20 2.63 2.56 2.27 2.22 2.12 2.06 2.01 2.01 1.80 1.77 1.55 1.54 1.53 1.50 1.47 1.44 1.39 1.39 1.38 1.36 1.34 1.33 1.32 1.20 1.19 1.11 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:x P:z P:z D:xz D:xz P:z P:z D:z2 P:y P:x P:y P:y P:y P:x D:z2 D:z2 P:x P:x P:x P:y P:y P:x P:x D:xy D:xy P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">28 41 45 2 15 97 35 101 44 30 69 41 45 54 5 18 43 49 71 98 36 36 26 3 16 98 34 67 54 43</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O W W O O Tc O O O O O O W W O O O O O O O W W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.293</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">413</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">2.74 2.44 2.31 2.18 2.09 2.06 1.94 1.77 1.63 1.61 1.53 1.41 1.30 1.12 1.11 1.11 1.08 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:y P:x P:x P:z P:y P:x P:z P:x P:z P:z D:xy P:z D:xz P:z P:z D:xy P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 0.80 1.33 1.33 1.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">23 59 83 55 38 36 50 98 48 71 102 49 7 64 92 100 57 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O O O O O O Tc O W O O Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.292</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">414</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">1.76 1.56 1.55 1.45 1.42 1.39 1.38 1.33 1.28 1.24 1.18 1.13 1.12 1.11 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">P:z D:xz P:x P:y P:z P:y D:xz P:y P:y P:x P:x P:y P:x P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">1.33 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">33 12 86 34 66 67 5 87 94 41 37 45 45 77 56</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">O W O O O O W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.280</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">415</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">1.70 1.66 1.43 1.42 1.39 1.38 1.30 1.29 1.28 1.23 1.23 1.20 1.08 1.05 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">D:xz D:xz D:xz D:xz P:y P:y P:x P:z P:z P:y P:y P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">12 7 18 5 67 34 86 33 66 87 94 37 85 82 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">W W W W O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.270</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">416</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">1.78 1.75 1.55 1.55 1.48 1.48 1.45 1.42 1.25 1.25 1.24 1.22 1.17 1.16 1.16 1.14 1.13 1.12 1.09 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x P:z P:z P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">57 82 91 75 25 60 45 41 80 32 53 65 58 63 41 45 70 47 73 74 76</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.247</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">417</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">2.47 2.44 2.03 1.97 1.97 1.85 1.84 1.84 1.76 1.68 1.68 1.65 1.60 1.57 1.49 1.34 1.24 1.24 1.21 1.18 1.17 1.14 1.11 1.10 1.10 1.09 1.08 1.08 1.06 1.03 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:z2 D:z2 D:xz D:z2 P:z D:z2 P:x P:x P:x P:x P:z P:x P:x P:x P:x P:z P:x P:x P:z P:x P:x P:x P:x P:z P:z P:x P:z P:x P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-4.498 -4.498 -6.613 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">0.80 0.80 1.00 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">13 8 103 9 39 19 81 56 73 98 93 36 85 51 95 88 88 78 78 90 76 72 74 48 92 58 86 84 63 89 57 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W Tc W O W O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.242</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">418</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">1.62 1.60 1.60 1.55 1.51 1.45 1.44 1.42 1.23 1.20 1.19 1.16 1.09 1.08 1.08 1.06 1.05 1.02 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:x P:x P:x P:z P:z P:x P:z P:z P:y P:y P:y P:y P:z P:y P:y D:xy P:y D:xy D:xy P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">57 82 45 80 53 41 32 65 75 60 91 25 78 76 74 12 27 5 18 61</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O W O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.209</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">419</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">3.28 3.26 2.22 2.04 2.04 1.83 1.81 1.79 1.78 1.67 1.67 1.48 1.45 1.44 1.41 1.27 1.27 1.23 1.20 1.18 1.13 1.10 1.09 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:x P:x D:z2 P:x P:x P:z P:z P:x P:x D:z2 D:z2 P:z P:z P:z D:z2 P:x P:x P:y P:x P:y P:x P:x D:x2-y2 P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">89 84 103 83 59 99 77 87 94 11 6 79 24 23 102 80 53 51 96 95 92 48 102 63 58</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O Tc O O O O O O W W O O O Tc O O O O O O O Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.202</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">420</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">8.08 8.01 6.57 6.50 4.96 4.71 2.25 2.14 2.10 2.06 1.76 1.75 1.73 1.59 1.46 1.45 1.37 1.27 1.24 1.22 1.17 1.12 1.11 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:x P:x D:yz D:yz P:y P:z P:y P:z P:y P:y P:z P:z P:y P:y P:y P:y P:z P:x P:x P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">27 61 60 25 100 101 97 36 35 98 37 26 45 41 41 45 43 54 29 31 64 62 98 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O Tc Tc O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.201</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">421</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">1.91 1.89 1.84 1.77 1.67 1.48 1.44 1.36 1.36 1.34 1.33 1.32 1.30 1.26 1.24 1.22 1.19 1.17 1.16 1.14 1.11 1.09 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:x P:z P:x P:z D:z2 P:x P:x D:z2 D:z2 P:x P:x P:x P:x P:x P:x P:y D:z2 D:z2 P:z P:x P:x P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">42 62 68 29 100 43 54 14 1 32 67 65 34 56 81 35 4 17 79 69 44 97 24</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O Tc O O W W O O O O O O O W W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.198</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">422</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">7.99 7.97 6.40 6.40 4.86 4.55 2.34 2.20 2.06 2.01 1.90 1.90 1.58 1.51 1.51 1.44 1.27 1.26 1.25 1.22 1.22 1.16 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:x P:x D:yz D:yz P:y P:y P:z P:z P:y P:y P:z P:z P:y P:y P:z P:y P:x P:x P:y P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">76 74 91 75 102 103 95 51 59 83 85 86 82 57 57 82 24 56 48 92 81 79 83 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O Tc Tc O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.184</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">423</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.46 2.44 2.17 2.11 2.09 2.07 1.84 1.84 1.55 1.52 1.50 1.49 1.47 1.44 1.31 1.30 1.23 1.23 1.22 1.21 1.07 1.07 1.04 1.04 1.02 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:x P:x P:z P:z P:z P:z P:x P:x P:y P:x P:x P:y P:y P:y P:z P:z P:x P:x P:x P:x P:x P:x P:x P:z P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">35 97 98 82 36 57 59 83 35 45 41 97 54 43 41 45 81 56 67 34 82 57 98 23 36 56</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.152</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">424</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">1.55 1.47 1.46 1.44 1.42 1.40 1.37 1.37 1.31 1.30 1.27 1.27 1.25 1.23 1.19 1.17 1.13 1.13 1.13 1.12 1.10 1.06 1.05 1.05 1.05 1.04 1.04 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:y P:x P:x P:y P:z P:z P:z P:z P:y P:y P:x P:x P:x P:x P:x P:x P:y P:z P:y P:y P:z P:y P:y P:z P:y P:z P:z P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">30 35 97 93 35 97 95 51 25 60 43 54 95 51 81 56 75 43 28 91 54 70 47 59 73 98 83 39 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.145</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">425</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">3.19 3.14 2.49 2.49 2.47 2.44 1.93 1.90 1.87 1.64 1.63 1.60 1.53 1.48 1.26 1.24 1.23 1.23 1.18 1.18</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:x P:x P:x P:x P:x P:x P:z P:z P:z P:z P:x P:x P:z P:z P:z P:x P:x P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">82 57 83 51 59 95 96 83 59 23 97 35 56 81 82 41 45 57 36 98</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.125</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">426</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.12 2.11 1.91 1.90 1.74 1.72 1.57 1.56 1.55 1.55 1.46 1.44 1.41 1.41 1.41 1.40 1.38 1.38 1.30 1.29 1.22 1.20 1.20 1.15 1.13 1.12 1.11 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x P:x P:x P:x P:x P:x P:x P:x P:y P:y P:z P:z P:y P:y P:z P:z P:z P:z P:x P:x P:y P:z P:z P:z P:z P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">57 82 41 45 95 51 97 35 63 58 81 56 70 47 83 59 43 54 56 81 93 51 95 36 98 54 43 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.040</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">427</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">4.92 4.92 4.00 3.98 2.54 2.54 2.53 2.50 2.45 2.44 2.18 2.17 2.11 2.10 2.08 1.68 1.60 1.58 1.27 1.26 1.24 1.02 1.02 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:x P:x P:x P:x P:z P:z P:z P:z P:y P:y P:x P:x P:y P:y D:x2-y2 P:x P:z P:z D:xz D:xz P:x P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">91 75 76 74 51 95 88 78 59 83 48 92 57 82 102 93 56 81 8 13 21 83 59 78 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O Tc O O O W W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.018</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">428</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">10.80 10.79 4.11 4.09 1.60 1.60 1.53 1.52 1.29 1.28 1.20 1.19 1.14 1.12 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:y P:y P:y P:y P:z P:z D:yz D:yz P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">58 63 70 47 48 92 11 6 84 89 55 50 6 11 78 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O W W O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.009</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">429</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">10.99 10.96 3.37 3.35 1.85 1.83 1.43 1.42 1.40 1.40 1.39 1.21 1.21 1.18 1.16 1.15 1.15 1.15 1.14 1.10 1.10 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:y P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:x P:y P:y P:x P:x P:y P:y P:x P:x D:xz D:xz P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">70 47 42 68 69 44 1 14 30 63 58 27 61 68 42 25 60 4 17 36 98 35 97</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O W W O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.006</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">430</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">1.60 1.58 1.57 1.57 1.35 1.34 1.30 1.27 1.26 1.25 1.25 1.25 1.23 1.23 1.17 1.15 1.10 1.10 1.10 1.10 1.09 1.09 1.09 1.08 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:y P:x P:x P:y D:x2-y2 D:x2-y2 P:x P:x P:x P:x D:x2-y2 D:x2-y2 P:x P:x P:y P:y P:x P:x P:x P:x P:x P:x P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">31 49 71 64 17 4 27 61 97 35 3 16 68 42 68 42 69 44 43 64 54 55 50 31 92</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O W W O O O O W W O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.999</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">431</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">1.65 1.61 1.49 1.49 1.40 1.39 1.36 1.35 1.35 1.33 1.31 1.30 1.27 1.27 1.26 1.25 1.14 1.14 1.06 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:x P:x P:x P:x D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y P:x P:x P:x P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">92 48 95 51 48 92 13 19 8 9 78 88 55 50 76 74 78 88 31 64</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O W W W W O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.981</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">432</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">3.46 3.41 3.02 3.00 2.55 2.54 2.34 2.33 1.94 1.92 1.70 1.69 1.67 1.67 1.39 1.38 1.38 1.37 1.37 1.34 1.33 1.32 1.25 1.24 1.17 1.06 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:y P:y P:x P:x P:x P:x P:x P:x P:y P:y P:y P:y P:z P:z P:z P:z D:yz D:yz P:y P:x P:y P:x P:z P:z P:x P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">58 63 25 60 61 27 39 37 68 42 45 41 47 70 54 43 14 1 47 75 70 91 35 97 86 30 57 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O W W O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.966</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">433</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">6.19 6.19 3.37 3.37 3.14 3.12 2.54 2.54 2.41 2.37 1.73 1.70 1.37 1.37 1.31 1.31 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:z P:z P:y P:y D:yz D:yz P:z P:z P:y P:y P:y P:y D:yz D:yz P:z P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">47 70 64 31 1 14 63 58 42 68 78 88 6 11 37 30 28</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O W W O O O O O O W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.959</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">434</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">6.48 6.47 3.81 3.75 2.72 2.71 2.61 2.55 1.91 1.89 1.70 1.69 1.25</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">P:z P:z P:y P:y D:yz D:yz P:y P:y P:y P:y P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">58 63 92 48 6 11 78 88 31 64 70 47 73</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O W W O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.949</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">435</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">6.31 6.30 3.58 3.57 2.71 2.66 2.61 2.58 2.47 2.47 2.46 2.46 2.03 2.00 1.79 1.79 1.39 1.38 1.27 1.26 1.20 1.18</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x D:xy D:xy P:y P:y P:y P:y P:x P:y P:x P:y P:y P:y P:y P:y D:xy D:xy P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">47 70 1 14 31 64 49 71 63 69 58 44 68 42 48 92 6 11 84 89 52 46</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O W W O O O O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.945</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">436</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">6.24 6.21 3.55 3.54 2.84 2.79 2.44 2.40 2.31 2.24 2.22 2.20 2.19 2.14 1.30 1.29 1.26 1.26 1.16 1.16 1.05 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x D:xy D:xy P:y P:y P:y P:y P:y P:y P:y P:x P:x P:y P:x P:x D:xy D:xy P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">63 58 6 11 55 50 78 88 84 48 89 47 70 92 72 90 14 1 49 71 68 42</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O W W O O O O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.943</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">437</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">8.87 8.83 4.91 4.85 4.75 4.75 2.44 2.39 2.27 2.24 2.24 2.15 1.79 1.75 1.58 1.56 1.35 1.33 1.23 1.23 1.13 1.10 1.07 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:y P:y D:z2 D:z2 P:y P:y P:y P:y D:z2 D:z2 P:y P:y D:xy D:xy D:yz D:yz P:z P:z D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">69 44 31 64 70 47 2 15 64 62 29 31 16 3 65 32 16 3 3 16 42 68 2 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O W W O O O O W W O O W W W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.941</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">438</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">8.92 8.85 5.07 5.06 4.55 4.51 2.44 2.40 2.30 2.27 2.26 2.25 1.83 1.79 1.57 1.56 1.39 1.38 1.27 1.26 1.24 1.20 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:y P:y D:z2 D:z2 P:y P:y P:y P:y D:z2 D:z2 P:y P:y D:xy D:xy D:yz D:yz P:z P:z D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">84 89 48 92 58 63 10 20 92 24 79 48 19 9 53 80 19 9 9 19 88 78 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O W W O O O O W W O O W W W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.930</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">439</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">6.66 6.60 4.62 4.59 2.98 2.97 2.18 2.17 2.14 2.12 2.10 2.10 1.98 1.97 1.56 1.55 1.50 1.50 1.40 1.39 1.33 1.33 1.26 1.24 1.15 1.14 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:z P:z P:z P:y P:y P:y P:y P:z P:z P:y P:y D:z2 D:z2 D:z2 D:z2 P:y P:y P:z P:z D:xy D:xy P:z P:z D:yz D:yz P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">49 71 68 42 70 47 42 68 55 50 66 33 5 18 17 4 67 34 31 64 17 4 78 88 4 17 58 63</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O W W W W O O O O W W O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.926</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">440</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">6.32 6.30 4.84 4.80 3.03 3.01 2.13 2.10 2.10 2.10 1.86 1.85 1.78 1.78 1.65 1.65 1.63 1.62 1.45 1.45 1.38 1.36 1.31 1.31 1.19 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:z P:z P:y P:y P:y P:y P:y P:y P:z P:z D:z2 D:z2 P:z P:z D:z2 D:z2 P:y P:y P:z P:z D:xy D:xy D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">55 50 78 88 58 63 88 99 77 78 49 71 7 12 42 68 13 8 94 87 48 92 8 13 8 13</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O W W O O W W O O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.816</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">441</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="35">2.55 2.33 2.09 2.08 1.90 1.89 1.76 1.75 1.73 1.72 1.72 1.69 1.69 1.69 1.69 1.51 1.51 1.45 1.44 1.42 1.34 1.34 1.25 1.24 1.24 1.24 1.23 1.23 1.15 1.14 1.11 1.09 1.09 1.07 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="35">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="35">P:x P:x P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:x P:z P:z P:z P:z P:x P:x P:x P:x P:x P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="35"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="35">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="35">23 38 74 76 84 89 68 84 42 89 69 71 49 44 96 55 50 78 88 40 27 61 55 50 49 89 84 71 69 44 49 71 55 50 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="35">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.803</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">442</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">2.59 2.58 2.31 2.28 2.23 2.08 2.02 2.01 1.97 1.93 1.89 1.88 1.79 1.77 1.69 1.69 1.67 1.63 1.52 1.52 1.46 1.44 1.35 1.33 1.31 1.30 1.20 1.18 1.12 1.12 1.12 1.11 1.10 1.09 1.07 1.05 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:z P:z P:x P:x P:x P:y P:y P:z P:z P:x P:z P:z P:z P:z P:x P:x P:z P:z P:x P:x P:y P:y P:z P:z P:x P:x P:x P:x P:x P:y P:x P:z P:y P:y P:z P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">49 71 49 71 38 49 71 69 44 23 55 50 84 89 55 50 68 42 84 89 55 50 78 88 74 76 69 44 27 89 61 31 84 69 64 44 40 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.769</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">443</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">6.57 6.54 4.80 4.74 2.14 2.12 1.98 1.95 1.91 1.88 1.58 1.57 1.50 1.50 1.46 1.46 1.45 1.44 1.22 1.22 1.19 1.19 1.10 1.09 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y P:x P:x P:x P:z P:x P:z P:y P:x P:x P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">64 31 42 68 44 69 71 49 44 69 71 49 68 42 31 48 64 92 64 44 69 31 68 42 70 47</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.768</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">444</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">6.46 6.45 5.02 4.96 2.08 2.07 2.00 1.95 1.85 1.81 1.60 1.59 1.52 1.51 1.51 1.50 1.41 1.40 1.24 1.21 1.17 1.17 1.15 1.15 1.14 1.14 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:x P:x P:x P:y P:x P:y P:z P:z P:y P:y P:x P:z P:x P:z P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">48 92 88 78 89 84 50 55 89 84 48 92 88 50 78 55 64 31 92 48 89 42 84 68 78 88 63 58</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.701</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">445</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">6.64 5.43 5.41 4.48 2.57 2.46 2.41 2.38 2.26 2.23 2.23 1.81 1.79 1.31 1.31 1.15 1.14 1.09 1.08 1.08 1.08 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:z P:x P:x D:xz D:xz P:z P:x P:x P:x P:z P:z P:z P:z D:xz P:x P:x P:x P:z P:z P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">39 92 48 103 101 96 64 31 21 92 48 50 55 102 96 49 71 84 89 72 90 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O Tc Tc O O O O O O O O Tc O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.664</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">446</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">10.49 6.21 6.06 1.66 1.63 1.41 1.36 1.34 1.16 1.13 1.12 1.12 1.10 1.09 1.06 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:y D:xy D:xy D:xy D:xy P:x P:x P:x P:z P:x P:z P:x P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">39 103 101 102 100 71 50 55 42 49 88 42 78 68 64 48</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O Tc Tc Tc Tc O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.663</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">447</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">5.54 5.28 5.15 5.14 5.03 4.93 4.92 3.37 3.27 2.99 2.54 2.19 2.08 1.79 1.36 1.31 1.29 1.28 1.14 1.11 1.09 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:y P:z P:y P:x P:z P:z P:x P:z D:x2-y2 P:x P:x P:x P:y D:z2 P:x D:xz P:y P:z P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">22 68 70 44 47 42 69 40 38 22 100 40 49 71 44 100 31 100 69 31 64 64</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O Tc O O O O Tc O Tc O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.632</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">448</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">5.01 3.59 3.59 2.76 2.75 2.71 2.70 1.72 1.71 1.62 1.61 1.47 1.47 1.46 1.41 1.40 1.34 1.34 1.13 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:y P:z P:z P:z P:z D:xy D:xy P:z P:z P:z P:z P:y P:z P:z P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">28 64 31 29 62 32 65 3 16 44 69 67 34 73 47 70 69 44 66 33</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O W W O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.631</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">449</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">5.36 4.07 4.06 2.57 2.56 2.48 2.47 2.22 2.20 1.70 1.64 1.63 1.63 1.63 1.49 1.48 1.16 1.16 1.07 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:y P:z P:z P:z P:z P:z P:z P:y D:xy D:xy P:y P:y P:z P:z P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">73 48 92 79 24 53 80 89 84 28 9 19 31 64 63 58 94 87 84 89</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.621</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">450</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">5.82 5.69 4.24 4.23 3.78 3.04 2.62 2.62 2.60 2.45 2.44 2.37 2.36 2.00 1.77 1.31 1.12 1.12 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:y P:y P:z P:z P:z P:z P:x P:x D:xz P:x P:x P:z P:z P:x P:x P:z P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">63 58 89 84 96 39 55 50 101 64 31 48 92 21 96 21 23 90 72</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O Tc O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.616</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">451</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">3.26 3.26 2.43 2.43 2.29 2.26 1.85 1.84 1.60 1.60 1.54 1.51 1.46 1.46 1.40 1.40 1.12 1.12 1.12 1.11 1.07 1.06 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:y P:y P:z P:z P:x P:x P:y P:y P:z P:z P:x P:x P:z P:z D:z2 P:x D:z2 P:x P:x P:x D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">70 47 31 64 44 69 63 58 92 48 84 89 62 29 47 70 2 65 15 32 44 69 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O W O W O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.609</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">452</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">2.90 2.90 1.68 1.68 1.67 1.67 1.51 1.49 1.38 1.36 1.30 1.28 1.26 1.26 1.25 1.25 1.18 1.17 1.16 1.08 1.08 1.06 1.06 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:y P:y P:y P:y P:z P:z P:z P:z D:z2 D:z2 P:x P:x P:x P:x D:yz P:y D:yz P:y P:y P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">63 58 48 84 92 89 89 84 63 58 10 20 79 24 47 70 9 39 19 83 59 50 55 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O W W O O O O W O W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.594</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">453</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">8.56 8.56 5.77 5.75 5.00 4.98 4.25 3.44 3.42 3.12 3.11 2.15 2.15 2.11 2.10 2.04 2.03 1.55 1.54 1.19 1.19 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:y P:z P:z P:x P:x P:y P:y P:y P:z P:z D:xy D:xy D:x2-y2 D:x2-y2 D:z2 D:z2 D:yz D:yz P:x P:x D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">68 42 49 71 70 47 26 71 49 47 70 14 1 5 18 5 18 1 14 71 49 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O W W W W W W W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.591</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">454</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">8.56 8.52 5.84 5.78 4.83 4.82 4.31 3.50 3.47 3.22 3.20 2.12 2.12 2.11 2.10 2.06 2.05 1.59 1.58 1.16 1.14 1.08 1.07 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:y P:y P:z P:z P:x P:x P:y P:y P:y P:z P:z D:x2-y2 D:x2-y2 D:xy D:xy D:z2 D:z2 D:yz D:yz P:x P:x D:xy D:xy P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">88 78 55 50 63 58 85 50 55 63 58 12 7 6 11 7 12 6 11 50 55 8 13 77 99</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O W W W W W W W W O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.540</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">455</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">3.86 3.21 3.18 3.07 2.76 2.70 2.67 1.67 1.67 1.62 1.62 1.33 1.32 1.27 1.27 1.21 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:z P:z P:z P:x D:xz P:y P:y P:z P:z P:z P:z P:x P:x P:z P:z D:z2 D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">23 50 55 23 101 58 63 88 78 64 31 92 48 68 42 103 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O Tc O O O O O O O O O O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.537</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">456</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">4.95 4.88 3.21 3.18 3.17 3.16 2.23 2.23 2.22 2.22 1.62 1.23 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">P:z P:x P:y P:z P:y P:z P:x P:z P:z P:x D:z2 P:x D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">38 38 47 49 70 71 64 42 68 31 101 37 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O O O O O O O Tc O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.514</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">457</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">3.98 3.96 3.85 3.84 3.59 3.49 2.05 2.02 1.90 1.90 1.76 1.76 1.51 1.50 1.48 1.47 1.34 1.33 1.33 1.32 1.22 1.20 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:y P:y P:y D:xy D:xy D:xy D:xy P:x P:x P:x P:x P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">44 69 89 84 100 102 103 101 44 69 89 84 49 71 55 50 68 42 78 88 22 21 40</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O Tc Tc Tc Tc O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.485</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">458</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">4.05 4.04 3.73 3.70 2.63 2.50 1.67 1.67 1.63 1.61 1.51 1.51 1.23 1.22 1.11 1.11 1.10 1.10 1.09 1.09 1.05 1.04 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:x P:x P:z P:z D:xz P:x P:z P:z P:x P:x P:y P:y P:z P:z P:x P:y P:y P:x P:x D:x2-y2 P:y P:y D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">50 55 88 78 103 23 64 31 88 78 74 76 90 72 69 56 81 93 44 102 95 51 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O Tc O O O O O O O O O O O O O O Tc O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.449</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">459</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">3.61 3.61 3.33 3.31 3.27 2.83 1.90 1.89 1.89 1.89 1.78 1.77 1.75 1.75 1.63 1.63 1.62 1.56 1.55 1.47 1.45 1.45 1.38 1.37 1.34 1.21 1.14 1.14 1.10 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:y P:y P:y P:y P:y P:y P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:y P:x P:x P:y P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">44 69 89 84 40 96 52 46 69 44 68 42 89 84 88 78 38 90 72 28 49 71 71 49 73 23 64 31 50 55</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.432</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">460</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">4.02 4.01 3.73 3.73 3.12 2.83 2.33 2.33 2.14 1.98 1.98 1.72 1.70 1.70 1.43 1.42 1.42 1.40 1.38 1.37 1.27 1.19 1.16 1.16 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:y P:y P:y P:x P:x P:y P:x P:x P:x P:y P:x P:x P:x P:y P:y P:x P:x P:y P:y P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">50 55 71 49 23 38 72 90 96 46 52 50 40 55 49 71 89 84 48 92 85 26 31 64 44 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.387</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">461</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">1.90 1.83 1.77 1.72 1.71 1.68 1.63 1.59 1.58 1.57 1.55 1.53 1.51 1.51 1.44 1.44 1.43 1.41 1.34 1.31 1.29 1.26 1.26 1.18 1.16 1.15 1.15 1.14 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:x D:z2 D:z2 P:y P:y P:x P:x P:y P:y P:x P:x P:y D:z2 P:y P:y P:y D:x2-y2 P:z P:x D:x2-y2 D:z2 P:y P:y P:x P:z P:z P:x D:x2-y2 P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">73 103 102 58 63 85 93 75 91 86 28 70 101 47 60 25 102 23 26 103 100 74 76 37 52 46 30 100 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O Tc Tc O O O O O O O O O Tc O O O Tc O O Tc Tc O O O O O O Tc O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.367</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">462</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">2.13 2.13 2.01 1.99 1.99 1.98 1.81 1.73 1.70 1.67 1.65 1.58 1.57 1.57 1.49 1.46 1.45 1.45 1.39 1.38 1.38 1.38 1.27 1.25 1.25 1.17 1.12 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:z P:z P:y P:z P:y P:z P:x P:x P:x P:y P:y P:z P:z P:x D:z2 D:z2 P:x P:x P:y P:z P:y P:z D:z2 P:y P:y P:x D:z2 P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">52 46 47 72 70 90 23 28 38 58 63 68 42 73 101 100 88 78 60 88 25 78 102 75 91 26 103 30 85</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O Tc Tc O O O O O O Tc O O O Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.343</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">463</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">3.26 3.08 2.61 2.42 2.12 2.11 1.99 1.89 1.73 1.73 1.62 1.61 1.60 1.52 1.51 1.47 1.46 1.45 1.44 1.42 1.42 1.21 1.21 1.20 1.19 1.16 1.14 1.07 1.07 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:y P:y P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:y P:z P:z P:z P:z P:y P:y P:x P:x P:y P:y P:x P:x P:z P:z P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">26 28 85 30 62 29 73 37 33 66 65 32 39 70 47 64 31 86 93 24 79 42 68 77 99 92 48 53 80 63 58</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.335</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">464</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">2.93 2.78 2.76 2.21 2.21 2.17 2.15 2.05 2.05 2.03 1.73 1.72 1.71 1.63 1.62 1.58 1.58 1.54 1.54 1.51 1.51 1.41 1.41 1.38 1.37 1.34 1.15 1.15 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:y P:y P:y P:x P:x P:y P:y P:x P:x P:y P:y P:y P:y P:z P:z P:x P:x P:y P:y P:y P:y P:x P:x P:x P:x P:y P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">85 73 93 24 79 30 86 77 99 28 48 92 26 58 63 29 62 31 64 88 78 66 33 80 53 37 47 70 42 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.320</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">465</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">8.02 4.26 4.24 3.45 3.44 2.58 2.38 2.37 2.36 2.36 2.05 2.05 2.03 2.02 1.98 1.70 1.69 1.46 1.45 1.45 1.44 1.18 1.15 1.14 1.14 1.13 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:z P:z P:z P:z P:z D:xz P:z P:x P:x P:z P:z P:z D:xz P:z P:z P:z P:z P:x P:x P:z P:z P:x P:z D:xz P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">39 31 64 92 48 101 55 44 69 50 52 46 103 23 96 90 72 71 49 84 89 22 71 100 49 89 84</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O Tc O O O O O O Tc O O O O O O O O O O Tc O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.312</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">466</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.40 2.20 1.86 1.73 1.68 1.56 1.55 1.54 1.53 1.42 1.42 1.42 1.25 1.22 1.18 1.16 1.13 1.12 1.09 1.09 1.03 1.03 1.02 1.02 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:y P:y P:x P:z P:x P:z P:z P:y P:z P:z P:z P:x P:x P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">37 38 23 39 26 67 33 34 66 68 86 42 71 49 46 52 47 70 31 64 63 58 92 48 66 33</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.305</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">467</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">2.38 1.99 1.95 1.95 1.93 1.89 1.76 1.76 1.66 1.65 1.54 1.53 1.40 1.39 1.35 1.34 1.33 1.30 1.29 1.26 1.25 1.17 1.17 1.15 1.14 1.08 1.08 1.07 1.06 1.04 1.04 1.03 1.03 1.02 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">P:y P:y P:y P:z P:z P:y P:x P:x P:z P:z P:x P:x P:z P:z P:z P:z P:y P:z P:z P:y P:y P:x P:x P:x P:x P:y P:z P:z P:y P:z P:y P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">86 37 85 77 99 26 87 94 66 33 34 67 79 24 59 83 30 62 29 73 93 63 58 53 80 28 57 82 82 41 57 78 45 36 88 98</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.291</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">468</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">5.38 2.54 2.54 2.33 2.33 2.09 1.90 1.90 1.73 1.73 1.72 1.71 1.71 1.65 1.64 1.51 1.50 1.46 1.43 1.43 1.37 1.37 1.37 1.35 1.26 1.12 1.11 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y D:xy D:xy P:z P:z P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">39 55 50 49 71 93 48 92 31 64 63 58 85 47 70 38 30 23 90 72 46 52 26 101 103 24 79 86 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O Tc Tc O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.223</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">469</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">12.55 4.72 4.15 4.15 3.74 2.61 2.60 2.53 2.53 2.45 2.16 2.15 2.15 1.86 1.85 1.83 1.81 1.80 1.59 1.58 1.29 1.23 1.09 1.05 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:x P:z P:z P:z P:z P:x P:x P:x P:x P:z P:x P:y P:y P:x P:x D:x2-y2 P:x P:x P:z P:z P:x D:z2 D:xz P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">22 40 44 69 38 61 27 36 98 22 26 41 45 25 60 100 69 44 68 42 28 101 100 54 43</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O Tc O O O O O Tc Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.215</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">470</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.96 4.93 3.02 2.04 2.02 1.95 1.92 1.84 1.84 1.71 1.68 1.41 1.40 1.31 1.30 1.28 1.27 1.26 1.26 1.18 1.18 1.13 1.11 1.10 1.10 1.10 1.10 1.10 1.08 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:x P:x P:x P:x P:x P:y P:y P:z P:z P:y P:y P:x P:x P:z P:z P:y P:x P:x P:y P:x P:x P:x P:x P:z P:x P:z P:y D:xz P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">76 74 22 21 73 57 82 81 56 59 83 91 75 89 84 81 81 56 56 69 44 85 59 51 83 95 95 100 51 48 92</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O Tc O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.186</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">471</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">4.03 3.98 3.29 2.97 2.35 2.35 2.33 2.33 1.80 1.71 1.71 1.64 1.49 1.39 1.39 1.36 1.36 1.09 1.08 1.08 1.07 1.07 1.03 1.01 1.01 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:x P:x P:x P:z P:y P:y P:z P:z D:xz P:z P:z D:z2 P:x P:x P:z P:x P:x P:y P:z P:y P:x P:z P:z P:z P:y P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">61 27 22 38 98 36 71 49 100 54 43 100 21 28 39 74 76 54 42 43 26 68 22 97 97 30 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O Tc O O Tc O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.179</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">472</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">2.90 2.89 2.62 2.62 2.52 2.52 2.28 2.28 2.26 1.85 1.71 1.38 1.38 1.34 1.31 1.30 1.29 1.27 1.25 1.16 1.14 1.14 1.12 1.09 1.08 1.08 1.06 1.04 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:y P:y P:y P:y P:y P:y P:y P:y P:y D:xy P:y D:xy P:x P:x D:xy D:xy P:y P:x P:x P:z P:z P:z P:z P:y P:x P:x P:y P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -6.613 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">47 70 46 52 58 63 72 90 22 100 21 102 27 61 103 101 40 60 25 45 41 98 36 96 74 76 26 38 43</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O Tc O Tc O O Tc Tc O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.139</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">473</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.86 4.75 3.88 3.85 2.50 1.67 1.66 1.56 1.54 1.51 1.47 1.44 1.42 1.35 1.33 1.28 1.27 1.25 1.25 1.24 1.23 1.15 1.15 1.11 1.10 1.08 1.08 1.04 1.01 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">D:xy P:y P:y D:xy P:y P:x P:x P:z P:z P:x P:x P:z P:z P:y P:y P:x P:x P:y P:y P:x P:x P:z P:z P:x P:x P:x P:x P:x P:z P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">102 21 22 100 39 91 75 82 57 60 25 45 41 63 58 81 56 72 90 84 89 59 83 44 69 59 83 74 98 76 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">Tc O O Tc O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.128</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">474</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">21.52 7.20 3.50 3.47 2.77 2.47 2.03 1.99 1.81 1.48 1.37 1.26 1.22 1.07 1.06 1.06 1.03 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:x D:xz P:x P:x P:z P:x P:z P:z P:x P:z P:z D:x2-y2 P:x P:x P:y P:x P:x P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">21 102 78 88 21 85 90 72 96 81 56 102 86 56 59 81 59 81 83</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O Tc O O O O O O O O O Tc O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.120</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">475</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">8.21 4.50 4.46 2.87 2.76 2.72 2.32 2.32 2.14 2.13 2.08 2.07 2.03 2.03 2.00 1.99 1.88 1.86 1.86 1.85 1.82 1.66 1.66 1.66 1.63 1.53 1.47 1.47 1.17 1.16 1.07 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">D:xy P:z P:z P:y P:x P:x P:z P:z P:x P:x P:x P:x P:y P:y P:y P:y P:x P:y P:y P:x P:y P:y P:y P:z P:z P:y P:y P:y P:x P:x P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">100 98 36 22 27 61 41 45 62 29 25 60 43 54 47 70 44 46 52 69 28 68 42 43 54 30 35 97 66 33 40 52 46</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">Tc O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.119</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">476</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">8.06 4.67 4.49 2.89 2.79 2.77 2.44 2.39 2.24 2.16 2.16 2.12 2.09 2.00 1.95 1.86 1.78 1.77 1.77 1.77 1.76 1.74 1.64 1.63 1.63 1.52 1.49 1.46 1.20 1.15 1.04 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:xy P:z P:z P:x P:y P:x P:z P:z P:x P:x P:x P:x P:y P:y P:y P:y P:x P:y P:z P:x P:y P:y P:y P:z P:y P:y P:y P:y P:x P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">102 83 59 74 21 76 82 57 75 24 79 91 56 81 58 63 89 72 56 84 90 73 88 81 78 93 51 95 99 77 72 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">Tc O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.101</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">477</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.81 2.78 2.33 2.32 2.21 2.21 2.21 2.20 2.16 2.15 1.82 1.82 1.74 1.54 1.54 1.45 1.45 1.44 1.37 1.36 1.36 1.34 1.33 1.22 1.11 1.11 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:z P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:x P:x P:x P:z P:x P:x P:x P:x P:x P:y P:y P:z P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">28 26 66 33 32 65 34 67 62 29 27 61 37 45 41 30 43 54 30 36 98 25 60 37 97 35 60 25</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.093</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">478</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="35">3.60 2.66 2.21 2.17 2.17 1.84 1.84 1.82 1.82 1.81 1.71 1.70 1.55 1.54 1.52 1.51 1.48 1.48 1.47 1.45 1.45 1.45 1.43 1.17 1.17 1.17 1.16 1.15 1.14 1.08 1.07 1.06 1.06 1.05 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="35">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="35">P:x P:z P:z P:x P:x P:y P:y P:x P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z D:xz P:y P:y P:z P:z P:z P:x P:x P:z P:z P:x P:z P:z P:x P:z P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="35"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="35">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="35">21 85 73 82 57 79 24 93 80 53 59 83 91 75 77 99 88 78 102 94 87 48 92 93 59 83 51 95 86 75 91 79 74 24 76</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="35">O O O O O O O O O O O O O O O O O O Tc O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.977</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">479</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">4.25 3.96 2.87 2.36 2.35 2.27 2.27 1.96 1.96 1.86 1.86 1.74 1.73 1.67 1.45 1.27 1.26 1.25 1.25 1.23 1.23 1.18 1.04 1.04 1.03 1.03 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:xz D:xz P:z P:x P:x P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:z P:x P:y P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">103 101 23 49 71 50 55 92 48 55 50 41 45 21 26 57 82 97 35 95 51 40 49 71 64 98 31 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">Tc Tc O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.928</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">480</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">2.35 2.34 2.19 2.18 2.01 2.01 1.86 1.85 1.73 1.73 1.62 1.61 1.42 1.42 1.18 1.17 1.10 1.04 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">D:xy D:xy P:z P:z P:z P:z P:z P:z P:x P:x P:z P:z P:x P:x P:y P:y D:xy P:y P:y D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">103 101 95 51 81 56 97 35 74 76 54 43 61 27 82 57 102 41 45 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">Tc Tc O O O O O O O O O O O O O O Tc O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.915</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">481</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">3.31 3.30 3.05 3.04 3.03 3.03 2.78 2.78 2.75 2.74 2.42 2.42</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">P:z P:z P:x P:x P:z P:z P:x P:x P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">54 43 61 27 81 56 74 76 97 35 95 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.876</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">482</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">3.66 3.62 2.61 2.60 2.55 2.51 2.45 2.43 2.36 2.33 2.21 2.19 2.08 2.07 1.70 1.68 1.61 1.61 1.42 1.40 1.40 1.39 1.25 1.24</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:xy D:xy P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:y P:y P:z P:z P:z P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">101 103 41 45 57 82 49 71 55 50 97 35 95 51 22 21 54 43 81 56 61 27 76 74</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.873</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">483</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">5.00 3.27 3.18 3.12 3.03 2.74 2.68 2.29 2.27 2.26 2.24 2.02 2.01 2.00 1.75 1.68 1.57 1.51 1.28 1.25 1.15 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x D:x2-y2 P:x P:x P:x P:z D:xz P:x P:x P:y P:y P:x P:x P:x P:z D:x2-y2 D:z2 P:z P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">73 102 93 84 89 93 102 77 99 56 81 87 94 21 21 103 103 23 57 82 57 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O Tc O O O O Tc O O O O O O O O Tc Tc O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.849</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">484</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">6.48 5.69 5.26 4.46 3.49 3.47 3.16 2.97 2.95 2.66 2.64 2.64 2.62 2.53 1.65 1.58 1.35 1.25 1.24 1.23 1.14 1.13 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:z2 P:x D:z2 P:x P:x P:x P:x P:y P:y P:x P:x P:z P:z D:x2-y2 D:x2-y2 D:xz P:x P:z P:z P:z D:xz P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-6.613 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">100 30 101 28 34 67 37 43 54 66 33 41 45 101 100 100 26 30 36 98 101 25 60</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">Tc O Tc O O O O O O O O O O Tc Tc Tc O O O O Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.832</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">485</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">6.36 5.81 3.98 3.96 3.38 3.35 2.51 1.96 1.95 1.85 1.69 1.67 1.67 1.64 1.60 1.57 1.56 1.35 1.30 1.30 1.13 1.13 1.10 1.10 1.07 1.06 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">D:z2 D:z2 P:x P:x P:x P:x P:x P:x P:x P:z D:x2-y2 P:z P:z P:x D:x2-y2 P:y P:y P:x P:x P:x P:x P:x P:x P:x P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">102 103 85 86 80 53 93 24 79 86 103 59 83 26 102 51 95 73 91 75 32 65 94 87 57 82 39</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">Tc Tc O O O O O O O O Tc O O O Tc O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.777</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">486</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">3.17 3.16 2.59 2.58 2.51 2.47 2.41 2.41 2.38 2.37 2.13 2.08 1.86 1.85 1.56 1.55 1.32 1.32 1.27 1.26 1.22 1.19 1.19 1.18 1.18 1.17 1.15 1.12 1.09 1.09 1.05 1.05 1.02 1.01 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">D:z2 D:z2 P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z D:z2 D:z2 P:x P:x P:x P:z D:x2-y2 D:x2-y2 P:z P:x P:z P:z P:y P:y P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">1 14 54 43 97 35 60 27 25 61 36 98 45 41 60 25 6 11 67 34 32 62 14 1 29 65 66 33 56 81 75 91 51 76 95 74</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">W W O O O O O O O O O O O O O O W W O O O O W W O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.773</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">487</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">3.18 3.17 2.64 2.58 2.54 2.53 2.32 2.31 2.29 2.27 2.09 2.08 2.04 2.03 1.72 1.68 1.34 1.34 1.22 1.21 1.18 1.17 1.16 1.16 1.16 1.15 1.12 1.10 1.09 1.08 1.08 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:z2 D:z2 P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z D:z2 D:z2 P:x P:x P:y P:z D:x2-y2 D:x2-y2 P:x P:z P:x P:z P:z P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">6 11 51 95 81 56 76 74 75 91 83 59 82 57 91 75 14 1 94 80 35 24 11 6 87 79 53 99 77 43 97 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W O O O O O O O O O O O O O O W W O O O O W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.772</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">488</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">4.19 3.28 2.71 2.66 2.64 2.64 2.32 2.18 2.17 1.78 1.75 1.75 1.67 1.39 1.37 1.36 1.35 1.30 1.19 1.19 1.10 1.09 1.08 1.08 1.07 1.06 1.05 1.04 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:z P:z D:z2 P:x P:x P:x P:z P:z P:z D:xz P:x P:x D:z2 P:x P:x P:x D:xz P:x P:z P:z P:x D:x2-y2 P:z P:x P:x P:x P:x P:x P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">38 40 101 26 68 42 37 71 49 100 70 47 100 52 46 32 101 65 69 44 31 100 26 64 62 29 84 89 30 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O Tc O O O O O O Tc O O Tc O O O Tc O O O O Tc O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.737</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">489</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">7.94 2.78 2.38 2.38 2.38 2.38 2.25 2.10 2.10 2.05 1.84 1.70 1.69 1.62 1.58 1.58 1.40 1.39 1.38 1.33 1.33 1.28 1.25 1.25 1.24 1.24 1.21 1.20 1.19 1.18 1.13 1.10 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:z P:x P:z P:z P:x P:x P:z P:x P:x P:z P:z P:z P:z P:x P:z P:z D:xz P:x P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:x P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">40 28 44 69 70 47 30 52 46 38 28 25 60 38 98 36 100 65 32 33 66 37 54 43 32 65 29 62 45 41 40 64 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O O O O O O O O O O O O O O O O Tc O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.693</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">490</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">9.63 3.31 3.24 3.24 2.80 2.68 2.49 2.49 2.48 2.48 1.93 1.89 1.86 1.77 1.77 1.68 1.67 1.47 1.47 1.46 1.46 1.44 1.43 1.42 1.04 1.04 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:z P:z P:z P:x P:z P:x P:x P:x P:x P:x P:x D:xz P:x P:x P:z P:z P:z P:z P:z P:z P:x P:x P:z P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">23 85 55 50 85 86 90 72 58 63 96 23 102 79 24 75 91 78 88 87 94 83 59 96 53 80 82 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O Tc O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.628</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">491</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">11.84 9.26 4.99 4.35 4.32 4.06 4.05 2.57 1.98 1.95 1.77 1.72 1.71 1.40 1.33 1.32 1.31 1.29 1.28 1.25 1.25 1.24 1.23 1.04 1.04 1.04 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x P:z P:z P:x P:x P:z P:z D:xz P:x P:x D:z2 P:x P:x P:z P:z P:z P:x P:x P:x P:x P:z P:z P:z P:x P:z P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">21 96 21 83 59 89 84 102 84 89 102 58 63 73 75 91 72 86 90 96 83 59 23 77 93 99 81 56</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O Tc O O Tc O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.582</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">492</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">8.19 8.06 4.17 4.17 3.98 3.98 2.17 2.00 1.90 1.46 1.45 1.40 1.40 1.40 1.40 1.37 1.37 1.34 1.33 1.32 1.32</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:y P:y P:x P:x P:x P:x P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">23 38 90 72 46 52 96 40 39 55 50 78 88 71 49 48 92 31 64 68 42</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.562</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">493</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">8.13 7.52 3.91 3.90 3.88 3.87 3.82 3.41 1.62 1.61 1.59 1.58 1.40 1.40 1.32 1.31 1.31 1.20 1.20 1.20 1.19 1.16 1.16 1.15 1.14 1.14 1.14 1.14 1.12 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:y P:y P:x P:x P:x P:x P:y P:y P:y P:y P:y P:y P:x P:x P:y P:x P:x P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">96 40 46 52 90 72 38 23 88 78 42 68 88 78 21 68 42 31 49 64 71 55 50 89 84 92 22 48 44 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.537</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">494</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">9.10 8.03 4.64 4.54 4.44 4.42 2.82 2.65 1.86 1.79 1.79 1.78 1.55 1.52 1.41 1.35 1.34 1.33 1.31 1.31 1.31 1.23 1.23 1.14 1.12 1.12 1.10 1.08 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:y P:y P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:y D:xy D:xy P:y P:y P:z P:y P:z P:y P:z P:z P:y P:y P:y P:y P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">40 96 52 46 72 90 22 21 68 42 78 88 39 100 102 70 47 31 58 64 63 92 48 46 23 52 90 72 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O Tc Tc O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.526</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">495</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">12.44 7.42 4.48 3.78 3.64 3.20 3.17 2.64 2.64 2.23 2.10 1.54 1.50 1.46 1.43 1.42 1.40 1.40 1.39 1.32 1.30 1.27 1.14 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:z P:z P:z D:xz P:x P:x P:x P:x P:x P:z P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">22 22 26 38 100 43 54 98 36 40 28 52 46 42 25 60 68 34 67 71 49 37 28 33</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O Tc O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.474</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">496</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">7.82 7.69 4.19 4.17 4.02 4.02 3.14 3.07 1.92 1.92 1.91 1.91 1.65 1.63 1.62 1.62 1.51 1.50 1.32 1.31 1.24 1.23 1.23 1.21 1.09 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z D:xy D:xy P:z P:z P:z P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">23 38 72 90 46 52 96 40 92 48 64 31 50 55 71 49 101 103 78 88 42 68 45 41 57 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O Tc Tc O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.463</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">497</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">7.18 5.52 4.07 3.98 3.98 3.29 3.26 3.00 2.59 2.58 2.32 2.32 2.24 2.22 1.99 1.94 1.94 1.36 1.34 1.33 1.21 1.17 1.16 1.04 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:z P:y P:y P:y P:y P:z P:y P:y P:y P:y P:y P:y P:z P:y P:y P:z P:y P:y P:z P:y P:y P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">73 85 28 79 24 53 80 26 62 29 94 87 77 99 93 65 32 86 34 67 30 66 33 93 85 80</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.451</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">498</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">4.79 4.25 3.76 3.69 3.35 3.34 2.78 2.77 2.56 2.54 2.35 2.34 2.26 2.25 2.02 2.01 1.87 1.86 1.81 1.59 1.53 1.52 1.48 1.12 1.12 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:z P:z P:z P:z P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:y P:y P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">28 26 85 73 29 62 77 99 66 33 67 34 32 65 94 87 79 24 37 86 53 80 30 29 62 22 26</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.388</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">499</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">4.60 3.86 3.82 3.46 3.03 2.83 2.76 2.67 2.51 2.37 2.31 2.20 2.16 2.10 2.00 1.94 1.94 1.77 1.61 1.47 1.24 1.08 1.07 1.05 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z P:x P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:y P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">27 61 43 74 76 54 98 56 45 35 36 81 83 82 97 41 59 51 57 95 60 98 35 62 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.388</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">500</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">4.25 3.25 3.21 2.88 2.24 2.24 2.06 2.02 1.98 1.82 1.76 1.73 1.60 1.47 1.47 1.35 1.25 1.24 1.21 1.19 1.15 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:y P:x P:y P:z P:y P:x P:y P:z P:x P:y P:z P:y P:z P:x P:x P:z P:x P:z P:x P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">54 33 43 66 37 99 41 77 61 57 34 39 67 86 45 82 25 36 27 81 29 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.378</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">501</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">4.35 4.31 3.27 3.21 3.10 3.08 2.44 2.44 2.44 2.38 2.31 2.30 1.76 1.75 1.73 1.71 1.54 1.53 1.23 1.22 1.15 1.15 1.13 1.13 1.13 1.12 1.07 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:y P:y P:y P:y P:z P:y P:y P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">74 76 27 61 56 81 59 83 43 54 51 95 35 98 97 36 57 82 79 24 92 48 51 83 59 95 45 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.356</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">502</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">2.20 2.16 2.16 2.16 2.06 2.02 2.02 1.97 1.97 1.90 1.85 1.77 1.76 1.63 1.58 1.56 1.47 1.46 1.38 1.35 1.35 1.25 1.23 1.21 1.20 1.14 1.05 1.04 1.04 1.03 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:x P:x P:y P:y P:x P:x P:z P:y P:y P:z P:z P:x P:x P:z P:y P:y P:x P:x P:x P:x P:z P:z P:z P:y P:y P:x P:y P:y P:z P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">95 51 62 29 81 56 30 99 77 76 74 54 43 86 24 79 36 98 57 82 93 61 27 53 80 28 94 87 29 62 97</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.320</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">503</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">3.11 3.11 2.15 2.14 2.12 2.05 1.70 1.69 1.57 1.56 1.41 1.24 1.16 1.14 1.12 1.12 1.11 1.11 1.10 1.09 1.09 1.09 1.08 1.08 1.07 1.07 1.07 1.06 1.05 1.03 1.03 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:x P:x P:x P:x P:x P:z P:x P:x P:y P:y P:z P:x P:x P:z P:x P:x P:x P:x P:x P:x P:y P:x P:x P:y P:z P:z P:x P:x P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">52 46 67 34 26 37 32 65 66 33 30 28 22 93 71 49 70 47 35 97 62 40 38 29 31 64 81 56 28 44 69 36 98</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.305</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">504</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.75 3.73 2.23 1.95 1.84 1.69 1.69 1.56 1.45 1.42 1.42 1.40 1.40 1.40 1.40 1.32 1.30 1.22 1.21 1.21 1.21 1.21 1.16 1.16 1.07 1.07 1.07 1.06 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:x P:x P:z P:x P:x P:x P:x P:z P:y P:y P:z P:x P:x P:x P:x P:z P:x P:z P:z P:x P:x P:x P:z P:z P:x P:z P:y P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">72 90 93 21 73 53 80 86 24 79 85 87 56 94 81 73 85 88 78 63 96 58 48 92 23 24 77 79 99</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.246</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">505</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">5.05 3.01 2.92 2.84 2.35 1.96 1.93 1.78 1.77 1.70 1.66 1.66 1.63 1.63 1.49 1.42 1.35 1.35 1.34 1.34 1.33 1.28 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:z P:x P:x P:z P:x P:z P:y P:y P:z P:y P:y P:z P:z P:x P:x P:y P:y P:y P:y P:z P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">73 85 86 93 28 85 96 91 75 26 89 84 90 72 30 73 76 74 55 50 23 37 39</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.234</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">506</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">3.78 2.67 2.66 2.58 2.56 1.79 1.79 1.77 1.74 1.73 1.73 1.72 1.70 1.41 1.39 1.35 1.33 1.15 1.15 1.13 1.10 1.06 1.06 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:y P:y P:y P:y P:y P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:y P:y P:x P:x P:y P:y P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">39 90 72 46 52 91 75 25 60 57 82 45 41 79 24 29 62 59 83 21 22 36 98 77 99</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.229</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">507</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">4.87 4.60 3.21 2.70 2.57 2.20 2.10 2.08 1.83 1.81 1.80 1.79 1.60 1.49 1.35 1.31 1.21 1.16 1.16 1.10 1.07 1.05 1.03 1.02 1.01 1.01 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:z P:x P:z P:x P:z P:y P:y P:y P:y P:y P:y P:x P:x P:x P:z P:z P:y P:y P:x P:z P:z P:y P:y P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">28 26 30 73 37 85 69 44 71 49 60 25 93 86 28 40 38 89 84 26 46 52 27 61 70 47 91 75</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.179</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">508</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">2.99 2.97 2.87 2.86 1.87 1.87 1.87 1.86 1.73 1.72 1.62 1.61 1.57 1.56 1.56 1.56 1.53 1.47 1.27 1.27 1.27 1.27 1.14 1.14 1.12 1.11 1.11 1.11 1.05 1.05 1.05 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:y P:y P:y P:y P:x P:x P:x P:x P:z P:z P:z P:z P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:y P:y P:y P:y P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">46 52 90 72 59 83 98 36 25 60 91 75 33 77 66 99 22 21 78 88 42 68 43 54 52 46 81 56 35 97 72 90 95 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.067</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">509</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">2.96 2.92 2.46 2.46 2.45 2.44 2.27 2.24 2.15 2.14 2.13 2.11 1.99 1.98 1.90 1.88 1.72 1.71 1.54 1.52 1.45 1.44 1.36 1.36 1.24 1.24 1.21 1.20 1.16 1.16 1.06 1.06 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:z P:z P:x P:y P:y P:x P:z P:z P:y P:y P:x P:x P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:y P:y P:y P:y P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">70 47 69 66 33 44 63 58 99 77 89 84 42 68 65 32 78 88 53 80 98 36 66 33 83 59 54 43 77 99 41 45 82 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.060</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">510</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.91 4.82 4.77 4.67 2.56 2.52 2.39 2.36 1.92 1.90 1.53 1.52 1.33 1.31 1.18 1.17 1.16 1.15 1.12 1.11 1.11 1.11 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">70 47 63 58 53 80 65 32 89 84 69 44 99 77 89 78 84 88 69 59 83 44 56 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.045</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">511</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">3.63 3.43 2.93 2.80 2.63 2.59 2.58 2.56 1.93 1.85 1.82 1.80 1.79 1.78 1.78 1.77 1.76 1.72 1.55 1.52 1.41 1.41 1.40 1.28 1.22 1.06 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">63 58 70 47 55 50 71 49 94 87 45 62 57 82 41 29 67 34 24 79 31 39 64 92 48 62 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.032</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">512</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">7.54 6.27 6.19 5.85 2.52 2.51 2.41 2.00 2.00 1.88 1.84 1.79 1.76 1.74 1.73 1.66 1.66 1.64 1.15 1.11 1.08 1.05 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:x P:z P:z P:x P:z P:y P:y P:y P:z P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">30 47 70 37 34 67 93 65 32 32 65 31 63 58 64 86 67 34 31 26 64 68 42</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.030</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">513</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">7.27 6.29 6.16 6.07 2.42 2.37 2.17 2.12 2.06 2.04 2.02 1.89 1.84 1.81 1.68 1.62 1.56 1.56 1.20 1.19 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:z P:y P:y P:y P:x P:x P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">93 58 86 63 87 94 47 80 53 70 37 80 30 53 87 94 48 92 78 88 85</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.025</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">514</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">10.89 5.00 4.93 3.09 2.76 2.13 2.09 1.87 1.85 1.83 1.81 1.59 1.56 1.28 1.24 1.21 1.19 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:z P:z P:z P:z P:z P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">39 73 28 85 26 31 64 92 48 69 44 84 89 35 97 95 51 79 24</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.020</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">515</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="42">3.25 3.23 3.07 3.05 2.36 2.29 2.23 2.22 2.18 2.17 2.15 2.12 1.54 1.50 1.49 1.45 1.44 1.43 1.41 1.40 1.34 1.32 1.30 1.29 1.19 1.19 1.19 1.17 1.16 1.11 1.11 1.11 1.08 1.08 1.07 1.06 1.05 1.04 1.03 1.03 1.02 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="42">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="42">P:y P:y P:y P:y P:y P:y P:x P:y P:x P:x P:y P:x P:x P:x P:x P:x P:x P:x P:y P:y P:x P:x P:y P:y P:x P:y P:y P:x P:z P:y P:y P:z P:x P:y P:x P:y P:y P:y P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="42"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="42">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="42">79 24 29 62 48 92 51 64 95 97 31 35 48 64 92 31 24 79 51 95 62 29 97 35 50 57 82 55 58 99 77 63 58 66 63 33 45 41 70 49 47 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="42">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.962</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">516</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">6.25 4.50 3.74 3.53 3.50 3.30 2.63 1.90 1.64 1.63 1.57 1.56 1.53 1.52 1.45 1.44 1.35 1.33 1.25 1.25 1.19 1.18 1.17 1.15 1.04 1.04 1.03 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:z P:z P:z P:y P:y P:z P:z P:x P:x P:x P:z P:z P:y P:y P:y P:y P:z P:z P:y P:y P:y P:y P:z P:z P:y P:y P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">85 73 28 88 78 86 26 86 84 89 75 91 84 89 74 76 30 37 31 64 50 55 78 88 68 42 93 69 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.953</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">517</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">4.76 4.74 4.44 4.32 4.05 4.03 3.89 2.89 2.83 2.79 2.07 2.05 1.72 1.36 1.36 1.30 1.20 1.16 1.15 1.09 1.08 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:y P:x P:z P:y P:y P:z P:x P:x P:z P:y P:y P:z P:x P:x P:z P:z P:z P:z P:z P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">88 78 86 37 68 42 86 93 37 26 48 92 28 58 63 85 93 68 42 78 44 69 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.938</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">518</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">5.87 5.57 4.49 4.45 4.18 4.01 3.98 3.42 2.80 2.63 2.61 2.53 1.71 1.71 1.53 1.37 1.36 1.05 1.05 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:x P:x P:y P:y P:z P:y P:y P:z P:x P:y P:y P:z P:x P:x P:x P:x P:x P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">37 30 68 42 37 31 64 30 93 92 48 93 70 47 86 36 98 68 64 42 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.918</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">519</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">3.63 3.61 3.14 3.13 3.05 3.02 3.02 2.82 2.16 1.61 1.60 1.59 1.56 1.56 1.52 1.52 1.52 1.52 1.51 1.50 1.48 1.47 1.45 1.37 1.32 1.31 1.31 1.28 1.14 1.11 1.11 1.10 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:z P:z P:y P:y P:y P:y P:x P:x P:x P:y P:y P:y P:x P:y P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:y P:x P:x P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">26 85 50 55 71 49 73 28 93 44 69 89 85 84 62 29 33 66 77 99 79 24 26 30 55 50 93 39 53 49 71 80 65 32</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.901</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">520</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">3.61 3.30 3.30 3.28 3.22 3.22 3.20 3.17 3.09 3.02 2.94 2.91 2.38 2.00 1.72 1.71 1.71 1.70 1.53 1.52 1.52 1.52 1.45 1.39 1.39 1.39 1.32 1.32 1.31 1.30 1.29 1.26 1.16 1.13 1.11 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">P:z P:y P:z P:y P:y P:z P:y P:y P:y P:z P:y P:y P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:y P:x P:x P:y P:z P:y P:z P:z P:y P:z P:z P:z P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">26 55 73 50 49 85 71 89 84 28 69 44 85 26 73 28 77 99 79 24 33 66 53 29 62 80 44 32 69 89 65 84 38 40 96 94</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.881</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">521</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">6.20 6.01 4.01 3.90 3.27 3.24 2.64 2.57 2.42 2.40 1.98 1.93 1.70 1.69 1.54 1.53 1.51 1.49 1.19 1.17 1.17 1.17 1.14 1.12 1.12 1.04 1.02 1.02 1.02 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:x P:x P:x P:x P:x P:x P:y P:y P:x P:x P:y P:y P:y P:y P:y P:x P:x P:y P:y P:z P:y P:z P:y P:y P:y P:y P:x P:x P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">70 47 52 46 63 58 62 29 90 72 66 33 24 79 67 45 41 34 99 68 77 42 39 71 49 65 71 82 32 49 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.875</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">522</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">7.41 7.16 4.57 4.40 2.84 2.79 2.74 2.73 2.35 2.31 2.06 1.97 1.82 1.74 1.59 1.56 1.53 1.50 1.37 1.35 1.32 1.28 1.20 1.18</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:x P:x P:x P:y P:y P:x P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">63 58 70 47 90 94 87 72 53 80 67 34 65 32 99 24 77 79 50 55 52 46 84 89</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.859</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">523</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">5.95 5.55 3.54 3.50 2.86 2.77 2.68 2.46 2.43 2.02 2.01 1.98 1.97 1.91 1.82 1.81 1.72 1.65 1.62 1.51 1.44 1.37 1.34 1.25 1.20 1.13 1.12 1.08 1.05 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:x P:x P:z P:z P:x P:x P:z P:x P:z P:x P:x P:x P:x P:x P:z P:y P:z P:z P:y P:y P:y P:z P:x P:y P:x P:x P:y P:y P:x P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">47 70 40 39 46 52 37 26 38 37 63 34 58 67 96 34 28 86 67 29 62 73 85 32 72 90 65 33 32 66 65</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.855</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">524</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">4.54 4.35 4.32 4.10 4.01 3.59 3.38 3.37 3.33 3.12 2.86 2.57 2.26 2.23 2.22 2.20 2.16 1.96 1.94 1.69 1.57 1.29 1.27 1.17 1.16 1.16 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:x P:y P:z P:z P:y P:x P:z P:z P:x P:x P:x P:z P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">65 32 67 34 38 53 80 94 40 87 23 70 47 63 96 71 49 39 58 55 50 41 45 46 44 69 52</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.848</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">525</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">5.51 5.08 3.49 3.42 2.80 2.79 2.38 2.14 2.09 2.05 1.96 1.96 1.83 1.80 1.73 1.66 1.65 1.62 1.62 1.60 1.56 1.52 1.46 1.42 1.38 1.36 1.35 1.33 1.32 1.31 1.28 1.25 1.12 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:x P:x P:x P:x P:x P:y P:y P:y P:x P:x P:x P:x P:y P:x P:z P:x P:y P:x P:x P:x P:y P:z P:x P:y P:x P:x P:x P:x P:x P:x P:y P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">47 70 58 63 30 34 67 32 34 32 67 65 65 85 96 62 49 86 29 37 71 39 72 44 90 87 94 66 33 28 69 86 49 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.847</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">526</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">5.59 5.56 3.40 2.97 2.91 2.82 2.45 2.40 2.36 2.32 2.32 2.28 2.06 2.03 2.02 1.97 1.88 1.86 1.85 1.85 1.41 1.37 1.36 1.32 1.30 1.24 1.18 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:x P:x P:x P:y P:z P:y P:y P:y P:y P:x P:y P:x P:x P:x P:y P:y P:z P:x P:z P:x P:x P:x P:z P:x P:x P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">58 63 93 94 39 87 53 55 50 53 80 80 94 87 84 89 28 79 73 24 73 77 55 99 86 50 85 26 89</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.842</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">527</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">4.40 3.84 3.58 3.13 3.12 3.04 2.64 2.59 2.51 2.26 2.25 2.23 1.88 1.86 1.86 1.82 1.79 1.61 1.52 1.48 1.40 1.33 1.32 1.30 1.22 1.12 1.12 1.11 1.11 1.10 1.09 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:y P:y P:x P:y P:y P:z P:x P:z P:x P:z P:x P:x P:x P:z P:x P:z P:x P:x P:z P:x P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">96 23 87 80 40 94 53 38 90 72 67 34 46 65 32 50 52 55 82 84 57 58 83 89 59 49 35 97 71 51 95 41 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.815</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">528</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">7.87 5.27 2.95 2.52 2.47 2.45 2.44 1.90 1.89 1.62 1.62 1.53 1.53 1.52 1.52 1.51 1.51 1.39 1.39 1.37 1.35 1.29 1.28 1.28 1.26 1.26 1.25 1.17 1.12 1.06 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">P:z P:z P:z P:y P:y P:x P:x P:x P:x P:x P:x P:x P:z P:x P:z P:x P:x P:y P:x P:z P:y P:z P:x P:x P:z P:z P:z P:z P:z P:y P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">30 37 86 64 31 97 35 54 43 66 33 36 68 98 42 44 69 42 40 28 68 40 62 29 64 38 31 26 96 78 39 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.805</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">529</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.59 4.57 3.99 2.88 2.87 2.39 2.38 2.05 2.05 1.86 1.86 1.68 1.67 1.66 1.64 1.64 1.61 1.56 1.48 1.48 1.42 1.39 1.31 1.29 1.12 1.09 1.08 1.07 1.04 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:x P:x P:z P:x P:y P:y P:x P:y P:z P:z P:y P:y P:y P:y P:y P:y P:z P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">25 60 39 91 75 41 45 27 61 98 36 36 35 51 98 97 34 67 95 22 41 45 82 57 94 76 74 87 59 83 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.804</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">530</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">10.50 5.01 3.82 3.73 3.49 3.27 3.20 3.13 2.04 2.03 1.96 1.92 1.90 1.86 1.71 1.68 1.31 1.31 1.30 1.23 1.22 1.19 1.15 1.15 1.13 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:y P:y P:z P:x P:z P:x P:x P:x P:z P:y P:z P:y P:z P:z P:x P:x P:z P:x P:x P:x P:z P:y P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">93 86 48 92 30 95 39 51 81 56 92 31 48 64 78 88 78 88 23 77 96 99 96 78 88 73</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.793</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">531</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">4.39 4.38 3.63 3.62 3.57 3.56 2.96 2.94 2.87 2.87 2.82 2.82 2.80 2.80 2.31 2.30 1.61 1.57 1.57 1.53 1.44 1.34 1.32 1.09 1.08 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:z P:z P:y P:y P:y P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">75 91 82 57 76 74 83 59 41 45 27 61 25 60 98 36 59 83 57 82 21 87 94 36 98 41 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.768</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">532</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.57 3.40 2.87 2.79 2.53 2.37 2.30 2.30 2.24 2.23 2.20 1.82 1.78 1.59 1.53 1.48 1.47 1.47 1.46 1.28 1.11 1.10 1.07 1.06 1.05 1.05 1.04 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:z P:z P:z P:z P:z P:z P:y P:y P:z P:y P:y P:y P:y P:z P:z P:y P:y P:y P:y P:z P:y P:y P:y P:y P:y P:z P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">70 47 37 30 93 63 42 68 58 64 31 48 92 26 86 71 88 49 78 28 67 62 29 34 69 73 66 44 33</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.767</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">533</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">9.53 3.03 2.88 2.68 2.68 2.23 2.16 2.06 2.02 1.96 1.93 1.92 1.84 1.81 1.76 1.70 1.64 1.54 1.53 1.48 1.43 1.30 1.29 1.27 1.23 1.20 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:y P:z P:z P:z P:z P:y P:y P:x P:x P:y P:y P:y P:x P:y P:x P:y P:y P:x P:x P:y P:y P:x P:y P:x P:y P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">39 25 60 91 75 74 76 71 49 82 61 57 55 27 50 41 45 69 44 83 59 89 36 84 98 47 58 70</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.762</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">534</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">3.36 2.84 2.82 2.42 2.18 2.14 1.81 1.79 1.78 1.78 1.74 1.70 1.69 1.58 1.56 1.53 1.40 1.38 1.28 1.26 1.20 1.19 1.17 1.16 1.13 1.09 1.08 1.08 1.07 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:z P:y P:y P:z P:z P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">86 58 63 37 88 78 76 70 74 47 73 61 27 78 88 85 42 68 93 39 68 42 83 59 26 77 99 95 51 48 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.743</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">535</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">3.89 3.86 3.53 3.39 3.39 3.36 3.09 3.05 3.05 2.84 2.76 2.74 2.68 2.59 2.43 2.38 2.38 2.34 1.58 1.56 1.50 1.47 1.37 1.36 1.25 1.24 1.23 1.21 1.19 1.17 1.10 1.09 1.09 1.06 1.05 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">P:z P:z P:z P:z P:y P:y P:y P:x P:x P:y P:x P:y P:x P:y P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x P:z P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">60 25 91 75 25 60 22 44 69 91 89 75 84 21 55 49 71 50 70 47 63 58 69 44 76 89 74 84 31 64 55 71 49 50 27 61</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.730</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">536</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">9.97 9.95 9.89 9.89 2.33 2.31 2.28 2.25 2.22 2.21 2.11 2.10 1.71 1.49 1.13 1.13 1.08 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:z P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">76 27 74 61 31 92 64 48 78 88 42 68 73 28 42 68 78 88 26</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.724</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">537</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">7.33 7.02 3.31 3.30 3.20 3.18 2.84 2.66 1.82 1.74 1.69 1.66 1.60 1.53 1.52 1.52 1.32 1.30 1.28 1.28 1.26 1.25 1.20 1.19 1.15 1.13 1.08 1.06 1.05 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:z P:z P:x P:z P:x P:z P:x P:x P:z P:y P:z P:z P:z P:y P:z P:z P:x P:x P:z P:z P:x P:x P:z P:x P:x P:z P:x P:y P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">25 60 49 91 71 75 44 69 30 25 38 49 71 60 74 76 55 50 61 27 64 89 44 84 31 69 97 32 64 65</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.719</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">538</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">12.63 4.01 3.97 3.60 3.51 3.41 3.11 3.07 3.05 2.61 2.47 2.41 2.23 2.03 2.02 1.96 1.95 1.75 1.74 1.73 1.45 1.39 1.37 1.36 1.26 1.20 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:y P:x P:x P:x P:y P:x P:y P:y P:y P:x P:x P:y P:y P:x P:z P:z P:x P:x P:x P:z P:x P:z P:y P:y P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">39 51 95 35 21 97 91 75 22 48 92 60 25 31 75 91 64 84 89 60 69 25 95 51 44 35 97</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.712</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">539</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">8.47 8.26 4.63 4.60 3.82 3.72 2.98 2.86 2.54 2.34 2.33 2.07 2.01 1.81 1.76 1.75 1.73 1.71 1.57 1.41 1.36 1.17 1.13 1.07 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:z P:z P:x P:x P:x P:x P:z P:x P:x P:y P:y P:z P:z P:x P:x P:z P:z P:y P:y P:z P:z P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">75 91 25 60 50 55 84 89 23 49 71 75 91 93 50 44 69 55 38 25 60 84 89 23 80 53</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.701</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">540</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">6.23 4.74 4.70 4.18 4.09 2.69 2.69 2.28 2.23 1.78 1.78 1.65 1.63 1.53 1.52 1.40 1.39 1.38 1.37 1.29 1.26 1.23 1.22 1.16 1.14 1.11 1.11 1.10 1.08 1.02 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:z P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:x P:x P:y P:y P:x P:x P:y P:y P:x P:x P:z P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">39 27 61 76 74 31 64 92 48 55 50 73 28 91 75 71 49 91 75 42 68 60 25 78 88 31 64 60 25 99 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.679</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">541</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">40.56 5.35 5.33 3.22 3.19 2.42 2.30 2.28 2.28 2.24 1.87 1.86 1.86 1.86 1.72 1.72 1.40 1.39 1.29 1.29 1.18 1.15</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:y P:x P:x P:y P:y P:y P:z P:x P:x P:z P:y P:y P:y P:y P:z P:z P:x P:x P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">22 54 43 60 25 40 60 98 36 25 54 36 98 43 46 52 68 42 27 61 71 49</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.675</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">542</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">38.28 5.19 5.17 3.28 3.26 2.84 2.73 2.42 2.12 2.09 2.06 2.04 1.86 1.85 1.63 1.62 1.42 1.41 1.31 1.27 1.27 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:x P:x P:y P:y P:z P:z P:y P:x P:x P:z P:z P:y P:y P:y P:y P:y P:y P:x P:y P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">21 56 81 75 91 75 91 96 59 83 72 90 81 56 59 83 76 74 50 23 55 78 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.658</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">543</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">8.72 8.60 4.24 4.20 3.33 3.32 3.30 3.26 3.16 3.00 2.97 2.87 2.82 1.94 1.69 1.58 1.56 1.35 1.34 1.25 1.22 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:z P:x P:x P:x P:z P:z P:x P:y P:z P:z P:z P:z P:y P:y P:x P:x P:z P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">61 27 68 42 64 60 25 31 22 52 46 74 76 38 21 88 78 68 42 75 91 72 90</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.656</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">544</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">8.11 8.01 5.02 4.41 4.40 3.64 3.59 2.94 2.92 2.91 2.87 2.38 2.36 1.58 1.55 1.45 1.45 1.43 1.40 1.39 1.12 1.08 1.07 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z P:y P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:x P:x P:z P:y P:z P:x P:x P:y P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">74 76 21 88 78 48 92 75 61 91 27 72 90 64 31 88 23 78 42 68 22 56 81 48 92</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.528</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">545</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.34 3.33 3.18 3.16 2.74 2.71 2.63 2.62 2.02 1.99 1.83 1.82 1.82 1.82 1.78 1.78 1.74 1.74 1.54 1.53 1.19 1.17 1.14 1.14 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:y P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y P:z P:z P:y P:y P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">35 97 43 54 97 35 27 61 54 43 70 98 47 36 66 33 62 29 45 41 51 95 56 81 95 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.526</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">546</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">3.41 3.36 3.06 3.05 2.67 2.66 2.59 2.59 2.06 2.03 1.87 1.87 1.82 1.82 1.79 1.78 1.70 1.70 1.58 1.56 1.30 1.30 1.15 1.15 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:y P:y P:y P:y P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y P:z P:z P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">51 95 56 81 95 51 76 74 81 56 83 59 63 58 77 99 79 24 57 82 35 97 43 54 27</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.476</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">547</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="35">2.85 2.71 2.66 2.65 2.64 2.63 2.59 2.53 2.51 2.48 2.46 2.45 2.43 2.41 2.40 2.40 2.21 2.14 2.05 2.04 1.75 1.73 1.70 1.66 1.66 1.61 1.60 1.58 1.57 1.45 1.43 1.42 1.08 1.07 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="35">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="35">P:x P:x P:z P:x P:z P:x P:x P:z P:x P:z P:z P:z P:x P:z P:z P:x P:z P:z P:z P:z P:x P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="35"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="35">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="35">53 94 79 80 24 32 65 77 87 99 62 29 34 66 33 67 94 87 34 67 79 53 80 32 65 62 24 29 77 66 33 99 73 85 93</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="35">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.457</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">548</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">6.26 6.01 5.60 5.35 5.14 4.97 4.89 4.80 4.78 4.77 4.72 4.71 4.37 4.30 3.28 3.23</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:x P:x P:x P:x P:x P:x P:x P:y P:y P:y P:y P:x P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">34 67 32 65 66 33 62 41 45 36 98 29 54 43 97 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.455</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">549</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">6.31 5.88 5.57 5.27 5.17 5.01 4.96 4.81 4.78 4.67 4.67 4.63 4.41 4.35 3.34 3.32</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:x P:x P:x P:x P:x P:x P:x P:y P:y P:y P:x P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">94 87 53 77 80 79 99 82 57 59 24 83 81 56 95 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.450</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">550</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="41">2.62 2.51 2.49 2.48 2.48 2.48 2.32 2.27 2.25 2.24 2.21 2.20 2.18 2.10 2.09 2.07 2.03 2.00 1.98 1.88 1.87 1.84 1.83 1.81 1.78 1.77 1.69 1.67 1.63 1.59 1.51 1.50 1.46 1.46 1.45 1.44 1.43 1.41 1.33 1.28 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="41">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="41">P:z P:x P:x P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:x P:x P:x P:x P:z P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:z P:x P:x P:x P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="41"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="41">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="41">39 87 80 29 24 62 79 65 26 32 67 85 34 33 66 99 87 67 34 77 24 30 53 94 94 93 29 62 37 99 28 86 73 65 32 80 33 66 79 53 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="41">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.408</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">551</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">4.45 4.31 4.06 3.54 2.99 2.98 2.91 2.91 2.90 2.85 2.79 2.79 2.79 2.75 2.75 2.32 1.92 1.80 1.79 1.76 1.76 1.75 1.74 1.74 1.63 1.62 1.47 1.45 1.36 1.33 1.33 1.30 1.29 1.23 1.18 1.16 1.03 1.02 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">P:x P:x P:x P:x P:z P:z P:x P:z P:z P:x P:z P:z P:x P:z P:z P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:z P:x P:x P:y P:y P:z P:z P:z P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">30 37 26 28 97 35 93 36 98 86 54 43 85 41 45 73 37 59 83 95 30 81 51 56 57 82 35 97 26 61 27 43 54 28 86 93 98 36 45 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.402</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">552</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">3.60 3.57 3.55 3.54 3.10 3.09 2.97 2.96 2.86 2.84 2.67 2.66 2.28 2.27 2.10 2.03 1.99 1.99 1.79 1.79 1.76 1.75 1.63 1.63 1.63 1.55 1.54 1.48 1.46 1.38 1.25 1.24 1.11 1.09 1.09 1.06 1.06 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:x P:z P:x P:z P:z P:z P:x P:x P:z P:z P:z P:z P:z P:z P:x P:x P:z P:z P:z P:z P:z P:x P:z P:z P:x P:y P:y P:y P:y P:z P:y P:y P:z P:z P:z P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">93 95 86 51 57 82 73 85 59 83 81 56 97 35 30 37 45 41 36 98 86 28 54 43 26 51 95 56 81 93 83 59 73 85 37 74 76 39</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.327</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">553</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">10.71 10.61 10.61 10.38 10.33 9.59 7.29 6.99 1.62 1.60</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">P:x P:y P:y P:y P:y P:x P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">28 25 60 61 27 26 30 37 25 60</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.324</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">554</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">10.62 10.58 10.56 10.50 10.43 9.53 7.39 7.06 1.58 1.52</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">P:y P:x P:y P:y P:y P:x P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">91 73 75 76 74 85 93 86 91 75</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.280</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">555</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">8.66 8.58 7.42 7.39 4.50 4.50 4.27 4.24 3.92 3.92 3.88 3.87 3.63 3.62 3.61 3.59 1.68 1.61 1.54 1.53 1.36 1.28 1.15 1.14 1.08 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">27 61 60 25 66 33 61 27 32 65 29 62 34 67 25 60 26 28 65 32 37 30 33 66 29 62</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.279</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">556</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">8.64 8.50 7.52 7.39 4.50 4.49 4.24 4.18 3.93 3.91 3.90 3.90 3.66 3.63 3.63 3.62 1.70 1.60 1.52 1.52 1.36 1.26 1.15 1.14 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">74 76 75 91 99 77 76 74 79 53 80 24 87 91 94 75 85 73 53 80 86 93 99 77 79 24</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.147</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">557</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">3.67 3.66 3.42 3.42 3.42 3.41 3.40 3.38 3.04 3.03 2.94 2.92 2.85 2.85 2.71 2.71 2.46 2.46 2.29 2.28 2.17 2.17 2.16 2.15 1.92 1.92 1.89 1.89 1.63 1.63 1.59 1.58</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">P:z P:z P:x P:z P:x P:z P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">29 62 29 33 62 66 43 54 33 66 35 97 32 65 34 67 34 67 36 98 97 35 41 45 54 43 65 32 45 41 98 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.145</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">558</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">3.63 3.61 3.41 3.40 3.35 3.33 3.31 3.29 2.99 2.99 2.93 2.91 2.87 2.84 2.77 2.77 2.47 2.46 2.29 2.28 2.22 2.21 2.17 2.14 1.93 1.93 1.92 1.91 1.71 1.70 1.63 1.61</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">P:z P:z P:z P:z P:x P:x P:y P:y P:x P:x P:x P:x P:y P:y P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">24 79 99 77 24 79 56 81 99 77 80 53 51 95 87 94 87 94 59 83 95 51 57 82 81 80 53 56 82 57 83 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.000</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">559</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">12.12 12.08 8.13 7.86 6.73 6.11 5.80 5.78 1.76 1.76 1.42 1.18 1.17 1.12 1.12 1.03 1.03 1.02 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:x P:x P:x P:x P:y P:y P:z P:z P:z P:x P:x P:x P:x P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">61 27 37 30 28 26 60 25 25 60 37 65 32 62 29 62 29 66 33 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-5.999</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">560</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">11.94 11.93 8.03 7.73 6.85 6.26 5.92 5.91 1.78 1.76 1.39 1.19 1.18 1.13 1.12 1.04 1.04 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:y P:y P:x P:x P:x P:x P:y P:y P:z P:z P:z P:x P:x P:x P:x P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">74 76 86 93 73 85 75 91 91 75 86 53 80 79 24 79 24 99 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.986</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">561</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">27.98 26.81 1.95 1.93 1.88 1.87 1.78 1.74 1.70 1.67 1.26 1.23 1.19 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">D:xy D:xy P:x P:x P:x P:x P:z P:z P:z P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">101 103 45 41 82 57 35 97 51 95 35 97 51 95</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">Tc Tc O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.938</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">562</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">48.17 3.59 3.56 3.31 2.82 2.79 2.45 2.45 2.41 1.61 1.61 1.61 1.60 1.53 1.40 1.26 1.24</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">D:xz P:x P:x D:z2 P:x P:x D:xz P:z P:z P:x P:y P:y P:x P:z D:xz P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 3.846 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.00 1.33 1.33 1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">102 56 81 102 83 59 100 56 81 88 83 59 78 21 102 84 89</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">Tc O O Tc O O Tc O O O O O O O Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.937</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">563</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">48.98 3.26 3.24 2.95 2.80 2.78 2.75 2.74 2.66 1.72 1.69 1.56 1.55 1.51 1.51 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 2 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">D:xz P:x P:x D:xz P:z P:z P:x P:x D:z2 D:xz P:z P:x P:x P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-6.613 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 3.846 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">100 43 54 102 43 54 98 36 100 100 22 42 68 98 36 69 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">Tc O O Tc O O O O Tc Tc O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.915</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">564</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">22.26 20.70 3.62 3.43 1.86 1.54 1.52 1.49 1.46 1.44 1.43 1.42 1.42 1.40 1.38 1.38 1.36 1.36 1.34 1.32 1.30 1.30 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:xz D:xz D:z2 D:z2 D:xz P:z P:z P:x P:x P:x P:z P:z P:x P:y P:y P:x P:x P:x P:x P:y D:x2-y2 P:y D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">101 103 101 103 100 97 35 41 45 97 95 51 35 41 45 95 51 57 82 57 103 82 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">Tc Tc Tc Tc Tc O O O O O O O O O O O O O O O Tc O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.765</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">565</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">11.87 8.92 6.54 6.34 5.20 4.87 3.13 2.53 1.54 1.45 1.44 1.32 1.31 1.19 1.19 1.16 1.10 1.09 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">D:z2 D:z2 D:z2 D:x2-y2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:z P:z P:y P:y P:y P:y P:x P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">101 103 100 101 102 103 100 102 26 41 45 45 41 35 97 85 57 82 82 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">Tc Tc Tc Tc Tc Tc Tc Tc O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.758</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">566</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">11.62 8.93 7.35 5.41 5.38 3.98 3.44 2.45 1.43 1.41 1.40 1.23 1.23 1.21 1.20 1.10 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:z2 D:z2 D:z2 D:x2-y2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:z P:z P:y P:y P:y P:y P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">103 101 102 103 100 101 102 100 85 57 82 51 95 82 57 26 41 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">Tc Tc Tc Tc Tc Tc Tc Tc O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.668</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">567</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">52.68 17.29 2.14 2.13 2.09 2.08 2.08 2.08 1.89 1.19 1.18 1.18 1.18</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 2 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">D:xy P:y P:x P:x P:x P:z P:x P:z D:xy P:x P:z P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 3.846 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">100 22 36 98 54 54 43 43 100 68 98 36 42</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">Tc O O O O O O O Tc O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.662</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">568</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">52.58 17.33 2.12 2.12 2.10 2.08 2.04 2.03 1.94 1.21 1.21 1.19 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 2 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">D:xy P:y P:x P:x P:x P:x P:z P:z D:xy P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 3.846 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">102 21 81 59 56 83 81 56 102 83 59 78 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">Tc O O O O O O O Tc O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.549</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">569</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">13.54 7.66 7.12 5.69 4.01 3.98 3.29 2.39 1.86 1.85 1.69 1.59 1.58 1.44 1.43 1.41 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:z2 D:z2 D:z2 D:x2-y2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y P:x P:z P:z P:y P:y P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">100 102 101 100 103 101 102 103 43 54 28 36 98 98 36 37 56 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">Tc Tc Tc Tc Tc Tc Tc Tc O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.545</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">570</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">12.89 8.04 7.34 5.74 4.53 3.50 3.18 1.95 1.78 1.78 1.60 1.50 1.48 1.39 1.38 1.37 1.07 1.06 1.05 1.05 1.04 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:z2 D:z2 D:z2 D:x2-y2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y P:x P:z P:z P:y P:y P:x P:z P:z P:y P:y P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">102 103 100 102 101 103 100 101 56 81 73 59 83 83 59 86 57 82 51 95 85 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">Tc Tc Tc Tc Tc Tc Tc Tc O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.405</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">571</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">24.99 24.21 7.36 5.86 5.60 1.50 1.21 1.21 1.17 1.17 1.03 1.01 1.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 2 2 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">D:xz D:xz P:z D:x2-y2 D:x2-y2 S P:x P:x P:x P:x D:xz D:xz P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -6.613 -6.613 -24.020 -9.089 -9.089 -9.089 -9.089 3.846 3.846 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">1.00 1.00 1.33 1.00 1.00 2.00 1.33 1.33 1.33 1.33 0.00 0.00 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">103 101 39 101 103 39 82 57 45 41 103 101 95 35 97</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">Tc Tc O Tc Tc O O O O O Tc Tc O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-4.022</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">572</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="7">26.54 25.39 25.29 1.15 1.14 1.10 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="7">1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="7">D:xy D:xy P:y P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="7"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="7">1.00 1.00 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="7">103 101 39 51 95 35 97</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="7">Tc Tc O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.604</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">573</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="7">17.19 16.69 16.24 8.43 8.32 2.86 2.52</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="7">1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="7">P:z D:x2-y2 D:x2-y2 D:z2 D:z2 D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="7"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="7">1.33 1.00 1.00 1.00 1.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="7">39 101 103 101 103 103 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="7">O Tc Tc Tc Tc Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.173</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">574</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">4.97 4.96 4.95 4.94 3.47 3.46 3.42 3.41 2.12 2.10 1.87 1.85 1.62 1.62 1.60 1.60 1.49 1.48 1.23 1.23 1.08 1.08 1.04 1.04 1.03 1.03 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xz D:xz D:xz D:xz P:y P:y P:y P:y D:z2 D:z2 D:z2 D:z2 P:y P:y D:yz D:z2 D:yz D:z2 P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">18 5 15 2 3 16 4 17 2 15 5 18 98 36 45 41 5 18 2 15 35 97 4 17 17 4 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W W W W W W W O O O O W W W W O O W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.169</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">575</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">4.94 4.91 4.90 4.87 3.49 3.48 3.48 3.48 2.09 2.06 1.90 1.87 1.63 1.62 1.60 1.59 1.49 1.48 1.22 1.21 1.11 1.11 1.07 1.07 1.05 1.05 1.01 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xz D:xz D:xz D:xz P:y P:y P:y P:y D:z2 D:z2 D:z2 D:z2 P:y P:y D:yz D:z2 D:z2 D:yz D:z2 P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">12 7 20 10 9 8 19 13 10 20 7 12 83 59 82 57 7 12 10 20 51 95 8 13 8 13 19 56 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W W W W W W W W W W W O O O O W W W W O O W W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.929</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">576</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">11.78 11.66 4.54 4.49 2.74 2.73 2.59 2.57 2.08 2.07 1.86 1.84 1.53 1.53 1.45 1.44 1.17 1.17 1.12 1.11 1.11 1.10 1.10 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:z2 D:z2 D:x2-y2 D:x2-y2 P:y P:y P:y P:y D:xy D:xy D:xy D:xy D:xy D:xy P:z P:z D:xy D:xy P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">14 1 14 1 61 27 60 25 18 5 15 2 17 4 25 60 16 3 45 41 98 36 54 43</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">W W W W O O O O W W W W W W O O W W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.926</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">577</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">11.98 11.49 4.61 4.42 2.80 2.72 2.57 2.54 2.07 2.03 1.84 1.79 1.57 1.54 1.46 1.41 1.20 1.17 1.12 1.11 1.10 1.10 1.10 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:z2 D:z2 D:x2-y2 D:x2-y2 P:y P:y P:y P:y D:xy D:xy D:xy D:xy D:xy D:xy P:z P:z D:xy D:xy P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">6 11 6 11 74 76 91 75 7 12 10 20 8 13 91 75 9 19 57 59 56 82 83 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">W W W W O O O O W W W W W W O O W W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.905</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">578</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">9.85 9.00 4.02 3.89 3.83 3.66 3.10 3.09 2.93 2.85 2.69 1.77 1.72 1.70 1.61 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 P:x P:x D:x2-y2 P:x D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -9.089 -9.089 -6.613 -9.089 -4.498 -4.498 -4.498 -4.498 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.00 1.00 0.80 0.80 0.80 0.80 1.00 1.33 1.33 1.00 1.33 0.80 0.80 0.80 0.80 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">100 102 11 1 14 6 103 22 21 101 39 11 1 14 6 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">Tc Tc W W W W Tc O O Tc O W W W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.836</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">579</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="37">5.02 4.99 4.70 4.68 3.99 3.98 3.53 3.52 1.63 1.62 1.58 1.56 1.44 1.43 1.43 1.43 1.42 1.42 1.41 1.41 1.41 1.40 1.40 1.40 1.39 1.38 1.27 1.27 1.18 1.18 1.16 1.15 1.11 1.11 1.11 1.10 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="37">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="37">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy P:y P:y D:yz D:yz D:z2 D:z2 P:z P:z P:y D:yz P:y P:z P:z D:xz D:yz D:xz D:z2 D:z2 P:z P:z P:z P:z P:z P:z D:xz P:z P:z D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="37"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="37">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="37">3 16 4 17 15 2 18 5 35 97 4 17 16 3 41 45 43 3 54 36 98 2 16 15 17 4 33 66 29 62 97 35 5 54 43 18 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="37">W W W W W W W W O O W W W W O O O W O O O W W W W W O O O O O O W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.834</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">580</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">4.94 4.93 4.63 4.62 4.06 4.03 3.60 3.58 1.62 1.61 1.57 1.55 1.45 1.45 1.44 1.43 1.43 1.42 1.42 1.41 1.41 1.38 1.38 1.38 1.38 1.36 1.26 1.26 1.17 1.16 1.15 1.13 1.13 1.12 1.11 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy P:y P:y D:yz D:yz P:z D:z2 P:z D:xz P:z P:z D:z2 D:xz D:yz P:y D:z2 D:yz P:y D:z2 P:z P:z P:z P:z P:z D:xz P:z D:xz P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 0.80 1.33 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">9 19 8 13 20 10 12 7 51 95 8 13 57 19 82 10 59 83 9 20 9 56 13 19 81 8 77 99 79 24 95 7 51 12 81 56</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">W W W W W W W W O O W W O W O W O O W W W O W W O W O O O O O W O W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.796</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">581</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">7.97 7.69 5.48 5.43 5.12 5.11 2.30 2.27 2.16 2.16 2.14 2.13 1.32 1.29</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">100 102 11 6 1 14 11 6 1 14 22 21 101 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">Tc Tc W W W W W W W W O O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.600</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">582</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">18.90 10.87 8.94 6.60 6.59 2.57 2.57 1.40 1.05 1.03 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">D:x2-y2 D:z2 P:x D:z2 D:z2 D:x2-y2 D:x2-y2 P:x D:xz S P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -6.613 -5.052 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">1.00 1.00 1.33 0.80 0.80 0.80 0.80 1.33 1.00 2.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">100 100 22 1 14 1 14 40 100 100 66 33</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">Tc Tc O W W W W O Tc Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.585</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">583</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">19.75 10.49 9.80 5.98 5.97 2.35 2.34 2.01 1.47 1.06 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">D:x2-y2 D:z2 P:x D:z2 D:z2 D:x2-y2 D:x2-y2 D:xz P:x S P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -4.498 -4.498 -4.498 -4.498 -6.613 -9.089 -5.052 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">1.00 1.00 1.33 0.80 0.80 0.80 0.80 1.00 1.33 2.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">102 102 21 11 6 11 6 102 96 102 99 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">Tc Tc O W W W W Tc O Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.488</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">584</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">11.73 8.57 3.93 3.92 3.42 3.42 1.89 1.89 1.79 1.79 1.71 1.71 1.61 1.59 1.50 1.50 1.27 1.26 1.16 1.16 1.07 1.06 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:yz D:yz D:xy D:xy D:xy D:xy D:xz D:xz P:y P:y P:y P:y D:xz D:xz P:z P:z P:z P:z D:xy D:xy D:xz D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">101 100 15 2 18 5 3 16 25 60 27 61 17 4 41 45 36 98 4 17 5 18 2 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc W W W W W W O O O O W W O O O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.485</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">585</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">11.81 8.55 3.99 3.97 3.42 3.39 1.90 1.89 1.82 1.80 1.69 1.68 1.60 1.58 1.52 1.52 1.27 1.26 1.14 1.14 1.06 1.06 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:yz D:yz D:xy D:xy D:xy D:xy D:xz D:xz P:y P:y P:y P:y D:xz D:xz P:z P:z P:z P:z D:xy D:xy D:xz D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">103 102 20 10 12 7 19 9 75 91 74 76 13 8 82 57 59 83 8 13 10 7 12 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc W W W W W W O O O O W W O O O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.383</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">586</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">10.14 10.10 5.12 5.10 3.43 3.42 2.76 2.75 1.94 1.94 1.86 1.85 1.83 1.83 1.75 1.75 1.73 1.72 1.64 1.63 1.39 1.38 1.32 1.30 1.24 1.23 1.23 1.22 1.15 1.15 1.14 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:xy D:xy P:x P:x D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 P:y P:y P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:y D:xy D:xy D:yz D:yz D:yz D:z2 D:z2 D:yz D:z2 D:z2 D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">14 1 70 47 2 15 5 18 15 2 69 44 42 68 64 31 18 5 71 49 17 4 3 16 4 16 3 17 17 4 16 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W O O W W W W W W O O O O O O W W O O W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.383</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">587</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">10.18 10.08 5.13 5.10 3.34 3.34 2.83 2.83 1.91 1.90 1.90 1.88 1.82 1.81 1.76 1.76 1.69 1.68 1.68 1.67 1.45 1.44 1.28 1.27 1.25 1.25 1.20 1.20 1.18 1.17 1.10 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:xy D:xy P:x P:x D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:y P:y D:xy D:xy D:yz D:yz D:yz D:yz D:z2 D:z2 D:z2 D:z2 D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">6 11 63 58 10 20 7 12 10 20 88 78 84 89 7 12 48 92 50 55 8 13 9 8 19 13 19 13 8 9 9 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W O O W W W W W W O O O O W W O O O O W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.368</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">588</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">8.58 8.58 4.84 4.83 3.53 3.53 3.33 3.33 2.05 2.04 2.00 1.99 1.89 1.88 1.85 1.85 1.83 1.82 1.54 1.54 1.34 1.32 1.32 1.32 1.26 1.24 1.18 1.18 1.18 1.16 1.16 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:yz D:yz P:z P:z D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y P:y P:y P:y P:y P:y P:y D:z2 D:yz D:z2 D:yz D:xy D:xy D:z2 D:yz D:z2 D:yz D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">14 1 70 47 15 2 5 18 18 5 15 2 69 44 71 49 42 68 64 31 17 4 4 17 4 17 3 3 16 16 14 1</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W O O W W W W W W W W O O O O O O O O W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.367</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">589</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">8.64 8.52 4.85 4.81 3.63 3.63 3.23 3.23 2.07 2.07 1.98 1.98 1.95 1.94 1.80 1.79 1.78 1.78 1.59 1.57 1.32 1.32 1.31 1.28 1.22 1.22 1.22 1.21 1.20 1.20 1.17 1.12 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">D:yz D:yz P:z P:z D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y P:y P:y P:y P:y P:y P:y D:z2 D:yz D:z2 D:yz D:z2 D:yz D:xy D:xy D:z2 D:yz D:z2 D:z2 P:z D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">6 11 63 58 10 20 12 7 10 20 7 12 84 89 50 88 55 78 48 92 13 8 8 13 19 9 13 8 9 19 11 6 89 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">W W O O W W W W W W W W O O O O O O O O W W W W W W W W W W W W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.356</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">590</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">7.34 6.21 5.91 1.97 1.96 1.92 1.92 1.75 1.72 1.69 1.69 1.58 1.58 1.56 1.55 1.37 1.34 1.20 1.19 1.17 1.15 1.11 1.09 1.04 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:x D:x2-y2 D:x2-y2 D:xy D:xy D:xy D:xy D:xz D:xz D:xz D:xz D:xy D:xy D:xy D:xy D:xz D:xz D:z2 D:z2 D:z2 D:z2 P:x P:x P:x P:x D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 1.00 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">39 103 101 8 13 17 4 19 9 16 3 19 9 3 16 103 101 9 19 16 3 93 30 86 37 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O Tc Tc W W W W W W W W W W W W Tc Tc W W W W O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.290</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">591</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">2.53 2.53 2.33 2.31 2.31 2.30 2.11 2.10 1.28 1.22 1.18 1.18 1.17 1.15 1.14 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy P:x P:x P:x P:x P:x D:z2 D:z2 P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">16 3 9 19 17 4 8 13 30 37 26 93 28 5 18 86</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W W W W W O O O O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.253</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">592</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">2.83 2.58 2.44 2.16 2.15 2.14 2.13 2.05 2.04 1.98 1.96 1.90 1.90 1.75 1.71 1.43 1.41 1.34 1.32 1.29 1.28 1.20 1.19 1.18 1.18 1.10 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:x D:x2-y2 D:x2-y2 D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz P:x P:x P:x P:x D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:xy D:z2 D:xy D:z2 D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">39 103 101 10 20 7 12 2 15 5 18 85 73 28 26 10 20 7 12 2 15 20 5 10 18 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O Tc Tc W W W W W W W W O O O O W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.137</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">593</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.39 2.38 2.25 2.25 1.92 1.91 1.82 1.82 1.72 1.63 1.62 1.59 1.58 1.58 1.43 1.43 1.40 1.39 1.34 1.34 1.20 1.20 1.14 1.13 1.11 1.11 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:xy D:xy D:xy D:xy D:xz D:xz D:xz D:xz D:z2 D:xz D:xz D:z2 D:xz D:xz P:x P:x P:x P:x D:xy D:xy D:xy D:xy D:xy D:xy P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 1.00 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">1 14 11 6 2 15 10 20 100 5 18 102 7 12 26 28 73 85 3 16 4 17 9 19 47 70 58 63</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W W W Tc W W Tc W W O O O O W W W W W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.055</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">594</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">4.13 4.11 3.63 3.63 2.70 2.67 2.64 2.62 2.54 2.53 2.47 2.47 2.28 2.28 2.18 2.18 2.04 1.98 1.98 1.98 1.96 1.94 1.67 1.67 1.53 1.53 1.39 1.38 1.05 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:z2 D:z2 D:z2 D:z2 D:yz D:yz D:yz D:yz D:xy D:xy P:y P:y P:y P:y D:xy D:xy D:z2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:z2 P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">18 5 2 15 4 17 3 16 17 4 42 68 64 31 16 3 16 18 3 17 5 4 71 49 15 2 44 69 49 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W W W O O O O W W W W W W W W O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.054</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">595</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">4.21 4.16 3.61 3.56 2.72 2.67 2.63 2.58 2.54 2.51 2.49 2.47 2.28 2.25 2.20 2.17 2.03 2.01 1.99 1.99 1.96 1.94 1.72 1.69 1.53 1.50 1.39 1.36 1.07 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:z2 D:z2 D:z2 D:z2 D:yz D:yz D:yz D:yz D:xy D:xy P:y P:y P:y P:y D:xy D:xy D:x2-y2 D:z2 D:x2-y2 D:z2 D:z2 D:z2 P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">12 7 20 10 8 13 9 19 8 13 88 78 48 92 9 19 12 19 7 13 9 8 50 55 20 10 84 89 55 50</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W W W O O O O W W W W W W W W O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.030</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">596</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="11">7.22 7.17 6.88 6.83 3.00 3.00 2.87 2.87 2.59 1.77 1.75</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="11">1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="11">D:xy D:xy D:xy D:xy P:x P:x P:x P:x P:x D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="11"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="11">0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="11">1 14 6 11 47 70 58 63 39 103 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="11">W W W W O O O O O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.027</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">597</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">5.42 5.41 5.39 5.38 2.18 2.17 2.14 2.14 1.74 1.73 1.49 1.49 1.22 1.22 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">D:xy D:xy D:xy D:xy P:x P:x P:x P:x D:xy D:xy D:xy D:xy D:xy D:xy D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">6 11 1 14 58 63 47 70 5 18 2 15 12 7 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">W W W W O O O O W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.017</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">598</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.69 2.69 2.25 2.24 2.13 2.03 2.02 1.89 1.87 1.86 1.73 1.73 1.57 1.43 1.39 1.28 1.27 1.26 1.24 1.22 1.21 1.12 1.12 1.12 1.10 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">D:xy D:xy D:xy D:xy P:x D:xy D:xy D:xy D:xy D:z2 D:xy D:xy D:z2 P:x D:z2 D:xy D:xy D:yz D:yz D:xy D:xy D:yz D:yz P:x D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -6.613 -9.089 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -6.613 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 1.00 0.80 0.80 1.00 1.33 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.00 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">20 10 19 9 39 2 15 3 16 103 7 12 101 73 102 5 18 6 11 6 11 14 1 28 100 7</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W W W O W W W W Tc W W Tc O Tc W W W W W W W W O Tc W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.014</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">599</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">11.75 11.66 5.40 5.39 3.47 3.42 1.60 1.60 1.37 1.34 1.31 1.27</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">D:yz D:yz P:z P:z D:yz D:yz P:z P:z D:z2 D:z2 D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">1 14 47 70 6 11 63 58 14 1 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">W W O O W W O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.012</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">600</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">9.95 9.87 4.52 4.52 2.50 2.47 2.03 2.03 1.58 1.29 1.28 1.27 1.15 1.08 1.08 1.04 1.03 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:yz D:yz P:z P:z D:xy D:xy D:yz D:yz P:x D:xy P:x D:xy P:x D:xy D:xy D:x2-y2 D:x2-y2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 1.33 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">6 11 63 58 13 8 14 1 39 12 85 7 86 17 4 7 12 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W O O W W W W O W O W O W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.967</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">601</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">3.84 3.84 3.64 3.63 3.23 3.22 2.97 2.95 1.79 1.78 1.65 1.64 1.55 1.54 1.45 1.44 1.43 1.42 1.29 1.28 1.11 1.11 1.10 1.10 1.10 1.09 1.09 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:z2 D:z2 P:y P:y P:z P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">2 15 5 18 16 3 17 4 3 16 20 10 12 7 4 17 19 9 13 8 31 64 49 64 44 31 71 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W W W W W W W W W W W W W W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.963</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">602</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">3.70 3.69 3.42 3.40 3.31 3.29 3.02 3.00 1.96 1.95 1.60 1.59 1.54 1.53 1.49 1.48 1.39 1.38 1.28 1.27 1.20 1.19 1.15 1.14 1.04 1.04 1.03 1.02 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">20 10 12 7 19 9 13 8 9 19 2 15 8 13 5 18 16 3 17 4 48 92 92 48 84 89 78 88 55 50</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W W W W W W W W W W W W W O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.891</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">603</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">3.05 3.02 2.96 2.94 2.92 2.87 2.86 2.81 2.80 2.47 2.26 2.19 2.16 2.13 1.75 1.74 1.72 1.70 1.52 1.48 1.34 1.31 1.12 1.10 1.08 1.07 1.06 1.05 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:xz D:xz D:xz D:xz P:x P:x P:x P:x D:yz D:yz D:xy D:xy D:x2-y2 D:x2-y2 D:xy D:x2-y2 D:x2-y2 D:xy P:x P:x P:x P:x P:x P:x D:xz D:xz D:xz D:xz P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">2 15 5 18 49 71 44 69 101 100 2 15 5 18 5 2 15 18 41 45 36 98 25 60 12 20 7 10 50 55</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W O O O O Tc Tc W W W W W W W W O O O O O O W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.879</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">604</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">3.26 3.24 3.20 3.15 3.05 2.78 2.70 2.63 2.62 2.58 2.52 2.13 2.12 2.03 1.99 1.76 1.68 1.58 1.54 1.49 1.43 1.32 1.26 1.26 1.24 1.24 1.22 1.14 1.13 1.12 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:x D:xz P:x D:xz D:yz D:xy D:xz D:xz P:x P:x D:yz D:x2-y2 D:xy D:xy D:x2-y2 P:x D:x2-y2 D:x2-y2 P:x D:xy P:x D:z2 P:x P:x P:x P:x D:xz D:xy D:xz D:yz P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -4.498 -9.089 -4.498 -6.613 -4.498 -4.498 -4.498 -9.089 -9.089 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -6.613 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 0.80 1.33 0.80 1.00 0.80 0.80 0.80 1.33 1.33 1.00 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.00 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">50 20 84 12 103 20 10 7 55 89 102 12 12 10 7 82 20 10 83 7 57 12 75 44 59 49 2 2 5 101 91</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O W O W Tc W W W O O Tc W W W W O W W O W O W O O O O W W W Tc O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.874</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">605</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">2.77 2.65 2.41 2.26 2.24 2.22 2.02 1.99 1.93 1.70 1.68 1.67 1.66 1.65 1.63 1.61 1.58 1.46 1.43 1.40 1.27 1.23 1.21 1.20 1.19 1.19 1.17 1.13 1.12 1.11 1.09 1.06 1.04 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:z2 D:xy D:xy D:z2 D:z2 D:xy P:x P:x D:xy D:xy P:x P:x D:z2 D:z2 P:x P:x D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:xz D:z2 D:z2 D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">15 18 10 2 7 5 1 18 14 11 7 5 20 71 69 12 6 55 89 15 12 49 44 2 17 4 10 16 3 15 8 13 9 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">W W W W W W W W W W W W W O O W W O O W W O O W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.808</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">606</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="39">2.70 2.50 2.38 2.23 2.20 2.13 2.11 1.91 1.88 1.80 1.71 1.66 1.63 1.63 1.61 1.57 1.57 1.56 1.48 1.43 1.40 1.40 1.39 1.38 1.35 1.33 1.29 1.27 1.25 1.24 1.23 1.17 1.15 1.05 1.04 1.04 1.02 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="39">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="39">P:x D:xy D:xy D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:xy D:xy P:x D:x2-y2 P:x P:x D:xy P:x D:xy D:x2-y2 P:x P:x P:x D:xz P:x D:xz P:x P:x D:xz D:z2 D:z2 D:xz P:x P:x D:z2 D:xz D:z2 D:z2 D:z2 D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="39"
                               units="nonsi:electronvolt">-9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -6.613 -9.089 -9.089 -4.498 -9.089 -4.498 -6.613 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="39">1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.00 1.33 1.33 0.80 1.33 0.80 1.00 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="39">39 10 20 7 12 2 15 18 5 7 12 55 103 89 50 5 84 18 101 71 69 49 10 44 20 57 82 15 10 20 2 45 41 13 7 8 15 2 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="39">O W W W W W W W W W W O Tc O O W O W Tc O O O W O W O O W W W W O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.717</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">607</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">3.07 3.04 2.99 2.97 2.71 2.68 2.09 2.08 2.06 2.03 1.92 1.89 1.86 1.84 1.80 1.80 1.71 1.70 1.58 1.57 1.33 1.30 1.27 1.27 1.24 1.23 1.17 1.16 1.16 1.15 1.10 1.10 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">D:x2-y2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 P:x P:x P:x P:x D:yz D:yz D:z2 D:z2 P:x P:x P:x P:x P:x P:x D:xz D:xz P:x P:x D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">19 9 8 13 13 8 3 16 4 17 9 19 4 17 48 92 78 88 19 9 3 16 81 56 31 64 42 68 9 19 95 51 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">W W W W W W W W W W W W W W O O O O W W W W O O O O O O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.707</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">608</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">3.13 3.12 3.06 3.05 2.84 2.77 2.17 2.13 2.11 2.11 2.07 2.00 1.96 1.90 1.87 1.82 1.77 1.72 1.48 1.45 1.40 1.38 1.34 1.30 1.28 1.25 1.22 1.22 1.20 1.19 1.19 1.15 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">D:x2-y2 D:z2 D:x2-y2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:x2-y2 P:x P:x P:x P:x D:yz D:yz D:z2 D:z2 P:x P:x P:x P:x D:xz P:x D:xz P:x P:x P:x D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">3 4 16 17 4 17 19 13 8 9 3 16 13 8 31 64 42 68 3 16 19 9 43 54 92 48 3 78 16 88 35 97 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">W W W W W W W W W W W W W W O O O O W W W W O O O O W O W O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.697</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">609</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">2.32 2.25 1.99 1.96 1.96 1.95 1.85 1.81 1.81 1.80 1.79 1.76 1.67 1.66 1.66 1.65 1.44 1.44 1.37 1.36 1.33 1.33 1.27 1.26 1.22 1.21 1.16 1.10 1.07 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">D:z2 D:z2 D:x2-y2 D:xy D:x2-y2 D:xy D:x2-y2 D:yz D:z2 D:x2-y2 D:yz D:z2 D:xy D:xy D:xy D:xy D:xy D:xy P:x D:yz D:yz P:x D:x2-y2 P:x P:x D:x2-y2 D:x2-y2 D:x2-y2 P:x D:z2 P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">9 19 8 10 13 20 9 8 16 19 13 3 2 13 15 8 4 17 48 17 4 92 17 88 78 4 16 3 51 8 95</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">W W W W W W W W W W W W W W W W W W O W W O W O O W W W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.680</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">610</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">3.12 3.11 2.72 2.70 2.66 2.64 1.86 1.82 1.69 1.68 1.62 1.61 1.39 1.39 1.30 1.30 1.23 1.21 1.12 1.10 1.10 1.09 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:xy D:xy D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:yz D:yz D:xy D:xy D:z2 D:z2 D:yz D:yz D:x2-y2 D:z2 D:z2 D:x2-y2 P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">5 18 3 16 17 4 2 15 12 7 16 3 9 19 13 8 18 5 16 10 20 3 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">W W W W W W W W W W W W W W W W W W W W W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.677</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">611</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">2.75 2.74 2.28 2.28 2.24 2.24 1.79 1.77 1.70 1.69 1.60 1.57 1.35 1.35 1.34 1.34 1.32 1.30 1.26 1.25 1.18 1.16 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:xy D:xy D:xy D:xy D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:yz D:xy D:xy D:yz D:z2 D:z2 D:xy D:xy D:xy D:xy D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">12 7 9 19 8 13 5 18 10 20 2 15 9 15 2 19 5 18 3 16 4 17 12 7</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.670</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">612</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">2.13 2.11 2.10 2.07 2.04 2.03 2.03 2.03 1.80 1.78 1.77 1.77 1.49 1.48 1.48 1.46 1.25 1.24 1.24 1.23 1.23 1.23 1.23 1.22 1.22 1.22 1.17 1.16 1.10 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:xy D:xy D:x2-y2 D:x2-y2 D:z2 D:z2 D:xy D:xy D:x2-y2 D:z2 D:z2 D:x2-y2 D:yz D:yz D:yz D:yz D:xy D:xy D:z2 P:x D:z2 D:xy D:xy D:z2 D:z2 P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">20 10 17 4 16 3 8 13 16 19 9 3 4 17 13 8 4 15 17 68 4 2 17 7 12 42 64 31 97 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W W W W W W W W W W W W O W W W W W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.616</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">613</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">8.19 5.12 3.39 3.39 2.76 2.74 2.52 2.46 2.30 2.27 2.07 2.06 1.99 1.97 1.70 1.68 1.50 1.50 1.50 1.48 1.48 1.46 1.41 1.41 1.40 1.39 1.32 1.32 1.22 1.19</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:yz D:yz D:z2 D:z2 D:xz D:xz D:xy D:xy D:z2 D:z2 P:z P:z P:y P:y D:z2 D:z2 D:x2-y2 D:x2-y2 D:xy D:x2-y2 D:x2-y2 D:xy P:y D:xz D:xz P:y D:x2-y2 D:x2-y2 P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">101 100 14 1 15 2 18 5 15 2 60 25 45 41 18 5 5 18 15 14 1 2 98 5 18 36 15 2 60 25</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">Tc Tc W W W W W W W W O O O O W W W W W W W W O W W O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.612</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">614</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">8.00 5.18 3.39 3.39 2.81 2.78 2.57 2.56 2.36 2.32 2.06 2.05 1.99 1.98 1.65 1.63 1.49 1.48 1.47 1.47 1.46 1.45 1.42 1.41 1.37 1.36 1.35 1.34 1.22 1.22</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:yz D:yz D:z2 D:z2 D:xz D:xz D:xy D:xy D:z2 D:z2 P:z P:z P:y P:y D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:xy D:xy D:x2-y2 P:y P:y D:xz D:xz D:x2-y2 D:x2-y2 P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">103 102 11 6 10 20 7 12 10 20 91 75 57 82 7 12 6 11 12 20 10 7 59 83 7 12 20 10 75 91</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">Tc Tc W W W W W W W W O O O O W W W W W W W W O O W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.586</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">615</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">4.63 4.62 4.41 4.40 4.34 4.33 2.33 2.33 2.02 1.60 1.59 1.54 1.52 1.39 1.39 1.14 1.08 1.07 1.06 1.06 1.05 1.05 1.04 1.04 1.04 1.04 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:z2 D:z2 D:xy D:xy D:xy D:xy P:y P:y D:yz P:y P:y D:x2-y2 D:x2-y2 P:y P:y D:yz D:xy D:xy D:xy D:yz D:yz P:x D:xy P:x D:xy D:xy D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.00 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">1 14 16 3 17 4 61 27 101 97 35 1 14 54 43 100 8 13 2 4 17 29 15 62 9 19 16 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W O O Tc O O W W O O Tc W W W W W O W O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.584</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">616</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">4.74 4.73 4.48 4.45 4.31 4.28 2.33 2.31 2.08 1.64 1.63 1.57 1.56 1.34 1.33 1.25 1.24 1.11 1.10 1.06 1.06 1.06 1.04 1.04 1.02 1.01 1.01 1.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:z2 D:z2 D:xy D:xy D:xy D:xy P:y P:y D:yz P:y P:y D:x2-y2 D:x2-y2 P:y P:y D:z2 D:z2 D:xy D:xy P:x P:x D:xy D:yz D:xy D:yz D:xy D:xy P:z D:yz P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.00 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.00 0.80 0.80 0.80 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">11 6 9 19 8 13 74 76 103 51 95 11 6 56 81 1 14 16 3 79 24 20 102 10 8 17 4 79 13 24</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W O O Tc O O W W O O W W W W O O W Tc W W W W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.384</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">617</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">1.95 1.94 1.77 1.76 1.66 1.65 1.54 1.54 1.41 1.40 1.38 1.38 1.32 1.30 1.23 1.21 1.21 1.20 1.20 1.20 1.11 1.10 1.05 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:yz D:yz D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2 D:xy D:xy D:xy D:xy D:yz D:yz D:yz D:yz D:yz D:yz D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">4 17 14 1 3 16 1 14 16 3 4 17 8 13 15 18 2 11 5 6 9 19 6 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.378</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">618</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.04 2.03 1.87 1.87 1.70 1.69 1.52 1.51 1.42 1.41 1.39 1.39 1.31 1.30 1.27 1.27 1.19 1.17 1.17 1.17 1.14 1.12 1.05 1.04 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">D:yz D:yz D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2 D:xy D:xy D:yz D:yz D:xy D:xy D:yz D:yz D:yz D:yz D:yz D:yz D:yz D:yz D:z2 D:z2 D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">8 13 6 11 9 19 6 11 9 19 4 17 8 13 14 1 20 10 3 16 12 7 7 12 1 14</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.235</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">619</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">9.74 9.27 7.07 6.81 3.31 3.31 2.30 2.30</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">D:yz D:yz D:yz D:yz D:xy D:xy D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">1.00 1.00 1.00 1.00 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">100 101 102 103 1 14 11 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">Tc Tc Tc Tc W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.227</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">620</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.54 2.52 2.39 2.38 2.15 2.14 2.11 2.10 1.92 1.91 1.76 1.75 1.63 1.59 1.54 1.53 1.44 1.44 1.40 1.40 1.38 1.37 1.22 1.19 1.12 1.10 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:xy D:z2 D:xy D:z2 D:xy D:xy D:z2 D:z2 D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">5 18 15 2 15 2 17 4 5 18 3 16 12 7 10 20 4 17 10 8 20 13 12 7 19 9 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.221</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">621</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">2.79 2.46 2.40 2.37 2.34 1.90 1.80 1.73 1.61 1.56 1.52 1.50 1.50 1.49 1.46 1.45 1.45 1.44 1.26 1.24 1.23 1.10 1.07 1.07 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:z2 D:xy D:z2 D:z2 D:xy D:xy D:xy D:z2 D:xy D:z2 D:xy D:xy D:z2 D:xy D:z2 P:y D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">7 13 7 20 20 9 5 10 12 5 17 15 15 10 8 19 13 8 9 12 3 19 2 78 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">W W W W W W W W W W W W W W W W W W W W W W W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.221</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">622</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="11">8.49 7.47 6.07 5.25 3.52 3.50 2.63 2.62 1.25 1.21 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="11">1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="11">D:yz D:yz D:yz D:yz D:xy D:xy D:xy D:xy D:xy D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="11"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="11">1.00 1.00 1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="11">102 103 100 101 6 11 1 14 12 12 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="11">Tc Tc Tc Tc W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.124</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">623</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">12.69 12.65 3.71 3.67 3.14 3.14 1.61 1.59 1.42 1.41 1.41 1.41 1.40 1.40 1.20 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:yz D:yz P:z P:z D:yz D:yz D:z2 D:z2 P:y P:y P:y P:y D:yz D:yz D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.00 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">1 14 47 70 6 11 15 2 65 29 32 62 1 14 5 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W O O W W W W O O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.121</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">624</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">12.92 12.89 3.75 3.74 3.31 3.30 1.43 1.42 1.42 1.37 1.36 1.36 1.23 1.23 1.22 1.20 1.17 1.16 1.12 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">D:yz D:yz P:z P:z D:yz D:yz D:yz D:yz D:z2 D:z2 D:z2 D:z2 P:y P:y P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 4.055 4.055 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">0.80 0.80 1.33 1.33 0.80 0.80 0.00 0.00 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">6 11 63 58 1 14 6 11 10 12 7 20 79 53 24 80 99 77 87 94</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">W W O O W W W W W W W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.106</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">625</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">2.97 2.92 2.00 1.97 1.81 1.80 1.59 1.56 1.56 1.43 1.43 1.42 1.41 1.35 1.34 1.30 1.24 1.23 1.07 1.06 1.05 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:z P:z D:x2-y2 D:x2-y2 P:z D:z2 D:z2 P:z D:z2 D:z2 D:z2 D:z2 P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">2 15 20 10 18 5 16 3 28 26 5 18 37 4 17 30 7 12 9 19 73 42 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">W W W W W W W W O O W W O W W O W W W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.104</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">626</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">2.86 2.69 2.00 1.96 1.89 1.82 1.63 1.59 1.54 1.44 1.42 1.39 1.36 1.35 1.33 1.29 1.24 1.19 1.14 1.09 1.08 1.03 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:z D:z2 D:z2 P:z D:z2 P:z D:z2 D:z2 D:x2-y2 P:z D:z2 D:x2-y2 D:x2-y2 P:z D:x2-y2 D:z2 P:y D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">20 10 12 2 7 15 73 13 8 93 9 85 19 5 12 86 18 7 20 28 10 4 48 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">W W W W W W O W W O W O W W W O W W W O W W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.103</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">627</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">7.07 6.90 4.86 4.68 3.88 3.24 2.50 1.99 1.92 1.88 1.49 1.34 1.32 1.28 1.05 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:xy D:xy D:xy D:xy D:yz D:yz D:yz D:yz P:x P:x D:xz D:xz P:x P:x P:y D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 1.00 1.00 1.00 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">14 1 6 11 101 100 103 102 70 47 18 5 63 58 67 7</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W Tc Tc Tc Tc O O W W O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.098</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">628</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">6.59 6.55 4.44 4.33 4.32 4.10 3.08 2.96 1.79 1.78 1.43 1.38 1.18 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">D:xy D:xy D:yz D:xy D:xy D:yz D:yz D:yz P:x P:x D:xz D:xz P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-4.498 -4.498 -6.613 -4.498 -4.498 -6.613 -6.613 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">0.80 0.80 1.00 0.80 0.80 1.00 1.00 1.00 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">6 11 103 14 1 102 101 100 63 58 7 12 70 47</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">W W Tc W W Tc Tc Tc O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.072</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">629</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.45 2.44 1.72 1.72 1.71 1.71 1.63 1.63 1.63 1.62 1.56 1.54 1.52 1.51 1.41 1.40 1.26 1.25 1.24 1.23 1.16 1.15 1.14 1.14 1.12 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">D:xz D:xz D:x2-y2 D:x2-y2 D:xz D:xz P:z P:z D:x2-y2 D:x2-y2 D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz P:z P:z D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">15 2 3 16 20 10 25 60 15 2 5 18 17 4 19 9 5 18 13 8 12 7 75 91 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W W W W W O O W W W W W W W W W W W W W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.048</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">630</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">2.16 2.15 1.94 1.93 1.91 1.90 1.82 1.81 1.70 1.70 1.59 1.58 1.57 1.57 1.57 1.56 1.53 1.52 1.40 1.40 1.31 1.31 1.25 1.25 1.09 1.09 1.07 1.07 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:xz D:xz D:x2-y2 D:x2-y2 P:z P:z D:xz D:xz D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:z P:z D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x D:x2-y2 D:x2-y2 P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">20 10 7 12 75 91 12 7 15 2 19 9 10 20 5 18 25 60 5 18 13 8 2 15 55 50 16 3 84 89</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W O O W W W W W W W W W W O O W W W W W W O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.976</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">631</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">3.55 3.53 3.52 3.51 2.64 2.58 2.30 2.24 1.44 1.43 1.07 1.06 1.05 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:z P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">19 9 13 8 3 16 4 17 76 74 81 56 95 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">W W W W W W W W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.939</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">632</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">4.79 4.57 3.46 3.39 2.41 2.39 2.08 2.00 1.98 1.97 1.81 1.76</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:x2-y2 D:xy D:xy D:x2-y2 D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">4 17 13 8 11 6 3 1 14 16 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.933</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">633</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">4.29 4.28 3.19 3.17 1.95 1.94 1.67 1.65 1.46 1.44 1.27 1.23 1.13 1.11 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:xy D:xy D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:z P:z D:z2 D:z2 D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">1 14 11 6 3 16 17 4 8 13 30 37 19 9 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W W W W W W W O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.926</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">634</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.06 3.92 3.81 3.56 2.87 2.83 2.68 2.65 2.55 2.38 1.76 1.71 1.70 1.66 1.65 1.65 1.61 1.55 1.48 1.43 1.41 1.37 1.35 1.25 1.21 1.20 1.13 1.13 1.13 1.09 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">D:z2 D:z2 D:z2 D:z2 P:z P:z D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:z2 P:x D:z2 P:x P:x P:x D:yz D:z2 P:x P:x P:x P:x P:z P:z D:yz D:x2-y2 D:x2-y2 D:yz D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -6.613 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.00 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">8 13 19 9 76 74 9 19 13 8 17 4 95 3 92 51 48 102 16 78 88 81 56 27 61 13 4 16 8 3 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">W W W W O O W W W W W W O W O O O Tc W O O O O O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.921</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">635</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">3.99 3.98 3.95 3.63 2.93 2.83 2.78 2.77 2.55 2.41 1.86 1.77 1.74 1.73 1.72 1.69 1.65 1.52 1.45 1.41 1.40 1.36 1.33 1.32 1.27 1.25 1.21 1.19 1.14 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:z2 D:z2 D:z2 D:z2 P:z P:z D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2 P:x D:z2 D:z2 P:x P:x P:x D:z2 P:x P:x P:x P:x D:yz P:z D:x2-y2 D:x2-y2 P:z D:yz D:x2-y2 D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.00 1.33 0.80 0.80 1.33 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">17 4 3 16 27 61 16 3 4 17 9 35 8 13 31 97 64 19 42 68 43 54 100 74 19 9 76 4 8 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W O O W W W W W O W W O O O W O O O O Tc O W W O W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.916</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">636</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">5.22 5.11 5.10 4.63 1.91 1.90 1.87 1.82 1.82 1.58 1.22 1.21 1.19 1.15 1.05 1.03 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:z D:xy D:xy P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">16 9 19 3 11 6 17 8 13 4 97 61 1 14 39 35 51 95</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W W W W W O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.744</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">637</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">5.46 5.45 1.83 1.81 1.80 1.79 1.76 1.75 1.69 1.68 1.55 1.51 1.27 1.25 1.25 1.24 1.23 1.22 1.10 1.09 1.03 1.03 1.03 1.01 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">D:yz D:yz D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz P:z P:z D:yz D:yz D:yz D:yz D:z2 D:z2 D:yz D:yz D:z2 D:z2 D:z2 D:z2 D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">1 14 2 15 17 4 16 3 5 18 30 37 4 3 17 16 16 3 11 6 17 4 1 14 15 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W W W W W W W W W O O W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.741</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">638</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">5.48 5.44 1.87 1.86 1.76 1.75 1.66 1.65 1.63 1.62 1.51 1.47 1.33 1.31 1.20 1.20 1.18 1.17 1.12 1.11 1.11 1.10 1.05 1.04 1.04 1.03 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">D:yz D:yz D:xz D:xz D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:z P:z D:z2 D:z2 D:yz D:yz D:yz D:yz D:z2 D:yz D:yz D:z2 P:x D:z2 D:xy D:xy D:xy D:xy D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">11 6 10 20 7 12 13 8 19 9 93 86 19 9 8 9 13 19 13 1 14 8 85 6 12 20 7 10 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W W W W W W W W W O O W W W W W W W W W W O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.701</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">639</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">7.33 3.41 3.03 3.00 2.57 2.02 2.01 1.91 1.90 1.83 1.81 1.47 1.45 1.37 1.37 1.20 1.19 1.18 1.18 1.10 1.10 1.09 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:yz D:yz D:xz D:xz D:yz D:xy D:xy P:z P:z D:xz D:xz P:x P:x D:xy D:xy P:y P:y P:x P:x D:z2 D:yz D:z2 D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -6.613 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.00 1.00 0.80 0.80 1.00 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.00 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">100 101 15 2 102 2 15 60 25 18 5 69 44 5 18 36 98 49 71 18 103 5 20 10</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc W W Tc W W O O W W O O W W O O O O W Tc W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.692</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">640</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">7.08 3.45 2.98 2.97 2.28 2.01 1.99 1.94 1.94 1.86 1.85 1.52 1.50 1.46 1.45 1.26 1.26 1.20 1.18 1.18 1.17 1.16 1.09 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:yz D:yz D:xz D:xz D:yz D:xy D:xy P:z P:z D:xz D:xz D:xy D:xy P:x P:x P:x P:x D:yz D:z2 D:z2 P:y P:y D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -6.613 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.00 1.00 0.80 0.80 1.00 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.00 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">102 103 20 10 100 10 20 91 75 12 7 7 12 89 84 55 50 101 12 7 59 83 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc W W Tc W W O O W W W W O O O O Tc W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.257</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">641</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">6.66 5.96 5.01 4.96 3.89 3.89 3.57 3.57 2.93 2.93 2.81 2.81 2.09 2.09 1.81 1.81 1.62 1.62 1.60 1.60 -1.58 1.52 1.51 1.51 -1.44 1.38 1.37 1.32 1.30 1.28 1.28 1.28 1.27 1.27 1.20 1.20 1.13 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 2 2 3 2 2 2 3 3 3 1 2 2 3 3 3 3 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">0.762 0.762 0.762 0.762 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 3.091 2.471 -5.688 -5.688 3.091 1.231 1.231 -6.493 -5.052 -5.052 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 1.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">102 100 101 103 9 19 16 3 12 7 18 5 8 13 6 11 14 1 9 19 105 107 16 3 104 2 15 107 100 102 17 4 10 20 12 7 18 5</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">Tc Tc Tc Tc W W W W W W W W W W W W W W W W P H W W P W W H Tc Tc W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.164</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">642</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">14.33 12.78 5.52 4.83 3.47 3.17 3.01 3.01 2.67 2.66 2.25 2.25 2.04 2.04 -1.83 1.76 1.76 -1.67 1.49 1.49 1.46 1.46 1.36 1.36 -1.22 1.21 1.21 1.12 1.12 -1.09 -1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">3 3 2 2 2 1 3 3 2 1 3 3 3 3 3 3 3 2 3 3 3 3 3 3 3 3 3 3 3 2 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">0.762 0.762 -5.052 -5.052 2.471 -6.493 1.231 1.231 2.471 -6.493 1.231 1.231 1.231 1.231 0.762 1.231 1.231 -5.052 1.231 1.231 1.231 1.231 1.231 1.231 0.762 1.231 1.231 1.231 1.231 -5.052 3.091</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">0.00 0.00 2.00 2.00 0.00 1.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">100 102 100 102 107 107 8 13 106 106 2 15 17 4 101 14 1 101 16 3 6 11 10 20 103 18 5 9 19 103 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">Tc Tc Tc Tc H H W W H H W W W W Tc W W Tc W W W W W W Tc W W W W Tc P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.025</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">643</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">15.01 11.76 9.20 7.24 6.50 6.21 5.36 5.17 4.48 4.01 -2.65 -2.42 2.37 2.11 -1.72 1.53 1.53 1.39 1.39 -1.25</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">3 3 2 2 1 2 1 2 3 3 3 3 2 2 2 3 3 3 3 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S P:x P:x S S P:x S S S S P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">0.762 0.762 -5.052 -5.052 -6.493 2.471 -6.493 2.471 0.762 0.762 2.188 2.188 -5.052 -5.052 -1.119 1.231 1.231 1.231 1.231 -1.119</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">0.00 0.00 2.00 2.00 1.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">100 102 100 102 106 106 107 107 101 103 104 105 101 103 100 16 3 9 19 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">Tc Tc Tc Tc H H H H Tc Tc P P Tc Tc Tc W W W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.059</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">644</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">5.62 4.44 3.52 2.74 2.70 2.52 2.44 2.34 2.32 1.94 1.69 1.68 1.67 1.66 1.34 1.34 1.33 1.32 1.29 1.17 1.17 1.08 1.08 1.04 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">3 3 2 1 2 2 1 2 2 2 1 1 1 1 1 1 1 1 3 1 1 1 1 3 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">S S S S S S S S S S D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:x2-y2 S D:xy D:xy D:yz D:yz S D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">0.762 0.762 -5.052 -6.493 -5.052 2.471 -6.493 -13.975 2.471 -13.975 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 3.091 -4.498 -4.498 -4.498 -4.498 3.091 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">0.00 0.00 2.00 1.00 2.00 0.00 1.00 2.00 0.00 2.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.80 0.80 0.80 0.80 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">102 100 102 107 100 107 106 104 106 105 14 1 14 1 6 11 6 11 104 3 16 16 3 105 9 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">Tc Tc Tc H Tc H H P H P W W W W W W W W P W W W W P W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.089</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">645</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">3.94 3.51 1.91 1.91 1.89 1.89 1.87 1.87 1.86 1.75 1.75 1.51 1.43 1.42 1.39 1.39 1.34 1.13 1.12 1.05 1.05 1.02 1.01 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">3 3 1 1 3 3 2 1 1 3 3 2 1 1 1 1 2 2 3 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">S S D:z2 D:z2 S S S D:x2-y2 D:x2-y2 S S S D:z2 D:z2 D:x2-y2 D:x2-y2 S S S D:xy D:xy D:xy D:xy D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">0.762 0.762 -4.498 -4.498 1.231 1.231 -13.975 -4.498 -4.498 1.231 1.231 -5.052 -4.498 -4.498 -4.498 -4.498 -13.975 -5.052 3.091 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">0.00 0.00 0.80 0.80 0.00 0.00 2.00 0.80 0.80 0.00 0.00 2.00 0.80 0.80 0.80 0.80 2.00 2.00 0.00 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">101 103 6 11 12 7 105 6 11 18 5 101 14 1 14 1 104 103 105 8 13 19 9 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">Tc Tc W W W W P W W W W Tc W W W W P Tc P W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.206</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">646</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">5.23 5.22 2.62 2.60 2.43 2.43 2.12 2.11 2.00 1.98 1.66 1.66 1.38 1.38 1.16 1.15 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:xz D:xz D:yz D:yz D:xz D:xz D:yz D:yz D:yz D:yz D:yz D:yz D:xy D:xy D:yz D:yz D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">14 1 2 15 6 11 17 4 5 18 16 3 4 17 10 20 13 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.208</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">647</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">5.22 5.22 2.56 2.55 2.44 2.44 2.19 2.18 2.09 2.05 1.56 1.56 1.41 1.41 1.22 1.20 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:xz D:xz D:yz D:yz D:xz D:xz D:yz D:yz D:yz D:yz D:yz D:yz D:xy D:xy D:yz D:yz D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">6 11 10 20 14 1 13 8 7 12 9 19 13 8 2 15 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.283</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">648</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">5.49 5.48 4.43 4.42 4.12 4.12 3.28 3.28 3.22 3.12 3.07 3.07 3.00 3.00 2.95 2.95 2.63 2.50 2.48 2.31 2.31 2.30 2.30 2.21 1.95 1.95 1.88 1.88 -1.63 -1.48 -1.35 -1.29 1.17 1.17 -1.16 -1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">3 3 3 3 3 3 3 3 1 1 2 2 2 2 3 3 2 2 2 2 2 2 2 2 2 2 3 3 3 2 2 3 2 2 3 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S P:x P:x S S S P:z S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -6.493 -6.493 -5.688 -5.688 -5.688 -5.688 1.231 1.231 2.471 -5.052 2.471 -5.688 -5.688 -5.688 -5.688 -5.052 -5.688 -5.688 1.231 1.231 0.762 -1.119 -1.119 0.762 -5.688 -5.688 2.188 -5.052</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 2.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">12 7 20 10 3 16 11 6 107 106 12 7 20 10 1 14 107 100 106 3 16 6 11 102 1 14 4 17 103 102 100 101 4 17 105 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">W W W W W W W W H H W W W W W W H Tc H W W W W Tc W W W W Tc Tc Tc Tc W W P Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.322</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">649</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">10.02 10.01 8.71 8.71 6.11 6.10 5.42 5.41 -5.15 -4.93 4.45 4.45 4.09 4.07 3.78 3.77 2.74 2.73 2.52 2.51 2.37 2.36 1.46 1.46 1.45 1.45 -1.31 -1.21 -1.17 1.14 -1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">3 3 3 3 2 2 2 2 3 3 3 3 3 3 3 3 2 2 2 2 2 2 3 3 3 3 2 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">S S S S S S S S P:z P:z S S S S S S S S S S S S S S S S P:z P:z P:z S P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 2.188 2.188 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -1.119 -5.506 -5.506 -5.052 -1.119</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 1.00 1.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">5 18 9 19 5 18 9 19 104 105 12 7 16 3 2 15 12 7 16 3 2 15 8 13 20 10 101 104 105 100 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">W W W W W W W W P P W W W W W W W W W W W W W W W W Tc P P Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.382</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">650</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">7.74 7.74 7.67 7.65 -5.91 -5.90 4.22 4.20 4.15 4.15 4.13 4.12 4.11 4.10 4.07 4.05 4.01 4.00 2.65 2.64 2.64 2.62 2.57 2.57 2.57 2.56 -1.94 -1.93 1.79 1.77 1.75 1.75 1.61 1.59 1.58 1.57 1.03 1.02 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">3 3 3 3 3 3 3 3 3 3 2 2 2 2 3 3 3 3 2 2 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">S S S S P:y P:y S S S S S S S S S S S S S S S S S S S S P:y P:y S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 2.188 2.188 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.506 -5.506 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">11 14 6 1 105 104 18 12 7 5 6 1 14 11 19 16 9 3 9 3 19 16 18 5 7 12 105 104 15 20 2 10 13 17 8 4 2 10 15 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">W W W W P P W W W W W W W W W W W W W W W W W W W W P P W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.425</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">651</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">5.60 5.54 5.33 5.32 3.95 3.95 3.80 3.79 3.04 3.03 2.74 2.70 2.27 2.26 2.22 2.21 -1.85 1.79 1.71 1.70 1.68 1.67 1.56 -1.19 1.19 1.16 1.16 1.11 1.11 -1.07 1.07 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">2 2 3 3 2 2 3 3 2 2 3 3 2 2 3 3 3 1 2 2 3 3 1 3 2 1 1 1 1 3 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">S S S S S S S S S S S S S S S S S S S S S S S P:z S D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-5.052 -5.052 1.231 1.231 -5.688 -5.688 1.231 1.231 -5.688 -5.688 0.762 0.762 -5.688 -5.688 1.231 1.231 0.762 -6.493 -5.688 -5.688 1.231 1.231 -6.493 2.188 2.471 -4.498 -4.498 -4.498 -4.498 0.762 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 1.00 2.00 2.00 0.00 0.00 1.00 0.00 0.00 0.80 0.80 0.80 0.80 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">103 101 17 4 17 4 20 10 20 10 101 103 11 6 11 6 102 106 14 1 14 1 107 104 106 12 7 18 5 100 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">Tc Tc W W W W W W W W Tc Tc W W W W Tc H W W W W H P H W W W W Tc W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.491</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">652</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">9.79 9.78 9.75 9.74 6.09 6.09 6.06 6.05 -6.02 -5.99 3.08 3.08 3.05 3.03 2.94 2.92 2.90 2.89 2.08 2.06 2.05 2.05 -2.02 -2.02 1.98 1.97 1.95 1.94 1.23 1.23 1.20 1.19 1.13 1.12 1.12 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">3 3 3 3 2 2 2 2 3 3 3 3 3 3 3 3 3 3 2 2 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">S S S S S S S S P:y P:y S S S S S S S S S S S S P:y P:y S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 2.188 2.188 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.506 -5.506 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 1.00 1.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">14 1 6 11 14 1 6 11 104 105 2 15 10 20 13 8 17 4 13 8 17 4 104 105 2 15 10 20 5 18 7 12 19 9 16 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">W W W W W W W W P P W W W W W W W W W W W W P P W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.515</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">653</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">7.60 7.57 7.52 7.51 5.76 5.74 5.65 5.64 5.61 5.61 -4.98 4.77 4.75 -4.59 3.87 3.86 3.10 3.09 2.99 2.97 -1.92 1.91 1.90 1.71 1.70 1.66 -1.55 1.42 1.42 -1.38 1.36 1.35 -1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">3 3 3 3 2 2 3 3 2 2 3 3 3 3 2 2 3 3 2 2 2 3 3 2 2 2 2 3 3 2 3 3 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">S S S S S S S S S S P:z S S P:z S S S S S S P:z S S S S S P:z S S P:z S S P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 1.231 1.231 -5.688 -5.688 2.188 1.231 1.231 2.188 -5.688 -5.688 1.231 1.231 -5.688 -5.688 -1.119 1.231 1.231 -5.688 -5.688 -5.052 -1.119 1.231 1.231 -5.506 1.231 1.231 -5.506</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 2.00 2.00 2.00 0.00 0.00 0.00 1.00 0.00 0.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">8 13 15 2 8 13 4 17 15 2 105 20 10 104 4 17 9 19 20 10 100 3 16 9 19 102 102 12 7 105 18 5 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">W W W W W W W W W W P W W P W W W W W W Tc W W W W Tc Tc W W P W W P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.657</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">654</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">2.95 2.89 2.21 2.17 2.12 2.09 1.96 1.92 1.87 1.83 1.77 1.73 1.73 1.70 1.39 1.39 1.35 1.35 1.32 1.31 1.28 1.28 1.05 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">2 2 2 2 2 2 3 3 3 3 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:y P:y S S S S S S S S D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 S S D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-5.506 -5.506 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -5.688 -5.688 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.00 1.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 2.00 2.00 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">105 104 7 5 12 18 12 18 7 5 9 16 19 3 4 13 8 17 6 1 11 14 10 2 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">P P W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.682</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">655</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">5.84 5.81 5.52 5.52 5.27 5.27 5.08 5.08 5.06 5.06 5.01 4.98 4.91 4.91 4.61 4.61 -2.87 -2.78 2.05 2.05 1.95 1.87 1.87 1.49 1.48 1.38 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">3 3 3 3 2 2 3 3 2 2 2 2 2 2 3 3 2 2 2 2 3 3 3 2 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">S S S S S S S S S S S S S S S S P:z P:z S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 -1.119 -1.119 -5.688 -5.688 0.762 1.231 1.231 -5.688 -5.688 -5.052 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">20 10 17 4 17 4 2 15 2 15 20 10 8 13 8 13 100 102 7 12 102 7 12 16 3 102 5 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W W W W W W W W W W W Tc Tc W W Tc W W W W Tc W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.701</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">656</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.00 2.96 2.02 2.02 1.99 1.98 1.57 1.57 1.55 1.55 1.42 1.42 1.42 1.41 1.38 1.38 1.34 1.34 1.15 1.15 1.13 1.13 1.03 1.03 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">2 2 1 1 1 1 2 2 2 2 1 1 1 1 1 1 1 1 3 3 3 3 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 S S S S D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz S S S S P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-5.506 -5.506 -4.498 -4.498 -4.498 -4.498 -5.688 -5.688 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 1.231 1.231 1.231 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.00 1.00 0.80 0.80 0.80 0.80 2.00 2.00 2.00 2.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">104 105 14 1 6 11 2 15 10 20 3 16 19 9 4 17 8 13 2 15 10 20 70 47 63 58</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">P P W W W W W W W W W W W W W W W W W W W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.867</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">657</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">3.80 3.76 3.67 3.64 3.27 3.25 3.04 2.98 2.95 2.93 2.87 2.79 1.52 1.52 1.49 1.49 1.42 1.42 1.42 1.41 1.41 1.41 1.40 1.38 1.38 1.38 1.28 1.24 1.18 1.18 1.18 1.16 1.14 1.12 1.11 1.10 1.10 1.02 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">3 3 3 3 2 2 2 2 1 1 1 1 3 3 2 2 1 1 1 3 3 3 3 1 2 2 3 3 1 1 1 2 1 1 2 2 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">S S S S S S S S D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 S S S S P:y P:y P:y S S S S P:y S S S S D:z2 D:yz D:z2 S D:z2 D:z2 S S S P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 1.231 1.231 -5.688 -5.688 -9.089 -9.089 -9.089 1.231 1.231 1.231 1.231 -9.089 -5.688 -5.688 1.231 1.231 -4.498 -4.498 -4.498 -5.688 -4.498 -4.498 -5.688 -5.688 -5.688 -0.500 -0.500 -0.500</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.80 0.80 0.80 0.80 0.00 0.00 2.00 2.00 1.33 1.33 1.33 0.00 0.00 0.00 0.00 1.33 2.00 2.00 0.00 0.00 0.80 0.80 0.80 2.00 0.80 0.80 2.00 2.00 2.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">16 19 3 9 9 3 16 19 6 1 14 11 7 5 18 12 63 70 47 18 12 10 2 58 7 5 15 20 1 20 6 15 14 11 20 2 10 6 14 1</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">W W W W W W W W W W W W W W W W O O O W W W W O W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.871</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">658</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">7.90 7.73 4.03 3.93 2.26 2.21 2.07 2.03 1.50 1.50 1.45 1.43 1.36 1.34 1.26 1.25 1.23 1.20 1.19 1.18 1.16 1.12 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:yz D:yz D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2 P:z P:z D:xy D:xy P:z P:z D:xy D:xy D:yz D:yz P:z P:z D:yz P:x D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">2 15 16 3 10 20 16 3 32 65 16 3 44 69 2 15 4 17 64 31 19 30 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">W W W W W W W W O O W W O O W W W W O O W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.873</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">659</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">7.97 7.70 4.04 3.97 2.39 2.20 2.12 2.07 1.50 1.50 1.46 1.46 1.40 1.40 1.29 1.27 1.23 1.23 1.19 1.19 1.17 1.17 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:yz D:yz D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2 P:z P:z D:xy D:xy P:z P:z D:xy D:xy P:z P:z D:yz D:yz D:yz D:yz P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">10 20 19 9 15 2 19 9 53 80 9 19 84 89 10 20 92 48 3 8 16 13 93</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">W W W W W W W W O O W W O O W W O O W W W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.929</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">660</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="46">3.25 3.21 3.00 2.96 2.93 2.89 2.89 2.88 2.73 2.67 2.64 2.63 2.59 2.57 2.54 2.48 2.42 2.35 2.34 2.30 2.28 2.26 2.13 2.11 2.09 2.01 1.98 1.94 1.90 1.86 1.77 1.73 1.46 1.43 1.40 1.37 1.31 1.29 1.21 1.19 1.09 1.07 1.07 -1.04 1.03 -1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="46">2 2 2 3 2 3 2 2 2 3 2 3 3 3 3 3 3 3 3 3 2 2 2 3 2 3 2 2 3 3 2 2 2 2 2 2 1 1 1 1 3 3 3 2 3 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="46">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S D:xz D:xz D:xz D:xz S S S P:y S P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="46"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 1.231 -5.688 1.231 -5.688 -5.688 -5.688 1.231 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 1.231 -5.688 1.231 -5.688 -5.688 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 1.231 1.231 1.231 -1.119 1.231 -1.119</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="46">2.00 2.00 2.00 0.00 2.00 0.00 2.00 2.00 2.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 0.00 2.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="46">8 13 4 13 17 8 16 3 19 17 9 4 15 7 2 12 5 18 20 10 12 7 18 3 5 16 2 15 9 19 10 20 6 11 1 14 14 1 6 11 11 6 14 100 1 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="46">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W Tc W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.944</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">661</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">7.74 7.73 3.08 3.02 2.00 1.98 1.95 1.92 1.49 1.48 1.30 1.29 1.14 1.14 1.13 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:yz D:yz D:yz D:yz D:yz D:xy D:yz D:xy P:z P:z P:z P:z D:xy D:x2-y2 D:x2-y2 D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">5 18 12 7 17 5 4 18 34 67 49 71 4 17 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W W W W W O O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.950</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">662</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="42">2.98 2.70 2.67 2.60 2.56 2.54 2.53 2.47 2.38 2.30 2.29 2.26 2.23 2.22 2.18 2.13 2.09 2.06 2.00 1.90 1.88 1.84 1.62 1.45 1.42 1.36 1.31 1.27 1.20 1.20 1.19 1.19 1.18 1.17 1.10 1.10 1.07 1.05 1.04 1.02 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="42">2 2 2 3 2 3 2 2 3 1 3 1 3 3 1 2 1 3 3 1 1 2 1 1 2 3 3 2 2 1 2 3 2 1 1 3 2 1 1 1 1 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="42">S S S S S S S S S D:x2-y2 S D:x2-y2 S S D:x2-y2 S D:x2-y2 S S D:yz D:yz S D:yz D:yz S S S S S P:y S S S P:y P:y S S P:y D:yz D:yz D:z2 S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="42"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 1.231 -5.688 1.231 -5.688 -5.688 1.231 -4.498 1.231 -4.498 1.231 1.231 -4.498 -5.688 -4.498 1.231 1.231 -4.498 -4.498 -5.688 -4.498 -4.498 -5.688 1.231 1.231 -5.688 -5.688 -9.089 -5.688 1.231 -5.688 -9.089 -9.089 1.231 -5.688 -9.089 -4.498 -4.498 -4.498 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="42">2.00 2.00 2.00 0.00 2.00 0.00 2.00 2.00 0.00 0.80 0.00 0.80 0.00 0.00 0.80 2.00 0.80 0.00 0.00 0.80 0.80 2.00 0.80 0.80 2.00 0.00 0.00 2.00 2.00 1.33 2.00 0.00 2.00 1.33 1.33 0.00 2.00 1.33 0.80 0.80 0.80 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="42">10 2 4 10 20 4 8 15 8 6 2 1 17 20 14 17 11 15 13 20 12 13 15 18 19 19 9 5 9 63 7 16 16 47 70 3 18 58 2 10 11 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="42">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W O W W W O O W W O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.950</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">663</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">9.06 7.24 4.13 2.86 2.20 2.14 2.03 1.93 1.54 1.49 1.47 1.46 1.41 1.37 1.17 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:yz D:yz D:yz D:yz D:xy D:yz D:xy D:yz P:z P:z P:z D:x2-y2 P:z D:yz D:xy D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 1.33 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">7 12 5 18 7 8 12 13 94 55 87 13 50 10 8 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W W W W W O O O W O W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.990</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">664</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">7.89 7.87 7.64 7.60 1.58 1.55 1.31 1.27 1.26 1.22 1.15 1.13 1.12 1.09 1.08 1.07 1.07 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:xz D:xz D:xz D:xz P:y P:y D:yz D:yz D:yz D:yz D:yz P:y D:yz D:yz P:y P:y D:yz P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">1 14 6 11 37 86 17 4 13 8 16 30 3 19 26 93 9 85</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W O O W W W W W O W W O O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.994</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">665</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">6.31 6.29 5.95 5.88 4.98 4.96 4.83 4.82 3.10 3.10 1.98 1.95 1.89 1.79 1.72 1.67 1.56 1.47 1.32 1.25 1.03 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">3 3 2 2 2 2 3 3 2 2 3 3 1 1 2 2 1 1 3 3 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">S S S S S S S S S S S S D:x2-y2 D:x2-y2 S S D:x2-y2 D:x2-y2 S S D:xz D:xz S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">1.231 1.231 -5.688 -5.688 -5.688 -5.688 1.231 1.231 -5.688 -5.688 1.231 1.231 -4.498 -4.498 -5.688 -5.688 -4.498 -4.498 1.231 1.231 -4.498 -4.498 -6.493</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.80 0.80 2.00 2.00 0.80 0.80 0.00 0.00 0.80 0.80 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">6 11 6 11 14 1 1 14 3 16 3 16 11 6 7 12 1 14 7 12 3 12 106</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">W W W W W W W W W W W W W W W W W W W W W W H</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.001</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">666</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">6.59 6.59 6.31 6.30 1.39 1.35 1.31 1.30 1.28 1.24 1.20 1.20 1.18 1.18 1.17 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:xz D:xz D:xz D:xz D:yz D:yz D:yz D:yz P:y D:yz P:y D:yz D:yz P:y D:yz P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">11 6 14 1 13 8 17 4 86 19 37 9 16 93 3 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W W W W W O W O W W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.018</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">6.30 6.30 5.37 5.36 2.77 2.76 2.42 2.39 2.06 2.05 2.00 1.99 1.95 1.95 1.90 1.87 1.86 1.86 1.86 1.83 1.73 1.72 1.58 1.57 1.46 1.45 1.29 1.29 -1.14 1.12 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">3 3 2 2 2 2 3 3 2 2 1 1 1 1 3 3 1 1 2 2 2 2 3 3 3 3 3 3 3 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">S S S S S S S S S S D:x2-y2 D:x2-y2 D:xz D:xz S S D:xz D:xz S S S S S S S S S S P:x S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">1.231 1.231 -5.688 -5.688 -5.688 -5.688 1.231 1.231 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 1.231 1.231 -4.498 -4.498 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 2.188 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 2.00 2.00 0.80 0.80 0.80 0.80 0.00 0.00 0.80 0.80 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">14 1 14 1 17 4 9 19 15 2 1 14 4 17 16 3 8 13 9 19 8 13 6 11 15 2 17 4 104 16 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">W W W W W W W W W W W W W W W W W W W W W W W W W W W W P W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.036</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">668</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">6.20 6.17 4.98 4.96 4.21 4.20 3.92 3.89 3.51 3.51 3.32 3.31 2.72 2.71 2.45 2.44 2.41 2.39 2.05 2.00 1.78 1.74 1.64 1.64 -1.39 1.32 1.32 -1.24 1.14 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">2 2 2 2 2 2 3 3 3 3 3 3 2 2 2 2 3 3 2 2 3 3 2 2 2 1 1 2 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">S S S S S S S S S S S S S S S S S S S S S S S S P:z D:xz D:xz P:z S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 1.231 1.231 -5.688 -5.688 1.231 1.231 -5.688 -5.688 -1.119 -4.498 -4.498 -1.119 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.80 0.80 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">19 9 16 3 6 11 19 9 6 11 16 3 5 18 10 20 5 18 12 7 12 7 4 17 103 16 3 101 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W W W W W W W W W W W W W W W W W Tc W W Tc W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.120</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">669</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">6.43 6.36 5.35 5.28 -4.90 4.76 4.68 4.56 4.47 4.32 4.22 -4.06 3.15 3.13 3.09 3.06 3.06 3.05 3.03 3.00 2.99 2.97 2.59 2.56 -2.45 1.97 1.59 1.58 1.02 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">2 2 2 2 2 2 2 3 3 3 3 2 2 2 2 2 3 3 3 3 3 3 2 2 3 3 3 3 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">S S S S S S S S S S S S S S S S S S S S S S S S S S S S D:x2-y2 S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.052 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.052 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 0.762 0.762 1.231 1.231 -4.498 0.762</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.80 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">1 14 7 12 101 18 5 7 12 18 5 103 19 9 11 6 19 3 9 16 14 1 3 16 103 100 6 11 3 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W Tc W W W W W W Tc W W W W W W W W W W W W Tc Tc W W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.136</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">670</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">5.45 5.41 4.93 4.92 4.28 4.28 3.77 3.76 2.85 2.58 2.57 2.56 2.52 2.45 2.40 2.26 2.24 1.66 1.66 1.64 1.64 1.64 -1.60 1.58 1.50 1.29 1.22 1.06 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">2 2 2 2 3 3 3 3 1 2 2 3 2 2 3 1 1 2 3 3 2 2 2 2 2 3 3 2 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">S S S S S S S S S S S S S S S D:xz D:xz S S S S S P:x S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -6.493 -5.688 -5.688 1.231 -5.688 -5.688 1.231 -4.498 -4.498 -5.688 1.231 1.231 -5.688 -5.688 -1.119 2.471 -5.688 1.231 1.231 -5.052 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 1.00 2.00 2.00 0.00 2.00 2.00 0.00 0.80 0.80 2.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 0.00 0.00 2.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">2 15 13 8 13 8 2 15 106 6 11 4 5 18 17 9 19 10 10 20 4 20 100 106 17 5 18 101 11 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W H W W W W W W W W W W W W W Tc H W W W Tc W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.138</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">671</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">2.51 2.41 2.05 1.93 1.93 1.85 1.84 1.80 1.73 1.69 1.59 1.53 1.51 1.51 1.50 1.47 1.41 1.36 1.36 1.33 1.26 1.26 1.21 1.20 1.17 1.16 1.11 1.11 1.05 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 2 1 3 2 3 1 1 1 1 1 1 1 2 1 3 1 1 3 2 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:xz D:xz D:xz D:xz D:xz S D:xz S S S D:xz D:xz D:x2-y2 D:xz D:x2-y2 D:xz D:x2-y2 S D:x2-y2 S D:xz D:xz S S D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -5.688 -4.498 1.231 -5.688 1.231 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -5.688 -4.498 1.231 -4.498 -4.498 1.231 -5.688 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 0.80 2.00 0.80 0.00 2.00 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 2.00 0.80 0.00 0.80 0.80 0.00 2.00 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">16 3 17 4 19 17 9 17 4 4 18 5 15 8 2 13 18 13 5 13 2 15 8 8 12 7 10 20 12 7</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.153</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">672</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">2.61 2.50 2.50 2.43 2.37 2.26 2.05 1.98 1.85 1.84 1.79 1.76 1.76 1.75 1.56 1.56 1.45 1.44 1.39 1.38 1.32 1.31 1.30 1.29 1.19 1.17 1.11 1.08 1.05 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">2 2 1 1 3 3 2 2 1 3 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">S S D:xz D:xz S S S S D:xz S D:xz D:xz D:xz S D:x2-y2 D:x2-y2 D:xz D:xz D:xz D:xz D:xz D:x2-y2 D:x2-y2 D:xz D:x2-y2 D:x2-y2 D:xz D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-5.688 -5.688 -4.498 -4.498 1.231 1.231 -5.688 -5.688 -4.498 1.231 -4.498 -4.498 -4.498 1.231 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">2.00 2.00 0.80 0.80 0.00 0.00 2.00 2.00 0.80 0.00 0.80 0.80 0.80 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">8 13 9 19 8 13 17 4 16 17 3 8 13 4 20 10 7 12 20 10 17 7 12 4 2 15 18 5 2 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.216</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">673</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">5.60 5.57 4.44 4.43 3.92 2.84 2.82 2.68 2.65 2.53 2.52 2.46 2.46 2.46 2.19 2.18 2.13 1.98 1.97 1.97 1.97 1.70 1.70 -1.58 1.35 1.22 1.21 1.09 1.08 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">3 3 2 2 1 2 2 1 1 3 3 2 1 2 2 2 2 2 2 3 3 3 3 2 2 1 1 3 3 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">S S S S S S S D:xz D:xz S S S S S S S S S S S S S S P:x S D:xz D:xz S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">1.231 1.231 -5.688 -5.688 -6.493 -5.688 -5.688 -4.498 -4.498 1.231 1.231 -5.688 -6.493 -5.688 -5.688 -5.688 2.471 -5.688 -5.688 1.231 1.231 1.231 1.231 -1.119 2.471 -4.498 -4.498 1.231 1.231 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">0.00 0.00 2.00 2.00 1.00 2.00 2.00 0.80 0.80 0.00 0.00 2.00 1.00 2.00 2.00 2.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.80 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">8 13 8 13 107 20 10 9 19 20 10 15 106 2 18 5 107 7 12 15 2 17 4 102 106 16 3 18 5 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">W W W W H W W W W W W W H W W W H W W W W W W Tc H W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.299</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">674</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="42">4.03 4.02 3.62 3.61 3.56 3.55 3.11 3.10 2.44 2.44 2.25 2.25 2.11 2.11 2.03 2.02 2.01 2.00 1.84 1.84 1.78 1.77 1.76 1.76 1.61 1.61 1.51 1.51 1.49 1.49 1.48 1.48 1.33 1.32 1.30 1.30 1.26 1.25 1.13 1.13 1.05 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="42">2 2 2 2 2 2 2 2 2 2 3 3 2 2 3 3 3 3 3 3 2 2 2 2 2 2 3 3 3 3 3 3 2 2 3 3 1 1 1 1 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="42">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S D:xz D:xz D:xz D:xz S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="42"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 1.231 1.231 -4.498 -4.498 -4.498 -4.498 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="42">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 0.80 0.80 0.80 0.80 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="42">13 8 4 17 2 15 20 10 19 9 15 2 3 16 13 8 10 20 4 17 14 1 11 6 18 5 19 9 11 6 14 1 7 12 3 16 13 8 4 17 18 5</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="42">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.351</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">675</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">9.80 9.58 3.21 3.20 2.40 2.40 1.94 1.81 1.78 1.78 1.77 1.77 1.69 1.68 1.31 1.31 1.29 1.29 1.25 1.25 1.22 1.21 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">2 2 1 1 1 1 3 3 2 2 3 3 3 3 1 1 2 2 1 1 2 2 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">S S D:xz D:xz D:xz D:xz S S S S S S S S D:x2-y2 D:x2-y2 S S D:x2-y2 D:x2-y2 S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-5.052 -5.052 -4.498 -4.498 -4.498 -4.498 0.762 0.762 -5.688 -5.688 1.231 1.231 1.231 1.231 -4.498 -4.498 -5.688 -5.688 -4.498 -4.498 -5.688 -5.688 -6.493</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">2.00 2.00 0.80 0.80 0.80 0.80 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.80 0.80 2.00 2.00 0.80 0.80 2.00 2.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">101 103 8 13 17 4 101 103 19 9 9 19 16 3 5 18 16 3 12 7 5 18 107</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">Tc Tc W W W W Tc Tc W W W W W W W W W W W W W W H</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.352</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">676</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">5.04 4.99 4.91 4.85 4.57 4.50 4.39 4.34 3.49 3.45 3.24 3.19 2.91 2.87 2.60 2.56 2.43 2.40 2.36 2.33 2.21 2.16 2.15 2.10 1.84 1.78 1.78 1.72 1.63 1.59 1.57 1.52</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">20 10 4 17 15 2 8 13 7 12 5 18 16 3 19 9 10 12 20 7 18 5 2 15 17 4 3 16 13 9 8 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.486</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">677</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">8.57 8.54 8.50 8.50 4.37 4.34 4.28 4.28 2.89 2.87 2.86 2.84 2.43 2.41 2.40 2.38 1.19 1.17 1.15 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">2 2 2 2 3 3 3 3 2 2 2 2 2 2 2 2 3 3 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">6 1 14 11 11 14 1 6 17 13 8 4 15 20 10 2 8 4 17 13</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.510</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">678</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">3.89 3.88 2.67 2.66 2.59 2.59 2.48 2.46 2.38 2.38 2.32 2.31 1.98 1.98 1.72 1.71 1.27 1.25 1.18 1.18</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">20 10 5 18 2 15 12 7 10 20 5 18 12 7 2 15 4 17 13 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.540</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">679</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">5.37 4.94 2.96 2.89 2.58 2.55 2.50 2.13 1.92 1.91 1.80 1.74 1.70 1.63 1.58 1.35 1.34 1.30 1.28 1.21 1.18 1.16 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">2 2 1 1 1 1 3 3 3 1 1 1 1 1 1 1 1 1 2 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 S S S D:xz D:xz D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz S D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-5.052 -5.052 -4.498 -4.498 -4.498 -4.498 0.762 0.762 0.762 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -5.052 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 2.00 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">101 103 2 15 20 10 101 103 100 2 15 20 10 5 18 16 3 5 100 18 12 7 9 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc W W W W Tc Tc Tc W W W W W W W W W Tc W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.549</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">680</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">5.57 4.88 4.80 4.64 4.37 2.78 2.67 2.43 2.27 2.15 2.10 1.99 1.96 1.87 1.76 1.64 1.60 1.33 1.30 1.20 1.18 1.16 1.16 1.13 1.13 1.12 1.11 1.10 -1.09 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">2 2 2 3 3 1 1 3 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:y S S S S D:x2-y2 D:x2-y2 S S D:yz D:yz D:yz D:xz D:xz D:xz D:yz D:xz D:xz D:xz P:z P:y P:y D:yz D:xy D:z2 D:yz D:xy P:z P:y D:z2 D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-5.506 -5.688 -5.688 1.231 1.231 -4.498 -4.498 1.231 1.231 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 2.188 -4.498 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.00 2.00 2.00 0.00 0.00 0.80 0.80 0.00 0.00 0.80 0.80 1.00 0.80 0.80 0.80 1.00 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 0.00 0.80 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">104 2 15 15 2 1 14 4 17 2 15 100 18 5 15 101 2 16 3 69 69 44 5 18 1 18 5 44 104 14 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">P W W W W W W W W W W Tc W W W Tc W W W O O O W W W W W O P W P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.551</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">681</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">5.51 5.14 5.04 4.70 4.57 2.70 2.68 2.33 2.26 2.11 2.11 1.97 1.94 1.94 1.73 1.66 1.61 1.31 1.31 1.19 1.16 1.16 1.14 1.14 1.13 1.12 1.11 1.09 1.09 1.07 -1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">2 2 2 3 3 1 1 3 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:y S S S S D:x2-y2 D:x2-y2 S S D:yz D:yz D:yz D:xz D:xz D:xz D:xz D:yz D:xz D:xz P:y P:y P:z P:z D:yz D:yz D:xy D:z2 D:xy D:z2 D:yz P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-5.506 -5.688 -5.688 1.231 1.231 -4.498 -4.498 1.231 1.231 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 10.422 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.00 2.00 2.00 0.00 0.00 0.80 0.80 0.00 0.00 0.80 0.80 1.00 0.80 0.80 0.80 0.80 1.00 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">105 10 20 20 10 6 11 8 13 10 20 102 7 12 10 20 103 9 19 89 84 84 89 12 7 7 6 12 11 105 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">P W W W W W W W W W W Tc W W W W Tc W W O O O O W W W W W W P P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.636</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">682</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">4.47 4.46 4.44 4.43 4.25 4.24 4.24 4.23 2.11 2.11 2.07 2.06 1.49 1.49 1.49 1.48 1.36 1.34 1.34 1.32 1.29 1.28 1.25 1.25 1.24 1.24 1.23 1.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">2 2 2 2 2 2 2 2 1 1 1 1 2 2 2 2 3 3 3 3 3 3 3 3 3 3 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">S S S S S S S S D:yz D:yz D:yz D:yz S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80 0.80 0.80 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">14 1 6 11 19 3 9 16 5 18 7 12 20 10 2 15 9 19 16 3 1 11 17 14 6 4 8 13</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.669</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">683</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">3.62 3.62 3.62 3.61 2.12 2.12 2.06 2.05 1.43 1.43 1.42 1.40 1.12 1.11 1.10 1.10 1.05 1.04 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 3 3 3 3 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">D:yz D:yz D:yz D:yz D:yz D:yz D:yz D:yz S S S S D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 1.231 1.231 1.231 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">7 5 18 12 2 15 10 20 4 8 17 13 8 13 17 4 16 9 3 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.725</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">684</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">5.44 5.43 5.41 5.40 4.62 4.62 4.61 4.61 2.78 2.76 2.74 2.72 2.26 2.26 2.20 2.19 1.63 1.63 1.57 1.57 1.57 1.57 1.54 1.54 1.32 1.31 1.30 1.29 1.25 1.24 1.22 1.22</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">2 2 2 2 2 2 2 2 3 3 3 3 2 2 2 2 1 1 1 1 1 1 1 1 3 3 3 3 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">S S S S S S S S S S S S S S S S D:yz D:yz D:yz D:yz D:yz D:yz D:yz D:yz S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">9 19 3 16 5 18 12 7 19 9 3 16 4 17 13 8 10 20 7 15 2 12 18 5 7 18 5 12 20 10 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.772</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">685</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">7.74 7.71 7.68 7.66 4.28 4.22 4.21 4.18 1.61 1.61 1.59 1.59 1.49 1.48 1.47 1.46 1.41 1.40 1.37 1.36 1.36 1.36 1.35 1.34 -1.12 -1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">2 2 2 2 3 3 3 3 2 2 2 2 3 3 3 3 1 1 2 1 2 1 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">S S S S S S S S S S S S S S S S D:yz D:yz S D:yz S D:yz S S P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -4.498 -4.498 -5.688 -4.498 -5.688 -4.498 -5.688 -5.688 -1.119 -1.119</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.80 0.80 2.00 0.80 2.00 0.80 2.00 2.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">7 18 12 5 12 5 7 18 16 9 3 19 19 3 9 16 10 20 1 2 11 15 14 6 103 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W W W W W W W W W W W W W W W W W W W W W W W Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.806</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">686</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">8.55 6.27 4.02 3.62 3.37 3.02 3.00 2.69 2.52 2.30 2.21 2.18 1.68 1.60 1.58 1.46 -1.44 1.43 1.43 1.41 1.40 1.37 1.36 1.24 1.24 1.14 1.14 1.14 -1.14 -1.09 1.08 1.05 -1.03 -1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 2 2 2 2 1 1 2 2 2 3 3 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 3 2 2 3 3 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">S S S P:z S D:x2-y2 D:x2-y2 P:x S S S S S D:yz D:yz P:z D:x2-y2 D:x2-y2 D:x2-y2 P:y P:y D:x2-y2 D:x2-y2 D:xz D:xz D:x2-y2 D:x2-y2 S D:xz P:z S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-6.493 -5.052 -5.052 -5.506 -5.052 -4.498 -4.498 -5.506 2.471 -5.052 1.231 1.231 -6.493 -4.498 -4.498 -5.506 3.846 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 0.762 3.846 9.585 1.231 1.231 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.00 2.00 2.00 1.00 2.00 0.80 0.80 1.00 0.00 2.00 0.00 0.00 1.00 0.80 0.80 1.00 0.00 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.00 0.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">107 102 103 105 101 11 6 105 107 100 6 11 106 13 8 104 102 10 20 63 58 9 19 11 6 1 14 102 102 21 7 12 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">H Tc Tc P Tc W W P H Tc W W H W W P Tc W W O O W W W W W W Tc Tc O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.612</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">247</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="7">57.62 18.90 6.87 2.77 2.52 2.20 1.88</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="7">1 1 2 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="7">S S P:x S S S D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="7"
                               units="nonsi:electronvolt">-24.020 -24.020 -5.506 -24.020 -24.020 -24.020 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="7">2.00 2.00 1.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="7">96 23 105 90 72 40 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="7">O O P O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.611</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">248</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="7">56.92 20.19 6.77 2.45 2.24 2.23 1.91</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="7">1 1 2 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="7">S S P:x S S S D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="7"
                               units="nonsi:electronvolt">-24.020 -24.020 -5.506 -24.020 -24.020 -24.020 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="7">2.00 2.00 1.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="7">40 38 104 52 96 46 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="7">O O P O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.574</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">249</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">40.91 40.71 8.23 2.30</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 2 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S P:y D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -24.020 -5.506 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 2.00 1.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">52 46 104 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O O P P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.574</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">250</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">41.02 40.60 8.23 2.30</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 2 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S P:y D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -24.020 -5.506 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 2.00 1.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">90 72 105 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O O P P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.498</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">251</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="6">42.53 17.70 17.24 6.60 4.60 2.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="6">1 1 1 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="6">S S S P:z S D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="6"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -5.506 -24.020 10.422</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="6">2.00 2.00 2.00 1.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="6">38 46 52 104 40 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="6">O O O P O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-24.495</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">252</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="7">43.93 17.51 16.78 6.48 3.87 2.12 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="7">1 1 1 2 1 1 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="7">S S S P:z S D:x2-y2 P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="7"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -5.506 -24.020 10.422 -5.506</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="7">2.00 2.00 2.00 1.00 2.00 0.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="7">23 72 90 105 96 105 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="7">O O O P O P P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.703</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">253</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">7.90 7.87 7.83 7.82 5.99 5.98 5.90 5.88 5.24 5.21 3.53 3.42 3.34 3.33 1.47 1.47 1.16 1.16 1.14 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">67 34 65 32 62 29 66 33 26 28 30 37 60 25 61 27 98 36 45 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.700</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">254</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">7.88 7.81 7.81 7.78 6.06 6.06 5.92 5.91 5.20 5.13 3.61 3.47 3.29 3.28 1.51 1.50 1.14 1.13 1.12 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">94 87 53 80 24 79 99 77 85 73 93 86 91 75 76 74 57 82 83 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.446</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">255</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">11.43 11.33 11.31 11.29 7.84 7.79 7.70 7.68 3.32 3.30 1.93 1.93 1.73</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">S S S S S S S S S S S S P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">32 65 67 34 29 62 66 33 25 60 52 46 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O O O O O O O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.444</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">256</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">11.42 11.41 11.30 11.17 7.96 7.86 7.71 7.66 3.27 3.25 1.94 1.92 1.74</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">S S S S S S S S S S S S P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">80 53 94 87 79 24 77 99 91 75 72 90 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O O O O O O O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.337</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">257</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">10.63 9.85 7.62 7.56 7.55 7.53 5.63 5.55 5.28 5.23 5.13 5.10 3.56 1.96 1.96</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">S S S S S S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">37 28 65 32 33 66 30 26 62 29 34 67 22 14 1</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.335</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">258</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">11.91 10.33 7.93 7.88 7.81 7.75 4.83 4.62 4.61 4.54 4.41 4.35 4.34 1.88 1.88</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">S S S S S S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">86 73 77 99 53 80 21 24 79 93 85 94 87 6 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.328</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">259</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">22.25 10.90 8.08 4.22 3.78 3.76 3.76 3.75 3.68 3.67 3.20 3.19 3.18 2.22 1.54 1.53 1.53 1.53 1.20 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S S P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.493 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">22 30 26 37 67 62 34 29 61 27 60 25 106 28 97 54 43 35 38 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O H O O O O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.327</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">260</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">13.64 11.97 9.54 4.98 4.90 4.54 4.50 4.13 4.11 4.05 3.75 3.70 2.18 1.83 1.82 1.76 1.50 1.49 1.43 1.36 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S P:z S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.493 -24.020 -24.020 2.188 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 2.00 2.00 0.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">93 21 85 24 79 87 94 74 76 86 75 91 73 51 95 107 56 81 105 23 82 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O H O O P O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.320</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">261</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">56.76 8.16 3.53 3.26 3.11 2.02 1.94 1.93 1.73 1.72 1.46 1.45 1.16 1.16 1.10 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S P:z S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -6.493 -24.020 -24.020 -24.020 -9.089 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 1.00 2.00 2.00 2.00 1.33 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">22 106 37 30 28 22 60 25 33 66 98 36 61 27 62 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O H O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.310</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">262</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">66.22 9.42 2.62 2.50 2.17 1.72 1.45 1.45 1.24 1.24 1.23 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">S S S S P:z S S S S P:z S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-24.020 -6.493 -24.020 -24.020 -9.089 -24.020 -24.020 -24.020 -24.020 11.031 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">2.00 1.00 2.00 2.00 1.33 2.00 2.00 2.00 2.00 0.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">21 107 86 73 21 93 99 77 75 107 91 83 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O H O O O O O O O H O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.180</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">263</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">12.81 11.75 11.44 11.34 3.67 3.65 3.50 3.50 3.50 3.48 3.06 3.05 1.75 1.74 1.69 1.69 1.69 1.69 1.24 1.24 1.23</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">S S S S S S S S S S S S S S S S S S P:x S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">37 26 30 28 66 33 34 67 65 32 62 29 97 35 54 41 43 45 104 98 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O P O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.178</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">264</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">12.60 11.89 11.53 11.31 3.68 3.63 3.60 3.52 3.52 3.46 3.03 2.95 1.74 1.74 1.73 1.72 1.65 1.65 1.28 1.27 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">S S S S S S S S S S S S S S S S S S S S P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">86 85 73 93 94 53 87 77 80 99 79 24 81 56 95 51 57 82 59 83 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.104</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">265</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">14.86 14.79 6.45 6.44 5.34 5.32 4.82 4.80 4.12 4.09 2.89 2.86 2.71 2.69 2.35 2.33</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">25 60 61 27 36 98 41 45 33 66 29 62 54 43 97 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.101</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">266</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">14.86 14.20 6.96 6.61 5.32 4.97 4.93 4.59 4.08 3.91 2.98 2.91 2.75 2.75 2.55 2.34</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">75 91 74 76 83 59 82 57 77 99 56 79 24 81 51 95</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.092</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">267</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">6.62 6.57 5.46 5.44 4.53 4.49 3.98 3.97 3.93 3.92 3.60 3.60 2.69 2.62 2.55 2.49 1.97 1.94 1.70 1.64 1.26 1.13 1.09 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">60 25 45 41 98 36 97 35 27 61 43 54 67 34 32 65 29 62 66 33 91 75 22 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.090</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">268</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">6.88 6.34 5.58 5.31 4.62 4.35 4.11 4.10 3.93 3.82 3.78 3.59 2.57 2.55 2.53 2.42 2.00 1.94 1.90 1.72 1.24 1.23</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">91 75 57 82 59 83 76 95 51 74 81 56 94 80 87 53 24 79 99 77 60 25</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.056</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">269</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">11.98 11.88 11.57 11.49 10.96 10.91 9.93 9.85 3.65 3.64</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">34 67 65 32 62 29 33 66 1 14</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-23.054</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">270</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">12.05 11.89 11.45 11.44 10.95 10.84 10.00 9.96 3.64 3.64</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">87 94 53 80 24 79 77 99 11 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.893</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">271</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">9.39 9.35 7.23 7.23 4.63 4.61 3.35 3.34 3.07 3.06 2.97 2.97 2.34 2.32 2.31 2.30 1.37 1.36 1.10 1.09 1.05 1.05 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">76 74 61 27 91 75 25 60 81 56 95 51 97 35 54 43 57 82 83 59 53 80 94 87</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.892</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">272</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">9.54 9.54 7.09 7.07 4.45 4.42 3.51 3.50 3.08 3.07 3.04 3.04 2.32 2.31 2.25 2.25 1.27 1.27 1.11 1.10 1.09 1.08 1.06 1.05 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">27 61 76 74 25 60 91 75 97 35 43 54 81 56 95 51 41 45 32 65 36 98 34 67 57 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.787</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">273</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">8.10 8.05 7.95 7.93 6.29 6.26 4.34 4.32 4.32 4.31 4.21 4.03 2.11 2.09 2.08 2.07 2.06 2.05 1.48 1.47 1.26 1.24 1.10 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">27 61 60 25 28 26 43 54 97 35 37 30 66 33 45 41 62 29 98 36 67 34 65 32</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.786</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">274</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">7.99 7.98 7.98 7.94 6.38 5.79 4.81 4.79 4.65 3.95 3.74 3.71 2.56 2.55 2.18 2.16 1.86 1.86 1.40 1.39 1.22 1.21 1.07 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">91 75 74 76 85 73 56 81 86 93 51 95 57 82 99 77 24 79 87 94 83 59 80 53</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.752</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">275</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">7.70 7.70 7.50 7.49 5.89 5.87 5.52 5.49 3.35 3.33 3.19 3.17 2.89 2.88 2.39 2.39 1.66 1.43 1.43</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">45 41 98 36 97 35 54 43 83 59 82 57 95 51 81 56 26 28 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.747</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">276</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">7.50 7.46 7.20 7.16 6.57 6.56 5.46 5.46 3.45 3.45 3.39 3.38 2.70 2.68 2.49 2.48 1.76 1.48 1.40</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">83 59 82 57 95 51 81 56 45 41 98 36 97 35 54 43 73 93 85</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.661</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">277</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">10.23 10.21 9.69 9.69 8.45 8.45 8.03 8.02 1.84 1.83 1.80 1.79 1.54 1.53 1.41 1.40 1.28 1.27 1.23 1.22 1.16 1.15 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">62 29 66 33 32 65 67 34 45 41 69 44 36 98 49 71 31 64 42 68 43 54 35 97</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.659</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">278</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">10.32 10.27 9.53 9.43 8.75 8.72 8.05 7.98 1.72 1.72 1.69 1.69 1.35 1.35 1.35 1.35 1.34 1.33 1.32 1.29 1.25 1.24 1.14 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">79 24 77 99 53 80 94 87 84 89 82 57 48 50 83 92 55 59 56 81 88 78 51 95</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.645</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">279</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">17.49 16.91 15.44 14.23 5.30 5.27 1.42 1.42 1.41 1.40 1.17 1.16 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">28 30 37 26 70 47 65 29 32 62 54 43 66</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.643</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">280</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">17.98 17.03 15.01 14.15 5.27 5.24 1.53 1.48 1.47 1.42 1.16 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">73 93 86 85 58 63 79 53 24 80 56 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.588</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">281</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">10.52 10.48 9.82 9.80 8.95 8.92 8.71 8.67 2.16 2.14 2.11 2.09 1.31 1.30</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">33 66 62 29 67 34 32 65 36 98 43 54 97 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.586</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">282</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">10.81 10.61 9.72 9.44 9.35 9.13 8.65 8.38 2.09 2.08 1.98 1.98 1.36 1.28 1.12 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">77 99 24 79 94 87 80 53 81 83 59 56 51 95 57 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.573</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">283</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">9.26 7.74 7.25 5.49 4.35 4.23 4.12 4.09 4.06 4.00 3.33 3.29 3.27 3.13 3.03 2.98 2.87 2.83 2.74 2.63 1.45 1.37 1.36 1.35 1.06 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">S S S S S S S S S S S S S S S S S S S S S S D:xz D:xz S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">26 37 28 30 65 32 66 33 67 34 97 29 62 35 54 45 98 43 41 36 69 44 14 1 71 68 49</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.571</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">284</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">9.43 8.05 6.91 5.32 4.34 4.28 4.25 4.20 3.95 3.90 3.30 3.20 3.13 3.12 2.99 2.98 2.96 2.95 2.73 2.71 1.39 1.39 1.35 1.35 1.06 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">S S S S S S S S S S S S S S S S S S S S S S D:xz D:xz S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">85 86 73 93 53 99 87 80 77 94 79 95 24 82 51 59 57 83 81 56 84 89 11 6 55 50 78</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.562</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">285</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">13.34 13.16 11.71 11.53 7.38 7.21 6.48 6.34 2.27 2.21 1.71 1.65 1.47 1.42 1.32 1.22 1.09 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">S S S S S S S S S S D:yz D:yz S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.613 -6.613 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">41 45 36 98 35 97 43 54 44 69 101 100 49 71 34 67 31 64</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O O O O O O Tc Tc O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.559</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">286</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">13.03 12.93 11.53 11.44 7.58 7.53 6.76 6.73 2.36 2.30 1.70 1.67 1.49 1.45 1.12 1.11 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">S S S S S S S S S S D:yz D:yz S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.613 -6.613 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">57 82 59 83 51 95 56 81 89 84 103 102 55 50 48 92 94</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O O O O O O O Tc Tc O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.469</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">287</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">45.09 42.61 2.54 2.40</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">70 47 14 1</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.467</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">288</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="4">45.27 42.45 2.55 2.38</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="4">1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="4">S S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="4"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="4">2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="4">58 63 11 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="4">O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.457</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">289</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">39.95 37.46 2.61 2.45 1.91 1.80 1.38 1.24</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">S S D:x2-y2 D:x2-y2 S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -4.498 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">2.00 2.00 0.80 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">47 70 1 14 26 28 37 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.455</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">290</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">40.18 37.33 2.62 2.44 1.89 1.81 1.38 1.27</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">S S D:x2-y2 D:x2-y2 S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-24.020 -24.020 -4.498 -4.498 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">2.00 2.00 0.80 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">63 58 6 11 85 73 86 93</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.396</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">291</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">22.48 14.14 8.37 6.65 5.01 4.19 4.14 3.80 3.31 2.87 2.87 2.81 1.60 1.40 1.28 1.12 1.07 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">S S S S S S S S S S S S D:yz S S S D:yz S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020 -24.020 -4.498 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 2.00 2.00 2.00 0.80 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">69 44 28 30 37 43 26 35 54 97 45 41 15 31 36 98 2 64</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O O O O O O O O W O O O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.394</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">292</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">36.74 30.06 3.14 2.62 2.32 2.13 2.02 1.89 1.87 1.68 1.59 1.54 1.32 1.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">S S S S S D:yz S S S D:yz S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">2.00 2.00 2.00 2.00 2.00 0.80 2.00 2.00 2.00 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">44 69 97 54 65 2 35 32 29 15 43 62 64 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O O W O O O W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.394</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">293</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">16.42 13.07 8.64 6.93 5.92 4.64 4.39 4.00 3.96 3.56 3.47 3.42 1.70 1.68 1.61 1.50 1.26 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">S S S S S S S S S S S S S S S S D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">89 84 73 93 86 85 81 95 56 51 57 82 92 83 59 48 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.390</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">294</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">31.64 29.59 3.38 2.87 2.74 2.46 2.28 2.24 2.06 1.94 1.94 1.89 1.74 1.63 1.54 1.35 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">S S S S S S S S S S S D:yz D:yz S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">84 89 51 56 95 53 81 80 79 48 24 20 10 92 88 78 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.376</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">295</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">20.98 20.05 7.04 6.98 5.76 2.86 2.82 2.75 2.64 2.52 2.46 1.87 1.49 1.38 1.37 1.25 1.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">44 69 49 71 37 98 42 36 35 68 97 26 45 41 43 54 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.373</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">296</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">23.30 21.93 5.07 4.67 4.08 3.83 3.33 3.28 2.12 2.08 1.87 1.86 1.85 1.84 1.84 1.83 1.42 1.41 1.38 1.31</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">49 71 31 64 44 69 42 68 43 54 34 33 97 35 67 66 36 98 5 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.372</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">297</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">25.58 21.06 9.61 4.85 3.82 3.21 2.85 2.38 1.96 1.92 1.67 1.55 1.36 1.29 1.18 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S S D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">89 84 55 86 50 78 59 95 83 88 92 51 57 85 81 10</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.370</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">298</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">23.39 19.56 9.82 5.55 4.29 3.71 3.45 2.20 2.12 1.91 1.78 1.77 1.62 1.58 1.39 1.37 1.29 1.18 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">S S S S S S S S S S S S S S D:yz S S S D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020 -24.020 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 2.00 2.00 2.00 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">50 55 84 48 92 89 88 83 78 56 77 51 94 87 12 99 81 59 7</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O W O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.351</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">299</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">32.45 25.97 9.76 7.61 2.01 1.84 1.56 1.51 1.44 1.42 1.35 1.15</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S D:yz S D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 2.00 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">71 49 31 64 45 69 44 42 41 18 30 5</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.351</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">300</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">20.54 15.34 10.36 8.72 8.03 7.12 4.79 3.98 3.52 3.06 2.51 1.85</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">49 71 64 31 68 42 41 45 36 98 44 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.349</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">301</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">41.97 18.44 10.98 3.72 3.45 3.45 3.03 1.77 1.27 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">S S S S S S S D:yz S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">55 92 50 57 78 89 48 7 59 93</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O O O W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.348</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">302</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">36.60 17.90 7.10 5.50 4.08 3.83 3.70 3.16 2.95 2.07 2.03 1.42</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">50 48 88 82 78 55 84 83 92 59 57 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.328</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">303</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="11">25.14 18.28 16.77 12.04 1.63 1.57 1.29 1.21 1.13 1.13 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="11">1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="11">S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="11"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="11">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="11">42 68 31 64 60 25 26 71 98 49 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="11">O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.327</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">304</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="11">25.04 18.83 16.83 12.29 2.21 2.06 1.24 1.21 1.10 1.06 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="11">1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="11">S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="11"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="11">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="11">78 88 92 48 50 55 91 75 59 83 85</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="11">O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.323</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">305</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">22.56 18.63 16.41 15.32 4.34 3.45 3.27 2.65</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">68 64 42 31 88 78 48 92</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.323</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">306</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">23.03 17.97 17.85 13.82 4.26 3.58 3.04 2.88</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">88 78 48 92 68 64 42 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.314</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">307</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">12.56 11.34 6.90 6.29 4.68 4.66 3.44 3.40 2.60 2.57 2.55 2.49 2.45 2.41 2.41 2.30 1.26 1.23 1.23 1.20 1.14 1.10 1.09 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">64 31 42 68 48 92 88 78 35 71 97 45 49 43 41 54 50 55 57 82 81 56 95 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.314</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">308</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">9.99 9.96 7.98 7.89 5.33 4.84 3.35 3.09 2.82 2.76 2.75 2.67 2.58 2.49 2.48 2.39 1.19 1.17 1.17 1.12 1.11 1.11 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">48 92 88 78 64 31 42 68 50 55 57 82 81 56 95 51 35 97 71 45 43 49 41 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.308</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">309</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">10.29 7.76 7.58 7.57 7.16 5.86 5.63 5.60 5.60 5.33 4.40 4.36 3.87 3.84 1.81 1.80 1.15 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">30 26 29 62 28 68 42 32 65 37 34 67 33 66 98 36 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.306</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">310</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">10.69 8.07 7.97 7.96 7.75 6.01 5.99 5.18 4.56 4.56 4.51 4.23 3.94 3.90 1.71 1.70 1.04 1.04 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">93 85 79 24 73 80 53 86 87 88 94 78 77 99 59 83 89 84 56 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.270</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">311</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">10.03 9.85 9.80 9.69 6.90 6.62 5.64 5.60 4.90 4.72 3.59 3.39 1.37 1.30 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">S S S S S S S S S S S S S S D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">51 95 81 56 88 78 48 92 57 82 83 59 50 55 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">O O O O O O O O O O O O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.269</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">312</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">10.53 10.25 10.18 9.92 6.91 6.58 5.96 5.91 4.55 4.20 3.44 3.06 1.16 1.12 1.04 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S S S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">97 35 43 54 68 42 64 31 45 41 36 98 49 71 17 4</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.266</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">313</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">12.30 12.25 8.16 8.15 6.95 6.60 4.54 4.20 2.77 2.75 1.97 1.96 1.68 1.56 1.48 1.28 1.23 1.20 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">25 60 61 27 98 36 41 45 75 91 76 74 59 83 35 39 42 97 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.260</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">314</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">12.44 12.39 8.52 8.50 7.17 6.96 4.46 4.29 2.96 2.96 1.89 1.88 1.72 1.62 1.59 1.57 1.20 1.17 1.13 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">75 91 76 74 59 83 82 57 25 60 61 27 95 98 36 51 41 45 78 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.254</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">315</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">10.89 10.48 8.78 8.75 8.46 8.34 8.32 6.80 6.66 6.65 5.91 5.90</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">37 26 33 66 30 34 67 28 29 62 32 65</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.252</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">316</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">11.00 10.74 8.90 8.89 8.50 8.44 8.24 6.66 6.52 6.51 5.82 5.79</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">86 85 99 77 87 94 93 73 24 79 80 53</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.100</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">317</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">17.15 17.11 11.93 11.90 10.57 10.57 4.32 4.31 1.87 1.87 1.16 1.15 1.15 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">S S S S S S S S S S S S D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">60 25 98 36 41 45 61 27 35 97 54 43 100 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O O O O O O O O O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.094</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">318</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">16.75 16.67 11.87 11.87 10.07 10.00 4.81 4.76 2.23 2.19 1.34 1.33 1.18 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">S S S S S S S S S S S S D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">75 91 83 59 82 57 76 74 95 51 81 56 102 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O O O O O O O O O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.008</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">319</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">11.92 11.89 7.57 7.53 6.41 6.37 3.88 3.80 3.40 3.35 3.25 3.24 3.21 3.16 2.08 2.08 1.68 1.68 1.49</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">76 74 81 56 95 51 59 83 91 75 61 27 57 82 54 43 97 35 39</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-22.007</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">320</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">12.50 12.45 7.83 7.81 6.72 6.71 3.55 3.54 3.42 3.41 3.06 3.05 2.93 2.91 2.11 2.10 1.92 1.91 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">61 27 54 43 97 35 36 98 76 74 25 60 41 45 81 56 95 51 59 83</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-21.957</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">321</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="3">91.91 1.19 1.15</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="3">1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="3">S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="3"
                               units="nonsi:electronvolt">-24.020 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="3">2.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="3">39 103 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="3">O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-21.937</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">322</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">15.90 15.75 12.46 12.36 11.33 11.25 3.57 3.56 2.63 2.62 2.59 2.58</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">74 76 56 81 51 95 83 59 82 57 75 91</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-21.935</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">323</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">16.28 16.23 12.85 12.80 11.47 11.41 3.16 3.15 2.37 2.36 2.24 2.23</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">27 61 43 54 35 97 98 36 45 41 60 25</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-14.658</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">324</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">5.61 5.36 4.93 4.91 4.67 4.66 4.41 4.38 4.07 4.05 3.85 3.63 2.61 2.61 2.58 2.51 2.42 2.27 2.26 2.23 2.16 2.16 2.13 2.08 2.01 1.88 1.86 1.83</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 2 1 1 1 1 2 3 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x S P:y P:y P:x P:x S S P:y P:y P:x S S S S S P:z P:z P:z P:z S S S S P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -13.975 -9.089 -9.089 -9.089 -9.089 -13.975 3.091 -9.089 -9.089 -9.089 3.091 -24.020 -24.020 -24.020 -24.020 -9.089 -9.089 -9.089 -9.089 -24.020 -24.020 -24.020 -24.020 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 2.00 1.33 1.33 1.33 1.33 2.00 0.00 1.33 1.33 1.33 0.00 2.00 2.00 2.00 2.00 1.33 1.33 1.33 1.33 2.00 2.00 2.00 2.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">40 104 52 46 38 96 105 104 72 90 23 105 52 46 38 40 40 46 52 38 90 72 23 96 96 90 72 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O P O O O O P P O O O P O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-14.657</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">325</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">5.65 5.39 4.94 4.91 4.64 4.62 4.47 4.35 4.08 4.06 3.83 3.58 2.62 2.62 2.58 2.52 2.44 2.28 2.25 2.22 2.16 2.16 2.13 2.08 2.01 1.88 1.87 1.84</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 2 1 1 1 1 2 3 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x S P:y P:y P:x P:x S S P:y P:y P:x S S S S S P:z P:z P:z P:z S S S S P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -13.975 -9.089 -9.089 -9.089 -9.089 -13.975 3.091 -9.089 -9.089 -9.089 3.091 -24.020 -24.020 -24.020 -24.020 -9.089 -9.089 -9.089 -9.089 -24.020 -24.020 -24.020 -24.020 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 2.00 1.33 1.33 1.33 1.33 2.00 0.00 1.33 1.33 1.33 0.00 2.00 2.00 2.00 2.00 1.33 1.33 1.33 1.33 2.00 2.00 2.00 2.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">96 105 72 90 40 23 104 105 52 46 38 104 90 72 23 96 96 90 72 23 52 46 38 40 40 46 52 38</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O P O O O O P P O O O P O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.485</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">326</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">20.69 13.06 11.53 7.66 4.40 4.39 2.94 2.57 2.56 2.46 2.46 1.61 1.25 1.20 1.20 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 2 1 1 3 1 1 1 1 2 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:x P:z P:z P:x P:x P:x P:x P:y P:y P:x S P:z P:z D:yz D:yz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -5.506 -9.089 -9.089 2.188 -9.089 -9.089 -9.089 -24.020 -5.506 -9.089 -4.498 -4.498 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.00 1.33 1.33 0.00 1.33 1.33 1.33 2.00 1.00 1.33 0.80 0.80 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">40 40 38 104 52 46 104 52 46 38 40 104 28 15 2 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O P O O P O O O O P O W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.481</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">327</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">20.67 13.23 11.59 7.75 4.44 4.43 2.92 2.55 2.55 2.50 2.47 1.58 1.26 1.21 1.20 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 2 1 1 3 1 1 1 1 2 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:x P:z P:z P:x P:x P:x P:x P:y P:y P:x S P:z P:z D:yz D:yz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -5.506 -9.089 -9.089 2.188 -9.089 -9.089 -9.089 -24.020 -5.506 -9.089 -4.498 -4.498 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.00 1.33 1.33 0.00 1.33 1.33 1.33 2.00 1.00 1.33 0.80 0.80 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">96 96 23 105 90 72 105 90 72 23 96 105 73 20 10 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O P O O P O O O O P O W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.409</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">328</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">13.98 13.93 10.27 10.25 9.71 5.17 5.06 2.55 1.90 1.90 1.51 1.51 1.22 1.22 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 2 1 1 3 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:z P:z P:y P:y P:y P:y P:y P:y S S D:yz D:yz P:z P:z D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 2.188 -24.020 -24.020 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.00 2.00 2.00 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">46 52 52 46 104 40 38 104 46 52 1 14 27 61 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O P O O P O O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.408</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">329</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">14.01 13.91 10.35 10.17 9.71 5.18 5.05 2.55 1.91 1.90 1.51 1.50 1.22 1.22 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 2 1 1 3 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:z P:z P:y P:y P:y P:y P:y P:y S S D:yz D:yz P:z P:z D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 2.188 -24.020 -24.020 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.00 2.00 2.00 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">90 72 72 90 105 96 23 105 72 90 11 6 76 74 13 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O P O O P O O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.375</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">330</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">13.54 8.17 8.15 7.86 5.30 4.81 4.78 3.42 3.12 2.51 2.08 1.61 1.41 1.40</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 2 1 1 1 2 1 1 3 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">P:x P:y P:y P:x P:z P:y P:y P:x P:z P:z P:x P:z S P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 2.188 -24.020 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 0.00 2.00 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">38 52 46 23 104 90 72 40 105 38 96 104 38 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O P O O O P O O P O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.365</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">331</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">13.55 8.15 8.11 7.93 5.27 4.72 4.70 3.42 3.05 2.66 1.93 1.62 1.61 1.46</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 2 1 1 1 2 1 1 1 3 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">P:x P:y P:y P:x P:z P:y P:y P:x P:z P:z P:x P:z P:z S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 -9.089 -5.506 -9.089 -9.089 -9.089 2.188 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 0.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">23 90 72 38 105 52 46 96 104 23 40 38 105 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O P O O O P O O O P O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.077</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">332</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">5.90 5.90 4.81 4.55 4.50 4.34 3.27 3.26 2.85 2.84 2.00 1.99 1.87 1.86 1.78 1.77 1.71 1.71 1.63 1.63 1.59 1.59 1.51 1.50 1.48 1.47 1.43 1.43 1.34 1.34 1.33 1.33 1.12 1.11 1.07 1.06 1.05 1.04 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">D:xz D:xz P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x D:yz D:yz P:x P:x D:yz D:yz P:y P:y P:y P:y D:xz D:xz P:x P:x P:x P:x P:y P:y D:x2-y2 D:x2-y2 D:x2-y2 P:y D:x2-y2 P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">1 14 28 30 26 37 32 65 34 67 62 29 66 33 67 34 2 15 32 65 5 18 65 32 67 34 1 14 66 33 29 62 29 62 3 16 4 33 17 66</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">W W O O O O O O O O O O O O O O W W O O W W O O O O W W O O O O O O W W W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.075</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">333</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">5.92 5.89 4.82 4.62 4.44 4.33 3.29 3.26 2.83 2.80 2.02 2.01 1.87 1.86 1.76 1.75 1.71 1.71 1.66 1.65 1.57 1.57 1.53 1.51 1.46 1.45 1.44 1.43 1.35 1.35 1.32 1.32 1.14 1.12 1.08 1.07 1.05 1.04 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">D:xz D:xz P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x D:yz D:yz P:x P:x D:yz D:yz P:y P:y P:y P:y D:xz D:xz P:x P:x P:x P:x P:y P:y D:x2-y2 D:x2-y2 D:x2-y2 P:y D:x2-y2 P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">6 11 73 93 85 86 53 80 94 87 79 24 77 99 94 87 10 20 53 80 7 12 80 53 87 94 6 11 79 24 99 77 24 79 9 19 8 99 13 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">W W O O O O O O O O O O O O O O W W O O W W O O O O W W O O O O O O W W W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.014</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">334</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">5.99 5.79 4.79 4.61 3.11 3.10 3.04 3.04 2.70 2.70 2.66 2.65 1.88 1.88 1.81 1.79 1.74 1.74 1.69 1.68 1.52 1.52 1.46 1.46 1.45 1.45 1.38 1.38 1.23 1.22 1.22 1.22 1.20 1.19 1.17 1.16 1.14 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:y P:y P:x P:x P:y P:y D:yz D:yz D:yz D:yz P:x P:x P:x P:x P:y P:x P:x P:y D:x2-y2 D:x2-y2 P:y P:y D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">37 30 26 28 32 65 67 34 62 29 66 33 1 14 67 34 67 34 65 32 18 5 2 15 65 32 66 33 33 29 62 66 4 17 29 62 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O W W O O O O O O W W W W O O O O O O O O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-12.012</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">335</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">6.07 5.79 4.80 4.54 3.08 3.07 3.06 3.04 2.69 2.69 2.68 2.68 1.89 1.88 1.81 1.80 1.74 1.74 1.67 1.66 1.53 1.53 1.44 1.44 1.44 1.43 1.39 1.38 1.25 1.23 1.22 1.22 1.22 1.21 1.17 1.15 1.13 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:y P:y P:x P:x P:y P:y D:yz D:yz D:yz D:yz P:x P:x P:x P:x P:y P:y P:x D:x2-y2 P:x D:x2-y2 P:y P:y D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">86 93 85 73 53 94 80 87 79 77 24 99 6 11 87 94 94 87 80 53 7 12 10 20 53 80 99 77 99 77 79 8 24 13 24 79 9 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O W W O O O O O O W W W W O O O O O O O W O W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.597</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">336</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">10.47 10.35 3.11 3.05 2.15 2.13 2.01 2.00 1.99 1.98 1.85 1.83 1.56 1.54 1.40 1.38 1.23 1.21 1.19 1.18 1.15 1.13 1.11 1.08 1.05 1.04 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x P:x P:x P:x P:z P:z D:x2-y2 P:z D:x2-y2 P:z D:x2-y2 D:x2-y2 P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:y P:y D:xz D:xz P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">25 60 61 27 41 45 2 36 15 98 5 18 54 43 97 35 41 45 36 98 36 98 41 45 5 18 91 75</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O W O W O W W O O O O O O O O O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.591</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">337</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">10.26 10.23 3.23 3.22 2.14 2.14 1.99 1.98 1.94 1.93 1.83 1.83 1.61 1.61 1.45 1.44 1.19 1.19 1.13 1.13 1.11 1.09 1.09 1.07 1.03 1.02 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x P:x P:x P:x P:z P:z P:z P:z D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:y P:y P:x D:xz D:xz P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">91 75 76 74 82 57 83 59 10 20 7 12 56 81 51 95 57 82 59 83 57 59 82 83 25 7 12 60</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O W W W W O O O O O O O O O O O O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.583</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">338</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">8.26 8.10 4.62 4.49 3.91 3.87 2.08 2.04 1.95 1.91 1.91 1.88 1.67 1.65 1.46 1.43 1.37 1.35 1.21 1.19 1.09 1.09 1.08 1.07 1.07 1.07 1.07 1.07 1.06 1.06 1.05 1.05 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:x P:x D:yz D:yz P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x D:xz D:xz D:xz D:xz P:y P:x P:x P:x P:y P:x P:x P:y P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">60 25 101 100 27 61 45 41 98 36 43 54 35 97 15 2 18 5 45 41 4 3 17 16 45 91 35 75 41 97 98 98 36 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O Tc Tc O O O O O O O O O O W W W W O O W W W W O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.580</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">339</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">8.02 7.97 4.57 4.51 4.04 4.03 2.06 2.03 1.97 1.95 1.91 1.89 1.72 1.70 1.40 1.40 1.32 1.31 1.19 1.19 1.12 1.12 1.11 1.10 1.10 1.09 1.09 1.08 1.07 1.07 1.02 1.02 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:x P:x D:yz D:yz P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x D:xz D:xz D:xz P:x D:xz P:x P:x P:x P:y P:y P:y P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">75 91 103 102 74 76 82 57 56 81 83 59 51 95 20 10 12 7 82 57 8 13 9 60 19 51 95 25 57 82 59 83 83</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O O Tc Tc O O O O O O O O O O W W W W O O W W W O W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.383</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">340</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">8.19 8.17 4.88 4.85 3.48 3.47 2.75 2.73 2.61 2.60 2.44 2.44 2.38 2.36 1.94 1.94 1.84 1.84 1.75 1.73 1.61 1.61 1.61 1.60 1.50 1.50 1.20 1.20 1.13 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 1 2 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:xz D:xz P:z P:z P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:z P:z P:x P:x P:y P:y P:x D:xz P:x D:xz P:y P:y P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 4.055 -9.089 4.055 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 0.00 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">1 14 32 65 34 67 62 29 32 65 67 34 65 32 66 33 62 29 67 34 33 1 66 14 29 62 61 27 33 66</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W O O O O O O O O O O O O O O O O O O O W O W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.382</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">341</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">8.14 8.13 5.00 4.93 3.37 3.31 2.85 2.80 2.64 2.63 2.43 2.41 2.39 2.37 1.88 1.88 1.86 1.84 1.67 1.66 1.59 1.59 1.56 1.54 1.54 1.53 1.27 1.27 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:xz D:xz P:z P:z P:z P:z P:z P:z P:x P:x P:y P:y P:x P:x P:z P:x P:x P:z P:y P:y D:xz D:xz P:x P:x P:y P:y P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">6 11 53 80 94 87 79 24 53 80 80 53 94 87 77 79 24 99 87 94 6 11 77 99 24 79 76 74 77 99</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W O O O O O O O O O O O O O O O O O O W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.292</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">342</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.95 4.94 4.32 4.30 4.08 4.03 3.93 3.89 3.71 3.71 3.18 3.15 2.64 2.64 2.07 2.06 1.53 1.51 1.33 1.32 1.30 1.29 1.15 1.15</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:y P:y P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">67 34 33 66 32 65 62 29 1 14 67 34 65 32 67 34 33 66 32 65 33 66 62 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O W W O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.289</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">343</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">5.22 5.04 4.52 4.39 3.93 3.89 3.80 3.80 3.72 3.71 3.29 3.26 2.54 2.53 2.19 2.12 1.58 1.54 1.38 1.33 1.25 1.24 1.10 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:z P:z P:z P:z D:x2-y2 D:x2-y2 P:y P:y P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">94 87 77 99 53 80 24 79 6 11 94 87 80 53 94 87 77 99 77 99 53 80 24 79</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O W W O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.261</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">344</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">14.04 10.40 7.76 5.39 2.37 2.35 2.32 2.27 1.90 1.90 1.89 1.88 1.85 1.82 1.68 1.65 1.60 1.56 1.40 1.39 1.34 1.33 1.06 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:z P:z D:x2-y2 D:x2-y2 D:yz D:yz P:z P:z P:z P:z P:z P:z D:yz D:yz D:yz D:yz D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">30 37 28 26 3 16 65 32 17 4 15 2 29 62 34 67 66 33 16 3 5 18 17 4</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O W W O O W W W W O O O O O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.260</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">345</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">13.34 11.05 7.36 5.76 2.27 2.25 2.20 2.18 2.01 1.96 1.82 1.80 1.80 1.79 1.77 1.72 1.66 1.58 1.43 1.41 1.33 1.31 1.11 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:z P:z D:x2-y2 D:x2-y2 P:z P:z D:yz D:yz P:z P:z P:z P:z D:yz D:yz D:yz D:yz D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">93 86 73 85 9 19 53 80 8 13 87 79 10 20 24 94 99 77 12 7 19 9 13 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O W W O O W W O O W W O O O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.230</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">346</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">15.14 11.61 9.22 7.34 2.02 2.02 2.01 2.00 1.65 1.65 1.60 1.60 1.57 1.57 1.51 1.49 1.10 1.09 1.08 1.07 1.04 1.03 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:y P:y P:z D:yz D:yz P:z D:x2-y2 D:x2-y2 P:z P:z D:yz D:yz D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2 P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">37 30 26 28 34 5 18 67 4 17 32 65 2 15 17 4 16 3 3 16 34 67 66 33</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O W W O W W O O W W W W W W W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.229</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">347</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">14.35 12.34 8.79 7.80 1.96 1.92 1.90 1.88 1.75 1.70 1.68 1.67 1.59 1.54 1.43 1.43 1.16 1.16 1.16 1.13 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:y P:y P:y P:y P:z D:yz D:yz P:z P:z P:z D:yz D:yz D:x2-y2 D:x2-y2 D:yz D:yz D:yz D:x2-y2 D:yz D:x2-y2 P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">86 93 85 73 87 12 7 94 80 53 20 10 8 13 8 13 19 9 9 19 87</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O W W O O O W W W W W W W W W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.104</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">348</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">6.00 5.93 5.54 5.46 3.10 3.06 2.96 2.92 1.88 1.87 1.73 1.72 1.62 1.61 1.46 1.44</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:z P:z D:xz D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">61 27 25 60 76 74 91 75 54 43 97 35 17 4 16 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.104</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">349</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">5.89 5.83 5.67 5.60 3.14 3.11 2.92 2.88 1.87 1.86 1.67 1.66 1.60 1.59 1.42 1.41</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:z P:z D:xz D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">76 74 91 75 61 27 25 60 81 56 95 51 13 8 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.079</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">350</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">8.10 8.02 7.38 7.32 2.25 2.22 1.86 1.84 1.74 1.72 1.64 1.61 1.55 1.53 1.49 1.46 1.09 1.09 1.08 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:x P:x P:x P:x P:x P:x P:x P:x D:xz D:xz P:z P:z D:xz D:xz P:z P:z P:y P:y P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">74 76 75 91 27 61 60 25 8 13 56 81 9 19 51 95 81 56 21 56 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O W W O O W W O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-11.078</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">351</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">8.44 8.34 7.05 6.98 2.16 2.14 1.99 1.97 1.79 1.76 1.70 1.69 1.67 1.67 1.66 1.64 1.17 1.17 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:x P:x P:x P:x P:x P:x P:x P:x D:xz D:xz P:z D:xz P:z D:xz P:z P:z P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">27 61 60 25 74 76 75 91 4 17 43 3 35 16 54 97 35 97 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O W W O W O W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.842</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">352</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">10.67 5.03 4.52 3.35 2.78 2.00 1.90 1.90 1.68 1.52 1.51 1.45 1.45 1.44 1.43 1.33 1.33 1.28 1.28 1.25 1.25 1.24 1.24 1.16 1.16 1.12 1.12 1.11 1.10 1.09 1.08 1.08 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:z P:x P:z S D:z2 D:x2-y2 D:z2 D:z2 P:z P:z P:z P:y P:y P:y P:y S P:x P:z D:xz P:x P:x P:z P:z P:x P:x D:z2 D:z2 P:z P:y P:y D:xz D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -6.493 -6.613 -6.613 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -24.020 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.33 1.33 1.00 1.00 1.00 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 2.00 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">22 22 40 106 100 100 1 14 28 60 25 54 43 45 41 22 40 38 100 67 34 65 32 65 32 2 15 26 98 36 15 2 18 5</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O O H Tc Tc W W O O O O O O O O O O Tc O O O O O O W W O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.832</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">353</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">15.46 4.63 4.24 3.65 3.54 2.83 2.51 2.26 1.73 1.72 1.63 1.51 1.47 1.46 1.31 1.31 1.27 1.27 1.27 1.20 1.20 1.13 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:x S D:z2 P:z D:x2-y2 P:z P:x D:z2 D:z2 S P:z P:z P:z P:x P:x P:z P:y P:y P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.493 -6.613 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -24.020 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.00 1.00 1.33 1.00 1.33 1.33 0.80 0.80 2.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">21 21 107 102 96 102 23 96 6 11 21 73 91 75 53 80 85 95 51 83 59 94 87</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O H Tc O Tc O O W W O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.798</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">354</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">12.44 3.46 3.17 2.90 2.66 2.55 2.54 2.48 2.48 2.26 2.26 2.22 2.16 2.15 1.98 1.95 1.95 1.93 1.93 1.93 1.92 1.91 1.86 1.85 1.33 1.19 1.13 1.12 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:z P:x S D:x2-y2 P:z P:y P:y D:z2 D:z2 P:x P:x P:x P:x P:x P:x P:x P:x P:z P:x P:x D:xy D:xy D:xy D:xy S P:z P:y P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.493 -6.613 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -24.020 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.00 1.00 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 2.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">21 21 107 102 96 75 91 6 11 77 99 85 53 80 73 94 87 23 79 24 7 12 20 10 21 86 56 81 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O H Tc O O O W W O O O O O O O O O O O W W W W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.791</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">355</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">7.74 4.58 3.72 3.32 3.32 3.10 2.90 2.90 2.57 2.42 2.41 2.30 2.25 2.24 2.18 2.17 2.11 2.07 2.07 2.06 2.06 1.99 1.98 1.71 1.07 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:x P:y P:y P:x D:xy D:xy D:x2-y2 P:x P:x S D:z2 D:z2 P:x P:x P:x D:xy D:xy P:x P:x P:x P:x P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -6.613 -9.089 -9.089 -6.493 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.00 1.33 1.33 1.00 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">22 40 22 60 25 28 2 15 100 65 32 106 1 14 66 33 26 18 5 62 29 67 34 38 41 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O W W Tc O O H W W O O O W W O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.760</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">356</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">8.58 6.22 6.07 6.07 2.62 2.61 2.12 2.09 2.08 1.77 1.77 1.67 -1.60 1.50 1.50 1.49 1.44 1.43 1.31 1.30 1.22 1.22 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:y P:y D:x2-y2 D:x2-y2 D:yz P:y P:y P:y P:y D:yz P:y D:yz P:y P:y D:xz D:xz P:z P:z D:xz D:xz P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 10.422 -9.089 -9.089 -9.089 -9.089 -6.613 2.188 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -0.500 -0.500</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 0.80 0.80 0.00 1.33 1.33 1.33 1.33 1.00 0.00 1.00 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">40 38 52 46 14 1 104 65 32 70 47 100 104 101 67 34 18 5 60 25 2 15 14 1</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O W W P O O O O Tc P Tc O O W W O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.759</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">357</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">8.84 6.07 6.04 5.94 2.59 2.58 2.14 2.12 2.11 1.77 1.76 1.72 -1.60 1.50 1.43 1.41 1.41 1.40 1.30 1.29 1.22 1.21 1.02 1.02 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:y D:yz P:y P:y D:yz P:y D:yz P:y P:y D:xz D:xz P:z P:z D:xz D:xz P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 10.422 -9.089 -9.089 -6.613 2.188 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -0.500 -0.500</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.00 1.33 1.33 1.00 0.00 1.00 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">96 90 72 23 6 11 53 80 105 63 58 102 105 103 94 87 7 12 91 75 10 20 77 99 6 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O W W O O P O O Tc P Tc O O W W O O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.679</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">358</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">12.31 12.31 2.75 2.50 2.13 1.96 1.95 1.81 1.81 1.75 1.75 -1.68 1.46 1.43 1.40 1.38 1.32 1.32 1.31 1.31 1.07 1.07 1.06 1.04 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:z P:z D:x2-y2 P:z P:z P:x P:x P:x P:x P:z P:z P:z P:x P:x P:z P:z P:z P:z P:y P:z P:z P:y D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 2.188 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">46 52 38 40 104 27 61 34 67 32 65 104 30 37 37 30 31 64 42 68 46 25 60 52 1 14</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O P O O O O O O P O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.675</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">359</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">12.03 12.00 2.01 2.00 1.89 1.89 1.88 1.87 1.61 1.60 1.58 1.50 1.47 1.44 1.43 1.39 1.39 1.32 1.31 1.14 1.13 -1.13 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:x P:x P:x P:x P:z P:z P:x P:y P:y P:x D:x2-y2 P:z P:z P:z P:z P:z P:z D:xy D:xy P:z D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 2.188 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">72 90 87 94 53 80 74 76 86 90 72 93 105 93 86 78 88 92 48 13 8 105 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O P O O O O O O W W P W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.665</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">360</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">14.69 5.85 5.63 3.48 2.75 2.31 1.96 1.95 1.95 1.74 1.63 1.63 1.52 1.48 1.39 1.38 1.21 1.21 1.16 1.16 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:z P:z P:z S P:x P:x P:y D:x2-y2 P:y S P:x P:x P:x P:z D:xy D:xy D:xy D:xy P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -6.493 -9.089 -9.089 -9.089 -6.613 -9.089 -24.020 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 2.00 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">21 96 23 107 21 23 91 103 75 21 57 82 39 73 7 12 10 20 84 89 22</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O H O O O Tc O O O O O O W W W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.618</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">361</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">13.05 4.72 4.71 4.69 3.53 2.28 2.12 2.06 2.02 2.01 1.76 1.75 1.70 1.53 1.53 1.51 1.51 1.50 1.49 1.37</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:z P:z P:x P:x S P:z P:z P:x P:x D:x2-y2 P:x S P:x P:y P:y P:x D:xy D:xy P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.493 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -24.020 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 2.00 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">22 38 38 22 106 40 21 52 46 101 97 22 35 25 60 41 5 18 45 26</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O H O O O O Tc O O O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.600</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">362</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">5.35 4.52 2.89 2.64 2.37 2.35 2.30 2.02 1.98 1.73 1.72 1.59 1.58 1.55 1.53 1.35 1.34 1.33 1.31 1.17 1.15 1.05 1.03 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:yz D:yz P:y D:yz D:yz P:z P:z P:z P:z P:y P:y P:x P:x P:z P:z P:y P:y P:z P:z P:z P:z P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.00 1.00 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">102 103 23 100 101 56 81 51 95 81 56 56 81 83 59 95 51 82 57 43 54 38 82 57</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc O Tc Tc O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.598</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">363</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">5.62 5.05 2.56 2.51 2.50 2.21 2.20 2.10 1.77 1.76 1.73 1.67 1.66 1.56 1.55 1.55 1.55 1.37 1.36 1.36 1.36 1.23 1.12 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:yz D:yz D:yz P:z P:z P:z P:z D:yz P:y P:y P:y P:z P:z P:y P:z P:y P:z P:x P:x P:x P:x P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">100 101 102 43 54 35 97 103 54 43 38 98 36 97 45 35 41 35 97 43 54 23 56 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc Tc O O O O Tc O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.581</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">364</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">7.90 7.12 7.08 6.34 2.51 2.49 2.12 2.09 2.06 2.05 1.96 1.95 1.72 1.72 1.65 1.62 1.61 1.59 1.59 1.42 1.41 1.25 1.25 1.20 1.16 1.16 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:y P:x P:x P:y D:xy D:xy D:xy P:y P:y P:y P:y P:y P:x P:x P:y P:y P:y P:y P:y P:x P:x P:x P:x P:y P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 0.80 0.80 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">40 46 52 38 1 14 104 30 34 67 32 65 60 25 37 29 62 66 33 35 97 47 70 96 98 36 27 61</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O W W P O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.577</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">365</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">7.99 6.79 6.78 5.56 2.39 2.39 2.20 2.02 1.99 1.99 1.83 1.82 1.75 1.75 1.73 1.72 1.56 1.55 1.51 1.50 1.40 1.38 1.33 1.33 1.20 1.19 1.13 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:y P:x P:x P:y D:xy D:xy P:y D:xy P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:y P:y P:y D:yz P:x P:x P:x P:x P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 10.422 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">96 72 90 23 6 11 93 105 80 53 94 87 95 51 91 75 79 24 77 99 86 103 83 59 58 63 40 46 52</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O W W O P O O O O O O O O O O O O O Tc O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.515</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">366</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">9.35 9.32 5.38 5.16 4.36 3.16 3.15 1.97 1.81 -1.57 1.26 1.26 1.21 1.21 1.17 1.17 1.06 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 2 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:x P:x P:x P:z P:x D:xy D:xy D:xz P:z P:x P:x P:x P:x P:x P:x P:x P:x S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 10.422 -9.089 2.188 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -1.119 -6.493</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.00 1.33 0.00 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">90 72 96 21 23 6 11 105 22 105 51 95 59 83 58 63 102 107</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O W W P O P O O O O O O Tc H</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.489</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">367</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">10.13 7.55 7.53 6.66 2.67 2.66 2.55 2.42 2.38 1.79 1.79 1.64 1.45 1.43 1.42 -1.28 1.14 1.09 1.08 1.05 1.05 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 2 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:z P:x P:x P:x D:xy D:xy P:x S P:x P:x P:x D:xz S D:z2 D:z2 P:x P:x P:z P:z P:z P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -6.493 -9.089 -9.089 -9.089 10.422 -24.020 -4.498 -4.498 2.188 -1.119 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.00 1.33 1.33 1.33 0.00 2.00 0.80 0.80 0.00 0.00 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">22 46 52 40 1 14 22 106 38 43 54 104 22 4 17 104 100 33 66 32 65 47</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O W W O H O O O P O W W P Tc O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.396</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">368</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">4.74 4.73 3.92 3.91 3.65 3.65 2.18 2.16 2.07 2.05 1.95 1.95 1.63 1.62 1.48 1.48 1.19 1.10 1.09 1.08 1.08 1.06 1.05 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">D:z2 D:z2 P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:z P:z D:z2 D:z2 P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">1 14 32 65 67 34 29 62 67 34 33 66 65 32 60 25 38 54 43 16 3 33 66 97 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">W W O O O O O O O O O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.393</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">369</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">4.75 4.73 3.93 3.82 3.70 3.60 2.21 2.18 2.16 1.95 1.93 1.93 1.72 1.60 1.54 1.30 1.23 1.21 1.15 1.14 1.11 1.06 1.04 1.04 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">D:z2 D:z2 P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:x P:z D:z2 D:z2 P:x D:z2 P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">6 11 53 80 94 87 24 79 94 77 87 99 53 91 80 75 56 23 77 51 9 19 79 7 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">W W O O O O O O O O O O O O O O O O O O W W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.391</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">370</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">3.31 3.31 3.04 3.03 2.49 2.29 2.26 2.26 2.18 2.17 2.14 2.11 1.82 1.78 1.76 1.74 1.70 1.70 1.50 1.45 1.42 1.31 1.30 1.16 1.14 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:y P:y P:y P:y P:x P:x P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:z D:xy D:xy D:xy D:xy P:z P:z P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">54 43 97 35 37 30 41 45 36 98 61 27 43 35 25 54 97 60 40 17 4 16 3 46 52 38 38</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O W W W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.389</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">371</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.25 3.23 3.08 3.08 2.37 2.29 2.28 2.21 2.19 2.12 2.11 2.00 1.98 1.93 1.89 1.75 1.74 1.72 1.57 1.42 1.33 1.32 1.23 1.20 1.19 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:y P:x P:x P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:z D:xy D:xy D:xy D:xy P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">81 56 51 95 86 93 82 57 83 59 74 76 75 81 95 56 91 51 96 8 13 9 19 23 72 90</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O W W W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.330</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">372</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">2.76 2.68 2.53 2.51 2.42 2.40 2.08 2.08 2.03 2.01 1.72 1.70 1.59 1.48 1.25 1.24 1.23 1.21 1.19 1.19 1.19 1.18</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:z P:z P:z P:z D:xy D:xy D:xy D:xy P:y P:y P:x P:x P:y P:y P:y P:y P:y D:yz P:y D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">93 86 56 81 51 95 9 19 8 13 74 76 73 85 94 87 75 91 53 6 80 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O W W W W O O O O O O O O O W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.328</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">373</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">2.67 2.59 2.59 2.56 2.55 2.49 2.01 2.00 1.91 1.91 1.59 1.59 1.45 1.29 1.29 1.28 1.18 1.18 1.12 1.11 1.07 1.07 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:z P:z P:z P:z P:x D:xy D:xy D:xy D:xy P:y P:y P:x P:x P:y P:y D:yz D:yz P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">30 43 54 35 97 37 16 3 17 4 27 61 28 26 34 67 1 14 32 65 60 25 41 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O W W W W O O O O O O W W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.173</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">374</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">5.88 5.52 2.72 2.70 2.57 2.56 2.34 2.34 1.89 1.89 1.88 1.83 1.58 1.58 1.46 1.45 1.25 1.25 1.22 1.21 1.13 1.13 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:z D:yz D:yz D:yz D:yz D:xy D:xy P:y P:y P:z P:z P:y P:y P:x P:x P:y P:y P:y P:y D:z2 D:z2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">37 30 4 17 3 16 1 14 35 97 26 28 43 54 70 47 62 29 66 33 2 15 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O W W W W W W O O O O O O O O O O O O W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.169</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">375</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">6.40 5.10 3.09 3.06 2.34 2.31 2.17 2.15 2.15 2.02 2.02 1.70 1.49 1.48 1.39 1.37 1.35 1.34 1.19 1.19 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:z P:z D:yz D:yz D:yz D:yz P:z D:xy D:xy P:y P:y P:z P:y P:y P:y P:y P:x P:x D:z2 D:z2 P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">93 86 9 19 8 13 73 11 6 51 95 85 56 81 79 24 58 63 10 20 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O W W W W O W W O O O O O O O O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.124</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">376</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">4.33 3.75 2.53 2.47 2.47 2.34 2.33 2.07 2.02 2.02 1.89 1.88 1.59 1.59 1.45 1.45 1.39 1.39 1.37 1.37 1.33 1.33 1.27 1.26 1.26 1.26 1.09 1.09 1.08 1.08 1.06 1.06 1.05 1.04 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">P:z P:z P:z D:yz D:yz D:yz D:yz P:z P:z P:z D:yz D:yz P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y D:xy D:xy D:xy D:xy P:y P:y D:x2-y2 D:x2-y2 P:x P:x P:y P:y D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">30 37 28 1 14 3 16 26 70 47 4 17 25 60 32 65 36 98 41 45 34 67 5 18 2 15 62 29 15 2 35 97 66 33 5 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">O O O W W W W O O O W W O O O O O O O O O O W W W W O O W W O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-10.115</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">377</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">4.59 3.61 2.76 2.54 2.52 2.29 2.27 2.12 2.10 2.10 1.89 1.88 1.65 1.65 1.53 1.52 1.47 1.47 1.33 1.33 1.32 1.32 1.20 1.20 1.17 1.16 1.10 1.10 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:z P:z P:z D:yz D:yz D:yz D:yz P:z P:z P:z D:yz D:yz P:y P:y P:y P:y P:y P:y D:xy D:xy P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">86 93 85 6 11 8 13 73 58 63 9 19 57 82 94 87 91 75 7 12 53 80 77 99 7 12 59 83 50 55</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O W W W W O O O W W O O O O O O W W O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.893</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">378</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">14.25 3.37 2.39 1.96 1.89 1.73 1.64 1.63 1.57 1.57 1.56 1.56 1.42 1.38 1.27 1.25 1.16 1.16 1.06 1.04 1.04 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:x P:z P:z P:z P:z D:x2-y2 P:z P:z D:z2 D:z2 D:z2 D:z2 P:x D:x2-y2 P:z P:z D:z2 D:z2 P:x P:x P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">39 73 85 28 26 103 89 84 10 7 20 12 96 101 55 50 5 18 85 73 23 69 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O Tc O O W W W W O Tc O O W W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.887</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">379</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.62 3.60 3.10 3.09 2.28 2.28 2.26 2.25 1.90 1.89 1.73 1.73 1.57 1.57 1.49 1.48 1.31 1.31 1.25 1.25 1.25 1.24 1.23 1.22 1.11 1.10 1.07 1.07 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">D:yz D:yz P:z P:z P:y P:y P:y P:y D:xy D:xy D:xy D:xy P:z P:z P:y P:y P:y P:y P:y P:z P:y P:z D:xz D:xz P:z P:z D:xz D:xz P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">1 14 47 70 61 27 29 62 3 16 17 4 52 46 32 65 34 67 33 60 66 25 15 2 42 68 18 5 28</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W O O O O O O W W W W O O O O O O O O O O W W O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.885</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">380</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.68 3.66 3.13 3.12 2.40 2.40 2.30 2.30 1.93 1.93 1.74 1.73 1.62 1.61 1.51 1.50 1.32 1.31 1.21 1.20 1.20 1.20 1.20 1.19 1.14 1.14 1.12 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">D:yz D:yz P:z P:z P:y P:y P:y P:y D:xy D:xy D:xy D:xy P:z P:z P:y P:y P:y P:y P:y P:y P:z P:z D:xz D:xz P:z P:z P:y D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">6 11 58 63 79 24 76 74 19 9 13 8 90 72 53 80 94 87 77 99 91 75 10 20 78 88 73 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W O O O O O O W W W W O O O O O O O O O O W W O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.840</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">381</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">2.30 2.16 2.06 2.00 1.82 1.69 1.47 1.47 1.41 1.41 1.34 1.34 1.26 1.25 1.24 1.24 1.24 1.09 1.09 1.07 1.06 1.06 1.06 1.06 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:x P:x P:z P:z P:x D:z2 D:z2 P:z P:z P:z P:z P:x D:xy P:y D:xy P:y P:y P:y D:z2 D:xy D:xy D:z2 P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">28 26 28 26 73 85 18 5 49 71 69 44 73 18 67 5 34 65 32 2 7 12 15 85 55</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O W W O O O O O W O W O O O W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.814</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">382</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">8.60 2.63 2.62 2.62 2.61 2.23 2.22 1.89 1.89 1.88 1.85 1.81 1.80 1.47 1.46 1.45 1.45 1.23 1.15 1.11 1.03 1.03 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y D:xy D:xy P:y P:y P:x P:x P:y P:x P:x P:y D:z2 D:z2 D:yz D:yz P:x P:x P:y D:z2 D:z2 P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">40 1 14 33 66 44 69 96 47 70 26 17 4 2 15 98 36 37 15 2 29 69 62 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O W W O O O O O O O O W W W W O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.811</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">383</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">8.82 2.54 2.47 2.40 2.35 2.27 2.25 1.91 1.90 1.90 1.78 1.78 1.67 1.45 1.44 1.39 1.37 1.26 1.18 1.10 1.08 1.07 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y D:xy P:y D:xy P:x P:x D:z2 P:y D:z2 P:x P:y P:x D:yz D:yz P:x P:x P:y D:z2 D:z2 P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 0.80 1.33 0.80 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">96 77 11 99 6 84 89 13 40 8 58 85 63 10 20 83 59 86 20 10 76 74 84 89</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O W O W O O W O W O O O W W O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.805</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">384</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">2.20 2.02 1.78 1.67 1.54 1.52 1.51 1.42 1.42 1.42 1.29 1.22 1.21 1.21 1.18 1.15 1.14 1.14 1.14 1.13 1.13 1.11 1.11 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:x P:x D:xy D:xy P:x D:xy D:xy D:z2 P:x D:xy D:xy D:xy P:x D:xy P:y P:x P:x P:y D:z2 P:z P:z D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -6.613 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.00 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">37 30 93 86 4 17 39 16 3 101 26 19 9 8 28 13 29 85 73 62 103 41 45 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O W W O W W Tc O W W W O W O O O O Tc O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.799</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">385</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">2.91 2.07 2.05 1.46 1.46 1.45 1.45 1.43 1.38 1.24 1.22 1.20 1.17 1.16 1.12 1.09 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:z P:z P:x P:z P:z D:xy D:xy D:z2 D:z2 D:yz D:yz P:y P:y P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">73 28 93 26 93 9 19 10 20 9 19 48 92 24 79 86 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O O W W W W W W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.784</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">386</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">8.34 2.03 2.03 2.01 2.00 1.85 1.84 1.55 1.55 1.47 1.47 1.43 1.28 1.28 1.14 1.13 1.09 1.08 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:x P:x P:z P:z D:z2 D:z2 P:y P:y P:y P:y P:y P:z P:z D:yz D:yz P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">38 71 49 27 61 3 16 47 70 23 30 28 41 45 5 18 49 71 70 47</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O W W O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.780</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">387</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">8.64 1.97 1.95 1.89 1.83 1.81 1.79 1.59 1.56 1.51 1.38 1.37 1.23 1.21 1.20 1.19 1.18 1.17 1.16 1.15 1.12 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:y P:x P:x P:z D:z2 P:z D:z2 P:y P:y P:y P:y P:y P:z P:z P:z P:z D:yz D:yz P:z P:z D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">23 55 50 76 19 74 9 38 73 93 58 63 82 57 55 50 7 12 58 63 11 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O W O W O O O O O O O O O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.766</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">388</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">2.89 2.87 2.85 2.80 2.66 2.65 2.33 1.90 1.77 1.49 1.46 1.44 1.41 1.39 1.39 1.38 1.32 1.31 1.31 1.31 1.26 1.25 1.23 1.18 1.12 1.11 1.05 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:x P:z P:x P:z P:x P:x P:x P:z P:z P:x P:x P:z D:x2-y2 D:x2-y2 D:yz D:yz D:x2-y2 D:yz D:x2-y2 D:yz P:x P:x P:z P:z P:z D:z2 D:z2 D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">48 74 92 76 88 78 39 28 85 51 95 30 8 13 19 9 19 8 9 13 56 81 93 86 73 9 19 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O W W W W W W W W O O O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.762</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">389</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">3.25 3.25 3.23 3.21 2.85 2.85 1.86 1.57 1.51 1.51 1.50 1.42 1.41 1.37 1.37 1.36 1.36 1.34 1.33 1.30 1.29 1.19 1.19 1.16 1.16 1.15 1.14 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x P:x P:z P:z P:x P:x P:z P:z P:x P:z P:x D:z2 D:z2 D:x2-y2 D:yz D:yz D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:z2 P:x P:x D:z2 D:z2 D:yz D:yz P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">64 31 61 27 68 42 26 85 97 28 35 3 16 16 16 3 3 17 4 4 17 54 43 18 5 17 4 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O W W W W W W W W W W O O W W W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.690</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">390</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">15.03 3.11 3.06 2.24 2.22 2.07 1.57 1.56 1.56 1.42 1.41 1.12 1.12 1.10 1.09 1.09 1.07 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:x P:z P:z P:y P:y P:z P:z D:yz D:yz P:y P:y P:y P:y D:x2-y2 P:y P:y P:z D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">39 85 86 55 50 26 37 13 8 71 49 89 84 101 81 56 93 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O O O W W O O O O Tc O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.672</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">391</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">2.23 2.16 2.15 2.14 1.94 1.94 1.89 1.87 1.78 1.77 1.69 1.65 1.63 1.63 1.58 1.55 1.51 1.44 1.28 1.25 1.22 1.22 1.22 1.22 1.21 1.20 1.20 1.20 1.11 1.10 1.09 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">P:x P:x P:y P:y P:z P:x P:z P:x D:xy D:xy P:x D:yz D:yz P:x D:xy D:xy P:z P:z P:x P:x P:x P:z P:z D:z2 P:x D:z2 P:y P:y P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">71 49 60 25 70 45 47 41 15 2 69 14 1 44 18 5 60 25 98 36 50 69 44 5 55 18 91 75 82 57 58 63</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">O O O O O O O O W W O W W O W W O O O O O O O W O W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.666</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">392</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.30 2.47 2.43 2.40 2.37 2.32 2.31 2.03 1.96 1.73 1.72 1.61 1.59 1.59 1.56 1.51 1.50 1.22 1.21 1.21 1.21 1.13 1.07 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z D:xz D:xz P:x P:z P:x P:z P:x P:x D:z2 D:z2 P:y P:y P:x P:x P:x P:z D:x2-y2 D:x2-y2 P:y P:y P:z D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">37 5 18 49 25 71 60 41 45 17 4 42 68 40 44 69 26 5 18 49 71 40 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O W W O O O O O O W W O O O O O O W W O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.658</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">393</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">2.37 2.36 2.15 2.14 1.84 1.83 1.81 1.79 1.79 1.78 1.77 1.77 1.69 1.65 1.48 1.48 1.48 1.47 1.33 1.32 1.32 1.31 1.31 1.28 1.27 1.26 1.21 1.21 1.06 1.05 1.04 1.02 1.02 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:x P:x P:y P:y D:xy D:xy P:x P:x P:z P:x P:x P:z P:z P:z D:yz D:yz D:xy D:xy P:x P:x D:z2 P:z P:z D:z2 P:x P:x P:y P:y D:xy D:xy D:xz P:x D:xz P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">50 55 91 75 10 20 84 89 58 82 57 63 75 91 11 6 7 12 49 71 12 89 84 7 83 59 25 60 15 2 20 69 10 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O O O W W O O O O O O O O W W W W O O W O O W O O O O W W W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.635</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">394</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">2.69 2.68 2.56 2.55 1.91 1.88 1.87 1.76 1.75 1.68 1.67 1.66 1.58 1.58 1.55 1.55 1.08 1.07 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:z P:z P:x P:x P:z D:xz D:xz D:z2 D:z2 P:x P:x P:x D:z2 D:z2 P:x P:x D:xz D:xz P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">75 91 55 50 86 12 7 13 8 39 57 82 19 9 89 84 20 10 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O W W W W O O O W W O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.576</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">395</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">2.04 1.48 1.46 1.46 1.45 1.45 1.35 1.35 1.28 1.27 1.24 1.22 1.21 1.17 1.16 1.10 1.10 1.08 1.08 1.08 1.06 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:z P:x P:x P:x P:x D:xz D:xz P:y P:y P:z D:xy D:xy D:xy D:xy P:x P:x P:x P:x P:x P:z D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">93 30 36 98 59 83 20 10 89 84 38 2 15 10 20 77 99 89 23 84 23 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O W W O O O W W W W O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.508</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">396</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="35">4.12 3.77 3.18 3.16 3.11 3.09 2.47 2.44 2.41 2.41 2.05 2.03 1.69 1.69 1.67 1.67 1.61 1.61 1.46 1.45 1.27 1.26 1.24 1.24 1.22 1.22 1.19 1.17 1.16 1.15 1.12 1.11 1.05 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="35">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="35">P:x P:x P:z P:z P:z P:z P:y P:y P:y P:y P:y P:y P:x P:x P:y P:y D:xy D:xy D:xy D:xy P:x P:x P:z P:z D:xy D:xy P:x P:x P:x P:x D:xy D:xy D:z2 P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="35"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -6.613 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="35">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="35">28 26 62 29 33 66 45 41 62 29 33 66 30 37 98 36 15 2 18 5 32 65 65 32 4 17 67 34 54 43 16 3 101 34 67</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="35">O O O O O O O O O O O O O O O O W W W W O O O O W W O O O O W W Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.500</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">397</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">3.27 3.26 2.65 2.62 2.28 2.26 2.14 2.13 1.75 1.73 1.56 1.53 1.50 1.50 1.44 1.37 1.32 1.32 1.25 1.20 1.19 1.14 1.04 1.03 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:x P:x P:x P:x P:z P:z P:x P:x P:z P:z P:x P:x D:z2 D:z2 P:y P:y P:z P:z P:y D:z2 D:z2 P:y P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">92 48 64 31 74 76 88 78 27 61 42 68 9 19 85 86 95 51 26 16 3 37 97 35 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O W W O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.497</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">398</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.04 3.82 3.46 2.95 2.81 2.39 2.28 2.15 2.14 2.03 1.95 1.93 1.85 1.54 1.54 1.49 1.48 1.46 1.44 1.29 1.28 1.27 1.24 1.24 1.22 1.22 1.16 1.12 1.12 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:z P:x P:x P:z P:z P:z P:y P:y P:y P:y P:y P:y P:x P:x D:xy P:y P:z P:x P:x P:y D:xy D:xy D:x2-y2 D:x2-y2 D:xy P:x P:x P:z P:z D:xy P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">24 85 73 77 79 99 57 83 77 24 99 79 80 56 20 82 53 86 94 59 10 7 19 8 13 93 88 59 80 12 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O W O O O O O W W W W W O O O O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.497</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">399</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.81 2.78 2.75 2.23 2.19 2.16 2.14 2.00 1.74 1.61 1.58 1.42 1.35 1.34 1.27 1.22 1.22 1.18 1.18 1.15 1.12 1.10 1.09 1.08 1.07 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:x P:x P:x P:x P:z P:z P:x P:x P:z P:x P:z P:y P:x P:y D:z2 D:z2 P:z P:z D:z2 D:z2 D:x2-y2 P:z D:x2-y2 P:y P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">42 68 78 64 27 61 31 48 76 88 74 28 92 30 4 16 79 97 17 13 13 43 9 73 53 93</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O W W O O W W W O W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.488</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">400</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">5.54 2.96 2.87 2.50 2.12 2.12 1.88 1.86 1.71 1.71 1.57 1.56 1.39 1.38 1.38 1.31 1.24 1.23 1.20 1.19 1.17 1.16 1.14 1.13 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:y P:y P:y P:y P:x P:x D:xz D:xz P:x P:x P:x P:x D:xy P:y D:xy P:y P:z P:z P:y P:y P:x P:x P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">28 26 73 30 70 47 14 1 42 68 52 46 1 93 14 37 62 29 32 65 78 88 85 62 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O W W O O O O W O W O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.483</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">401</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.68 3.59 2.21 2.20 1.97 1.90 1.89 1.87 1.84 1.74 1.62 1.62 1.61 1.60 1.45 1.44 1.13 1.11 1.10 1.09 1.08 1.05 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:x P:x P:y P:y D:xz D:xz P:y P:y P:x P:x P:x P:x D:xy D:xy P:y P:y P:x P:x P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">73 85 63 58 28 93 11 6 26 86 92 72 48 90 6 11 53 80 77 99 79 24 47 70</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O W W O O O O O O W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.443</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">402</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="9">22.60 1.72 1.68 1.21 1.21 1.13 1.12 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="9">1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="9">P:x D:x2-y2 D:x2-y2 P:z P:z P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="9"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="9">1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="9">39 103 101 33 66 77 99 33 66</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="9">O Tc Tc O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.378</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">403</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.89 4.88 4.43 4.43 4.34 4.33 4.23 4.22 3.08 3.08 2.64 2.63 2.11 2.11 1.73 1.73 1.65 1.65 1.48 1.47 1.06 1.05 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:x P:x P:y P:y P:y P:y P:z P:z P:z P:z P:y P:y P:z P:z P:y P:y P:z P:z P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">29 62 66 33 66 33 62 29 32 65 34 67 34 67 62 29 32 65 66 33 65 32 46 52</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.375</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">404</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">4.86 4.85 4.62 4.62 4.44 4.43 4.23 4.22 3.00 2.98 2.75 2.72 2.14 2.13 1.55 1.55 1.54 1.53 1.49 1.49 1.17 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:y P:y P:x P:x P:y P:y P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">79 24 77 99 99 77 24 79 53 80 94 87 87 94 77 99 79 24 53 80 72 90</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.349</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">405</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">9.18 6.32 4.75 3.51 3.48 2.75 2.72 2.72 2.69 2.18 2.18 2.16 2.15 1.98 1.96 1.92 1.67 1.67 1.66 1.64 1.34 1.32 1.17 1.17 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:z P:z P:z P:z P:x P:x P:y P:y P:x P:x P:x P:x P:y D:yz D:yz P:z P:z P:z P:z D:xy D:xy P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">28 26 30 62 29 66 33 32 65 27 61 68 42 67 34 37 4 17 52 46 69 44 15 2 71 49</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O W W O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.348</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">406</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">9.62 5.83 5.13 3.62 3.56 2.78 2.78 2.56 2.53 2.24 2.21 2.12 2.12 1.91 1.87 1.67 1.67 1.66 1.65 1.65 1.33 1.31 1.15 1.14 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:y P:z P:z P:x P:x P:z P:z P:x P:x P:y P:y P:x P:x D:yz P:z D:yz P:z P:y P:z P:z D:xy D:xy P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">73 85 93 79 24 53 80 77 99 88 78 74 76 94 87 8 72 13 90 86 84 89 20 10 50 55</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O W O W O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.328</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">407</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">9.40 8.67 5.33 3.33 2.55 2.55 2.31 2.31 2.03 2.02 2.00 1.99 1.81 1.79 1.59 1.58 1.39 1.38 1.23 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:y P:y P:z P:z P:x P:x P:x P:x P:y D:xz D:xz P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">37 26 30 28 46 52 31 64 69 44 49 71 66 33 67 34 42 68 38 1 14 70</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.327</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">408</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">9.66 9.15 5.04 3.03 2.47 2.47 2.41 2.39 2.00 2.00 1.99 1.98 1.97 1.96 1.68 1.68 1.32 1.25 1.25 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:z P:z P:y P:y P:x P:x P:y P:x P:x D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">86 85 93 73 72 90 92 48 84 89 99 77 50 55 87 94 23 78 88 6 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.279</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">409</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">3.64 3.62 3.34 2.83 1.94 1.48 1.47 1.41 1.38 1.38 1.38 1.37 1.34 1.33 1.30 1.30 1.16 1.15 1.14 1.14 1.10 1.10 1.09 1.09 1.08 1.07 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:y P:y P:z P:x P:x P:y P:y P:z D:z2 D:z2 P:y P:y P:x P:x P:y P:y D:z2 D:z2 D:z2 D:z2 P:x P:x D:xy P:y D:xy P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">44 69 40 40 30 32 65 26 15 2 33 66 44 69 71 49 18 3 5 16 35 97 16 31 3 64 29 62</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O W W O O O O O O W W W W O O W O W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.274</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">410</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">3.24 3.23 2.56 2.34 1.92 1.66 1.55 1.55 1.43 1.43 1.42 1.42 1.40 1.40 1.39 1.38 1.38 1.31 1.30 1.12 1.12 1.12 1.11 1.11 1.10 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:y P:y P:x P:z P:x P:x D:xy D:xy P:y P:y P:z P:y P:y D:z2 D:z2 P:y P:y P:x P:x D:z2 P:y P:y D:z2 P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">89 84 93 96 96 73 19 9 56 81 85 80 53 12 7 83 59 55 50 20 77 99 10 51 95 84 89</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O W W O O O O O W W O O O O W O O W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.237</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">411</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">2.31 2.30 2.21 2.20 2.17 2.17 2.17 2.16 2.16 2.13 2.12 2.11 2.10 2.09 1.72 1.71 1.68 1.52 1.46 1.45 1.27 1.27 1.17 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:y P:y P:z P:y P:y P:z P:z P:z P:z P:z P:y P:x P:x P:y P:x P:x P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">25 60 65 32 61 27 41 60 25 45 34 67 70 47 28 36 98 38 29 62 36 98 66 33</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.235</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">412</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">1.99 1.68 1.53 1.52 1.26 1.26 1.23 1.23 1.17 1.17 1.13 1.13 1.12 1.11 1.09 1.09 1.02 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:x P:x P:x P:x P:y P:y D:xz D:xz D:xy D:xy P:y P:y P:x P:x P:y P:y P:x D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">37 86 69 44 97 35 18 5 17 4 95 51 89 84 49 71 26 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O W W W W O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.233</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">413</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.27 2.26 2.23 2.23 2.22 2.21 2.21 2.21 2.15 2.15 2.14 2.13 2.07 2.06 1.77 1.70 1.70 1.55 1.47 1.46 1.20 1.19 1.17 1.16 1.11 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:y P:x P:x P:y P:x P:x P:x P:x P:z P:z D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">75 91 80 53 91 75 76 74 82 57 87 94 58 63 73 83 59 23 24 79 99 77 83 59 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.213</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">414</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">3.27 2.12 2.09 2.01 1.98 1.31 1.28 1.23 1.22 1.22 1.21 1.18 1.18 1.14 1.10 1.07 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:x P:x P:x P:x P:x D:xz D:xz D:xz P:z P:x D:xz P:x P:y P:y P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">39 69 44 89 84 7 12 18 38 37 5 86 55 50 98 36 26</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O O W W W O O W O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.183</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">415</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">5.73 5.58 4.97 4.95 3.59 3.54 3.29 3.25 2.91 2.87 1.84 1.83 1.82 1.75 1.73 1.59 1.50 1.49 1.38 1.36 1.31 1.28 1.26 1.25 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:x P:x P:z P:z P:y P:y P:x P:x P:z P:z P:y P:x P:y P:x P:x D:xz D:xz P:z P:y P:y P:z P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">36 98 41 45 41 45 54 43 97 35 98 45 36 22 41 2 15 30 43 54 38 43 54 49 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.182</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">416</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">2.36 2.33 2.22 2.20 2.11 2.06 2.04 1.98 1.82 1.80 1.80 1.79 1.60 1.59 1.58 1.56 1.52 1.50 1.48 1.46 1.36 1.33 1.31 1.28 1.27 1.26 1.25 1.22 1.19 1.17 1.09 1.07 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:x P:x P:x P:x P:x D:xz P:x D:xz P:z P:x P:x P:z P:x P:z P:z P:x P:x P:x D:xz D:xz D:xz D:xz P:x P:x P:x P:x P:z P:z D:xy D:xy P:z P:z D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">98 41 45 36 71 15 49 2 49 69 44 71 83 69 44 59 82 57 5 18 20 10 84 50 89 55 50 55 5 18 84 89 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O O O O O W O W O O O O O O O O O O W W W W O O O O O O W W O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.163</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">417</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">2.54 2.49 2.43 2.42 1.95 1.92 1.70 1.70 1.64 1.63 1.62 1.61 1.47 1.47 1.44 1.43 1.34 1.33 1.32 1.30 1.29 1.27 1.26 1.26 1.04 1.03 1.03 1.03 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:x P:x P:x P:x D:xz D:xz P:x P:x P:x P:x P:z P:z P:x P:x D:xy D:xy P:z P:x P:z P:x D:xz D:xz D:xz D:xz P:z P:z D:xy P:y D:xy P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">83 59 50 55 20 10 71 49 36 98 50 55 82 57 7 12 84 84 89 89 12 7 2 15 71 49 5 55 18 50</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O O W W O O O O O O O O W W O O O O W W W W O O W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.132</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">418</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.75 2.73 2.02 2.00 1.99 1.94 1.94 1.91 1.88 1.88 1.88 1.62 1.62 1.50 1.50 1.45 1.39 1.38 1.38 1.38 1.37 1.36 1.33 1.28 1.26 1.13 1.12 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x P:x P:x P:x P:z D:z2 D:z2 P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:x D:z2 D:z2 P:z P:x P:z P:z P:z P:z P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">82 57 51 95 39 4 17 35 97 68 42 59 83 78 88 96 83 45 8 13 59 41 23 56 81 98 36 28</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O W W O O O O O O O O O O O W W O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.124</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">419</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">4.78 4.76 3.82 3.82 3.40 3.38 2.28 2.27 2.19 2.18 2.13 2.12 2.11 2.08 2.08 1.95 1.91 1.78 1.77 1.58 1.28 1.15</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:z P:z P:x P:x P:x P:x D:z2 D:z2 P:x P:z P:x P:z P:z P:y P:y D:xz D:xz P:x P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">59 83 57 82 81 56 89 84 19 9 48 23 92 95 51 57 82 10 20 85 93 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O W W O O O O O O O W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.105</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">420</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">1.82 1.81 1.75 1.75 1.71 1.70 1.69 1.66 1.63 1.63 1.59 1.59 1.58 1.58 1.51 1.47 1.29 1.29 1.28 1.26 1.16 1.14 1.14 1.11 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:x P:x P:y P:y P:z P:x P:z P:x P:z P:z P:x P:y P:x P:y P:x P:x P:z P:z P:z P:z P:x P:x P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">97 35 70 47 43 95 54 51 81 56 45 58 41 63 57 82 45 82 57 41 43 54 37 86 81 56</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.083</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">421</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">2.57 2.37 2.35 2.33 2.30 2.25 2.20 2.07 2.04 1.97 1.97 1.94 1.52 1.47 1.27 1.23 1.23 1.23 1.19 1.16 1.10 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x D:z2 P:x D:z2 P:x P:x P:x P:x D:z2 P:x D:z2 P:x P:x P:z P:x P:x P:z D:z2 D:z2 P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">51 78 8 88 13 95 35 68 42 4 97 17 82 45 83 57 41 98 9 19 59 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O W O W O O O O W O W O O O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.081</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">422</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">2.72 2.50 2.47 2.24 2.01 1.96 1.92 1.91 1.84 1.83 1.78 1.68 1.62 1.62 1.51 1.47 1.11 1.10 1.10 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:x P:x P:x P:x P:y P:y P:x P:y P:z P:y P:x P:z P:x P:z P:x P:z P:z P:z P:z P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">57 41 82 45 63 47 95 58 81 70 97 56 51 54 35 43 36 82 57 59 43</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.055</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">423</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.19 3.18 2.13 2.13 2.08 2.06 2.06 2.05 2.05 2.05 1.97 1.97 1.86 1.84 1.34 1.29 1.26 1.25 1.24 1.23 1.21 1.20 1.15 1.15 1.14 1.13 1.12 1.12 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">D:z2 D:z2 P:z P:z P:z P:z P:x P:y P:y P:x P:x P:x D:z2 D:z2 P:y P:y P:z P:z P:z P:z P:x P:x P:y P:x P:x P:y P:y P:y D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">1 14 29 62 66 33 34 70 47 67 65 32 6 11 63 58 99 77 24 79 87 94 43 80 53 54 35 97 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W O O O O O O O O O O W W O O O O O O O O O O O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.052</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">424</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.19 3.17 2.18 2.16 2.07 2.06 2.05 2.03 2.03 1.99 1.98 1.96 1.92 1.91 1.25 1.24 1.24 1.24 1.23 1.23 1.22 1.21 1.20 1.20 1.09 1.09 1.04 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">D:z2 D:z2 P:z P:z P:x P:x P:z P:y P:z P:y P:x P:x D:z2 D:z2 P:z P:z P:y P:y P:x P:x P:z P:z P:x P:x P:y P:y P:y P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">6 11 99 77 87 94 24 63 79 58 80 53 1 14 66 33 51 95 67 34 29 62 65 32 56 81 70 47 73</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W O O O O O O O O O O W W O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.032</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">425</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">6.81 6.79 6.63 6.60 4.27 4.03 2.45 2.40 2.27 2.26 2.08 2.07 1.92 1.91 1.85 1.84 1.83 1.82 1.58 1.56 1.25 1.24 1.21 1.21 1.12 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:x P:x P:x P:x D:yz D:yz P:z P:z P:y P:y P:y P:y P:x P:x P:z P:z P:y P:y P:x P:x P:z P:z P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">60 25 27 61 100 101 98 36 35 97 54 43 64 31 35 97 36 98 68 42 45 41 41 45 42 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O Tc Tc O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-9.028</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">426</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">6.43 6.42 6.42 6.41 4.14 3.82 2.59 2.59 2.30 2.26 2.07 2.06 2.03 2.03 1.91 1.89 1.89 1.88 1.65 1.65 1.15 1.15 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:x P:x D:yz D:yz P:z P:z P:y P:y P:z P:z P:y P:y P:y P:x P:x P:y P:x P:x P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">75 76 74 91 102 103 83 59 95 51 51 95 81 56 59 92 48 83 78 88 78 88 57 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O Tc Tc O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.996</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">427</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="11">7.67 7.62 6.41 6.39 1.42 1.41 1.15 1.14 1.09 1.08 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="11">1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="11">P:y P:y P:y P:y D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:z P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="11"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="11">1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="11">58 63 70 47 6 11 1 14 84 89 93</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="11">O O O O W W W W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.989</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">428</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">8.21 8.20 5.87 5.86 1.50 1.49 1.11 1.10 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">P:y P:y P:y P:y D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">70 47 58 63 1 14 6 11 69 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.963</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">429</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="35">4.90 4.89 3.11 2.92 1.97 1.94 1.82 1.80 1.67 1.63 1.62 1.59 1.50 1.49 1.44 1.35 1.26 1.23 1.21 1.17 1.16 1.14 1.14 1.13 1.13 1.13 1.13 1.11 1.10 1.09 1.08 1.08 1.07 1.05 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="35">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="35">P:z P:z P:y P:y P:z P:z P:x P:x P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:x P:x P:x D:z2 D:x2-y2 P:x D:z2 P:x P:y D:x2-y2 P:x D:yz D:x2-y2 D:yz P:y D:x2-y2 P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="35"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="35">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 1.33 0.80 1.33 0.80 0.80 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="35">44 69 31 64 49 71 27 61 32 65 15 2 29 62 68 42 3 16 64 42 31 15 17 68 2 97 40 4 35 3 5 16 69 18 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="35">O O O O O O O O O O W W O O O O W W O O O W W O W O O W O W W W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.960</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">430</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">4.78 4.73 3.05 2.96 2.12 2.11 1.89 1.86 1.57 1.56 1.50 1.49 1.48 1.47 1.46 1.45 1.24 1.21 1.19 1.17 1.17 1.16 1.16 1.13 1.13 1.12 1.12 1.11 1.09 1.09 1.08 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:z P:z P:y P:y P:z P:z P:x P:x P:y P:y D:x2-y2 P:y D:x2-y2 P:y P:y P:y D:x2-y2 D:x2-y2 P:x P:x P:x P:y P:x D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x D:z2 D:yz D:yz D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">89 84 92 48 50 55 76 74 80 53 10 88 20 79 24 78 19 9 48 51 95 96 92 12 13 7 8 78 88 10 9 19 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O O O O O O O O O O W O W O O O W W O O O O O W W W W O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.954</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">431</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">8.39 8.39 4.82 4.67 4.11 4.10 3.89 3.73 1.34 1.33 1.27 1.27 1.06 1.04 1.04 1.04 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:z P:z P:y P:y D:yz D:yz P:y P:y P:x P:z P:x P:z D:xz P:z P:z D:xz D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 1.33 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">47 70 42 68 1 14 64 31 31 26 64 28 4 52 46 17 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O W W O O O O O O W O O W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.949</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">432</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">8.19 8.19 4.85 4.74 3.95 3.93 3.13 3.13 1.33 1.14 1.12 1.09 1.08 1.08 1.08 1.05 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:z P:z P:y P:y D:yz D:yz P:y P:y P:z P:y P:y P:z P:z P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">58 63 78 88 6 11 48 92 85 55 50 73 72 90 86 92 48 85</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O W W O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.933</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">433</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">6.83 6.82 3.81 3.80 3.29 3.26 3.24 3.21 2.82 2.79 2.41 2.38 1.58 1.57 1.43 1.43 1.21 1.20</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:x P:x D:xy D:xy P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">70 47 14 1 49 71 64 31 44 69 68 42 52 46 63 58 31 64</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O W W O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.931</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">434</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">6.53 6.52 3.69 3.66 3.62 3.62 2.82 2.80 2.77 2.77 2.33 2.30 1.66 1.64 1.57 1.57 1.35 1.34 1.12 1.12 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:y P:y D:xy D:xy P:y P:y P:y P:y P:y P:y P:z P:z P:x P:x P:x P:x D:xz D:xz P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">63 58 48 92 6 11 84 55 50 89 78 88 92 48 72 90 70 47 19 9 78 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O W W O O O O O O O O O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.925</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">435</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">6.74 6.73 3.15 3.13 3.06 3.06 3.02 2.96 1.86 1.85 1.48 1.47 1.24 1.23 1.20 1.19 1.14 1.10 1.10 1.10 1.09 1.08 1.05 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:z P:z P:y P:y P:z P:z P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:z P:z P:y P:y P:y P:y P:y P:y D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">70 47 44 69 68 42 49 71 66 33 67 34 5 18 64 31 26 64 62 29 38 31 2 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O W W O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.922</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">436</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">6.66 6.63 3.40 3.39 2.99 2.95 2.64 2.59 1.77 1.76 1.41 1.40 1.39 1.38 1.18 1.18 1.16 1.16 1.16 1.16 1.12 1.11 1.10 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:y P:y P:z P:z P:y P:y P:z P:z P:y P:y P:y P:y P:z P:z D:x2-y2 D:x2-y2 P:y P:y P:y P:y P:y D:z2 D:z2 P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">58 63 84 89 88 78 55 50 99 77 94 87 92 48 7 12 24 79 48 92 85 10 20 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O W W O O O O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.901</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">437</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">5.65 5.25 3.85 3.41 2.62 2.58 2.34 2.33 2.22 2.11 1.89 1.68 1.57 1.55 1.37 1.31 1.28 1.28 1.22 1.17 1.15 1.14 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:x P:x P:x P:x P:y P:y P:y P:y P:z P:z P:x P:z P:x P:z P:z P:x P:z P:z D:x2-y2 P:y P:z P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">91 75 76 74 59 83 57 82 51 95 25 56 60 81 59 61 88 83 102 36 48 98 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O Tc O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.900</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">438</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">6.11 5.62 4.34 4.00 2.96 2.52 2.34 2.31 2.21 2.09 2.02 1.89 1.77 1.56 1.50 1.38 1.33 1.33 1.31 1.30 1.21 1.19 1.12 1.07 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z P:z P:z P:z P:z P:z P:z D:z2 P:z D:z2 P:x P:z P:x D:z2 D:z2 P:x P:z P:x P:z P:z P:z P:x D:z2 P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">68 42 64 31 78 88 49 71 17 92 4 27 48 61 16 3 35 44 97 69 50 55 60 13 74</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O W O W O O O W W O O O O O O O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.897</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">439</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">5.93 5.91 4.10 4.07 2.88 2.84 2.37 2.35 2.17 2.16 2.01 1.98 1.78 1.77 1.45 1.45 1.44 1.42 1.06 1.05 1.05 1.04 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:z P:z P:z P:z D:z2 D:z2 P:z P:z P:x P:x P:x P:x D:z2 D:z2 P:z D:z2 P:z D:z2 P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 0.80 1.33 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">78 88 48 92 42 68 50 55 13 8 31 64 74 76 95 51 19 9 84 4 89 17 49 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O W W O O O O O O W W O W O W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.868</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">440</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">5.73 5.71 4.04 4.01 2.74 2.73 2.70 2.50 2.50 2.32 2.30 1.96 1.94 1.79 1.78 1.40 1.37 1.36 1.35 1.34 1.32 1.15 1.12 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:x P:x P:x P:y P:y P:z P:z P:y P:y P:x P:x P:z P:z P:z P:z P:z P:z P:x P:x P:z P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">60 25 27 61 39 36 98 97 35 45 41 75 91 54 43 68 98 42 36 74 76 64 31 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.781</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">441</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.94 3.91 3.36 3.28 3.04 3.00 2.94 2.93 2.79 2.68 2.62 2.46 2.38 1.85 1.83 1.73 1.69 1.68 1.62 1.51 1.30 1.29 1.18 1.18 1.06 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:z P:z P:x P:x P:x P:x P:x P:y P:y P:z P:z P:x P:x P:y P:z P:y P:z P:x D:yz D:yz P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">49 71 69 44 49 71 27 61 38 49 71 68 42 69 44 69 31 44 64 40 5 18 41 45 68 42</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.774</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">442</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.90 3.87 3.55 3.48 3.04 3.04 3.02 3.01 2.59 2.54 2.36 2.27 2.23 2.08 2.05 1.88 1.87 1.57 1.49 1.35 1.29 1.26 1.08 1.04 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:x P:z P:z P:x P:x P:y P:y P:z P:z P:x D:yz D:yz P:y P:y P:x D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">55 50 84 89 55 74 50 76 55 50 23 78 88 84 89 89 84 48 92 96 7 12 78 88 82 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O W W O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.752</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">443</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">7.34 7.28 5.37 5.28 2.23 2.19 2.17 2.10 1.88 1.87 1.86 1.81 1.78 1.77 1.56 1.52 1.37 1.33 1.22 1.22 1.18 1.15 1.04 1.02 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x P:y P:y P:x P:x P:y P:y P:y P:y P:y P:y P:x P:x P:y P:y D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">64 31 42 68 44 69 71 49 42 68 44 69 64 31 71 49 64 31 42 68 44 69 70 47 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.751</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">444</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">7.23 7.21 5.44 5.35 2.22 2.19 2.16 2.09 1.86 1.86 1.83 1.82 1.81 1.81 1.53 1.51 1.40 1.37 1.25 1.25 1.17 1.14 1.04 1.03 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:z P:z P:z P:z P:z P:z P:x P:y P:x P:x P:x P:y P:y P:y P:y P:y P:y P:y P:x P:x P:y P:y D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">92 48 88 78 89 84 50 55 88 89 78 92 48 84 50 55 92 48 88 78 89 84 63 58 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.618</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">445</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">7.77 7.76 5.87 4.52 4.50 3.45 3.44 3.28 3.27 2.36 2.35 2.25 2.25 1.90 1.90 1.75 1.73 1.70 1.70 1.68 1.68 1.61 1.60 1.33 1.33 1.27 1.23 1.22 1.17 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:y P:y P:y P:z P:z P:z P:z P:y P:y P:z P:z P:x P:x D:yz D:yz P:z P:z D:z2 D:z2 D:x2-y2 D:x2-y2 D:xy D:xy D:xy D:xy P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">64 31 28 69 44 47 70 69 44 29 62 70 47 14 1 32 65 2 15 2 15 3 16 14 1 30 29 62 70 47</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O O O O O O O O O O O W W O O W W W W W W W W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.616</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">446</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">7.58 7.55 6.07 4.63 4.59 3.37 3.35 3.26 3.22 2.42 2.41 2.16 2.16 1.87 1.85 1.79 1.78 1.71 1.71 1.70 1.69 1.61 1.60 1.31 1.30 1.27 1.20 1.19 1.10 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:y P:y P:y P:z P:z P:z P:z P:y P:y P:z P:z P:x P:x D:yz D:yz P:z P:z D:x2-y2 D:x2-y2 D:z2 D:z2 D:xy D:xy D:xy D:xy P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">48 92 73 89 84 63 58 84 89 79 24 63 58 6 11 53 80 10 20 10 20 9 19 6 11 93 24 79 58 63</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O O O O O O O O O O O W W O O W W W W W W W W O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.599</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">447</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">3.51 3.46 3.14 3.13 2.99 2.98 2.63 2.53 2.49 2.39 2.28 1.90 1.87 1.71 1.66 1.65 1.55 1.54 1.54 1.53 1.50 1.48 1.43 1.37 1.20 1.18 1.17 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x P:z P:y P:y P:z P:z P:x P:x P:x P:x P:z P:x P:x P:x P:z P:z P:y P:y P:z P:z P:z P:z P:x P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">40 40 70 47 69 44 38 42 68 96 96 31 64 23 64 31 63 58 48 92 84 89 22 22 49 71 48 92</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.590</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">448</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">4.14 4.09 4.01 3.35 2.98 2.97 2.90 2.81 2.56 2.54 2.20 2.19 2.17 1.91 1.62 1.57 1.36 1.35 1.18 1.18 1.07 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:y P:z P:y P:x P:z P:z P:y P:y P:z P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">63 96 58 96 84 89 70 47 48 92 40 69 44 23 40 21 55 50 92 48 42 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.585</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">449</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">8.40 8.37 5.59 5.52 4.57 4.03 4.03 3.90 3.86 3.61 3.61 2.12 2.10 2.02 2.02 1.83 1.83 1.76 1.76 1.22 1.22 1.19 1.19</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:y P:z P:z P:y P:x P:x P:y P:y P:z P:z D:x2-y2 D:x2-y2 D:z2 D:z2 D:xy D:xy D:yz D:yz D:xy D:xy P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">68 42 49 71 26 70 47 71 49 70 47 5 18 18 5 1 14 1 14 4 17 66 33</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O W W W W W W W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.583</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">450</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.47 3.44 2.75 2.74 2.16 2.15 2.03 2.02 1.63 1.61 1.59 1.55 1.54 1.42 1.41 1.40 1.33 1.32 1.32 1.31 1.30 1.28 1.26 1.23 1.23 1.17 1.16 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:x P:x P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y P:y P:x P:x P:x P:x P:z P:z P:x P:x P:y P:y P:x P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">70 47 67 34 32 65 66 33 26 41 45 98 36 29 62 68 42 62 29 65 32 35 97 63 58 69 44 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.582</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">451</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">8.12 8.06 5.20 5.15 4.84 3.74 3.72 3.71 3.68 3.18 3.17 2.04 2.03 1.84 1.82 1.78 1.77 1.56 1.56 1.42 1.42 1.33 1.31</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:y P:z P:z P:y P:y P:z P:y P:z P:x P:x D:x2-y2 D:x2-y2 D:z2 D:z2 D:yz D:yz D:xy D:xy P:z P:z D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">88 78 55 50 85 50 63 55 58 58 63 12 7 7 12 6 11 6 11 77 99 8 13</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O W W W W W W W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.581</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">452</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">3.97 3.96 2.72 2.70 2.18 2.17 1.95 1.95 1.63 1.62 1.62 1.61 1.42 1.39 1.39 1.39 1.39 1.35 1.34 1.30 1.29 1.28 1.28 1.22 1.21 1.09 1.09 1.08 1.07 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:x P:x P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y P:y P:x P:x P:x P:x P:z P:z P:y P:y P:x P:x P:x P:x P:x P:x P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">63 58 94 87 80 53 99 77 82 57 83 59 85 79 24 78 88 79 24 51 95 53 80 89 84 77 99 56 81 89 84</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.520</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">453</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">4.10 3.87 3.51 3.48 3.35 3.31 2.99 2.90 2.90 2.73 2.71 2.59 1.81 1.81 1.57 1.57 1.55 1.54 1.31 1.13 1.12 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:z P:z P:y P:y P:z P:z P:x P:z P:z P:y P:y P:x P:x P:x P:z P:z P:x P:x P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">23 38 63 58 50 55 38 49 71 47 70 23 64 31 84 89 92 48 39 96 44 69</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.468</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">454</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">4.99 4.08 3.93 3.85 2.90 2.78 2.75 2.38 2.37 2.04 2.04 1.73 1.72 1.71 1.71 1.68 1.67 1.24 1.24 1.18 1.18 1.17 1.17 1.13 1.13 1.10 1.09 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:x P:z P:x P:z P:x P:z P:z P:z P:z P:x P:x P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:z P:z P:x P:x P:z P:z P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">38 38 23 23 39 50 55 49 71 64 31 47 58 92 48 70 63 52 46 84 89 84 89 44 69 68 42 68 42 40</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.426</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">455</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">9.03 9.01 7.55 3.52 3.48 3.48 2.56 2.55 2.54 2.54 2.29 2.28 2.15 2.01 1.98 1.49 1.48 1.46 1.12 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:y P:z P:z P:z D:xy P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">44 69 40 28 46 52 68 42 42 68 44 69 38 42 68 69 104 44 49 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O P O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.423</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">456</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">8.90 8.87 7.47 3.57 3.57 3.49 2.60 2.59 2.52 2.51 2.28 2.28 2.23 1.98 1.94 1.51 1.50 1.47 1.20 1.20</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:y P:x P:x P:y P:x P:x P:y P:y P:x P:x P:y P:z P:z P:z D:xy P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 10.422 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">89 84 96 90 72 73 88 78 78 88 89 84 23 88 78 84 105 89 55 50</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O P O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.399</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">457</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">4.51 4.50 4.00 3.99 3.98 3.97 2.32 2.31 1.65 1.61 1.60 1.56 1.54 1.53 1.42 1.42 1.32 1.31 1.28 1.25 1.24 1.24 1.12 1.11 1.10 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z D:xz P:z P:z P:x P:x P:z P:z P:x P:x P:z P:z P:z P:y P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">68 42 52 46 64 31 78 88 39 70 47 101 72 90 49 71 71 49 55 50 44 69 92 70 48 47</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O Tc O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.385</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">458</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">6.23 6.15 4.46 4.39 3.01 2.63 2.12 1.87 1.45 1.42 1.34 1.31 1.16 1.12 1.09 1.06 1.04 1.02 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:y P:y P:z P:x D:xy P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">71 49 55 50 38 26 23 85 69 44 71 49 70 47 31 55 101 50 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.378</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">459</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.88 4.87 4.10 4.08 3.62 3.57 2.33 2.16 2.12 2.09 1.98 1.95 1.95 1.92 1.90 1.90 1.72 1.69 1.61 1.60 1.37 1.36 1.25 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x P:x P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">78 88 72 90 92 48 64 31 52 46 68 55 50 42 84 89 58 63 55 50 78 88 23 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.374</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">460</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">6.20 6.08 4.36 4.31 3.04 2.84 2.18 2.02 1.80 1.74 1.35 1.30 1.28 1.28 1.19 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">50 55 71 49 23 85 38 26 84 89 58 69 44 63 48 92 72</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.316</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">461</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">3.93 3.92 3.83 3.05 3.04 3.03 3.00 2.98 2.97 2.85 2.85 2.83 2.54 2.52 2.17 2.15 1.93 1.93 1.51 1.49 1.22 1.06 1.04 1.04 1.03 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:y P:y P:y P:y P:y P:y P:x P:x P:y P:y P:x P:x P:y P:y P:z P:z P:y P:y P:x P:x P:y P:z P:z P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">31 64 30 42 68 37 29 62 26 28 66 33 47 70 70 47 46 52 32 65 38 34 67 27 61 67 34</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.314</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">462</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">3.97 3.95 3.55 3.15 3.10 3.09 3.07 2.88 2.87 2.87 2.87 2.69 2.68 2.59 2.11 2.09 2.05 2.05 1.39 1.38 1.35 1.10 1.08 1.06 1.06 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:y P:y P:y P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:y P:z P:z P:y P:y P:x P:x P:y P:z P:z P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">48 92 93 86 85 88 78 79 99 24 77 63 58 73 58 63 72 90 80 53 23 94 87 94 87 74 76</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.266</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">463</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">4.22 3.81 3.76 3.76 3.52 3.01 3.00 2.93 2.82 2.82 2.49 2.48 2.05 2.04 2.00 1.99 1.70 1.70 1.63 1.63 1.51 1.50 1.50 1.49 1.30 1.29 1.24 1.24 1.23 1.23 1.16 1.16 1.16 1.16 1.15 1.15 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:y P:y P:x P:x P:y P:x P:x P:y P:z P:z P:z P:z P:y P:y P:y P:y P:x P:x P:x P:x P:z P:z P:z P:z P:y P:y P:z P:z P:x P:x D:xy D:xy D:xy D:xy P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">37 26 67 34 30 65 32 28 66 33 62 29 45 41 98 36 47 70 66 33 41 36 45 98 33 66 68 42 62 29 18 5 15 2 64 31 29 62</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O W W W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.263</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">464</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">4.02 3.75 3.62 3.61 3.60 3.16 3.15 3.14 2.77 2.76 2.53 2.52 2.09 2.06 2.00 1.98 1.70 1.70 1.51 1.51 1.50 1.49 1.47 1.44 1.38 1.38 1.25 1.23 1.20 1.19 1.18 1.18 1.18 1.18 1.14 1.13 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:y P:y P:x P:x P:y P:x P:x P:y P:z P:z P:z P:z P:y P:y P:y P:y P:x P:x P:x P:x P:z P:z P:z P:z P:x P:x P:y P:y P:z P:z P:z P:z D:xy D:xy D:xy D:xy P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">86 93 94 87 85 53 80 73 77 99 79 24 83 59 82 57 63 58 99 77 59 83 57 82 24 79 99 77 92 48 88 78 20 10 12 7 24 79</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.143</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">465</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">6.59 4.90 4.89 3.73 3.32 3.31 3.29 3.28 3.21 3.20 2.87 2.86 2.80 2.80 2.65 2.64 2.30 1.67 1.52 1.51 1.35 1.34 1.33 1.33 1.32 1.18</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:x P:x P:x P:x P:y P:y P:y P:y P:z P:z P:z P:z P:x P:x P:x P:x D:x2-y2 P:x P:z P:z P:y P:y P:z P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">22 27 61 28 97 35 36 98 43 54 45 41 25 60 98 36 100 30 44 69 41 45 30 97 35 22</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O Tc O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.138</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">466</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">6.24 6.20 4.01 3.06 3.03 2.36 2.36 2.16 2.14 2.12 2.11 2.03 2.00 1.83 1.83 1.78 1.77 1.73 1.70 1.65 1.64 1.64 1.53 1.52 1.48 1.48 1.48 1.47 1.47 1.31 1.30 1.29 1.28 1.25 1.14 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">P:x P:x P:x P:y P:y P:z P:z P:x P:x P:x P:x P:y P:y P:z P:z P:x P:x P:y P:y P:z P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:y P:y P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">76 74 21 57 82 95 51 91 75 81 56 81 56 89 84 78 88 59 83 86 56 81 59 83 63 58 72 90 85 59 83 73 95 51 96 86</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.109</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">467</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">3.58 3.50 3.19 3.14 2.83 2.77 2.56 2.32 2.31 2.23 2.20 1.89 1.88 1.87 1.66 1.66 1.66 1.62 1.61 1.61 1.40 1.34 1.33 1.20</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:y P:y P:z D:z2 P:x P:y P:y P:z P:z P:y P:y P:x P:x P:y P:y P:z P:z P:x D:x2-y2 P:z P:z D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">36 98 54 43 37 101 26 41 45 97 35 27 61 37 61 25 60 25 60 27 100 66 33 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O Tc O O O O O O O O O O O O O O Tc O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.104</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">468</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.91 2.87 2.86 2.82 2.76 2.43 2.33 2.31 2.30 2.29 2.28 2.26 2.22 1.77 1.70 1.69 1.67 1.55 1.53 1.50 1.50 1.37 1.37 1.34 1.21 1.18 1.07 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:z2 P:y P:y P:z P:z D:z2 P:z P:z P:y P:y P:y P:y P:x P:z P:z D:x2-y2 P:z P:x P:z P:z P:z P:y P:y D:x2-y2 P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">102 74 76 57 82 103 91 75 75 95 91 51 73 93 81 102 56 93 83 86 59 83 59 103 56 81 76 74</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">Tc O O O O Tc O O O O O O O O O Tc O O O O O O O Tc O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.075</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">469</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">6.68 6.63 6.16 6.05 4.96 4.88 4.71 4.68 2.01 1.98 1.65 1.64 1.62 1.60 1.58 1.57 1.57 1.57 1.53 1.53 1.52 1.49 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:x P:x P:x P:x P:y P:z P:x P:x P:y P:z P:x P:x D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">41 45 98 36 60 25 27 61 97 35 66 33 43 54 43 35 98 36 54 97 29 62 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.073</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">470</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">23.97 5.66 4.93 2.47 2.46 2.31 2.21 1.70 1.65 1.62 1.50 1.39 1.34 1.29 1.22 1.20 1.09 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:z D:xz D:xz P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:x P:z P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">39 101 103 71 49 55 50 96 64 31 40 48 92 82 23 57 50 55</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O Tc Tc O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.070</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">471</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">6.69 6.57 6.39 6.25 5.09 4.90 4.70 4.64 1.97 1.92 1.63 1.62 1.62 1.59 1.58 1.56 1.56 1.56 1.52 1.48 1.43 1.42 1.04 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:x P:x P:x P:z P:x P:x P:x P:z P:y P:x P:y P:x D:xy P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">82 57 59 83 91 75 76 74 51 95 81 56 99 51 77 83 59 95 81 79 56 24 103 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O O O O O O O O O O O O O Tc O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.057</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">472</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">2.61 2.40 2.33 2.33 1.85 1.81 1.80 1.66 1.66 1.63 1.61 1.61 1.59 1.59 1.26 1.17 1.16 1.11 1.11 1.10 1.08 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:y P:y P:z P:y P:y P:y P:y P:z P:y P:y P:y P:y P:x P:x P:x P:y P:y P:y P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">30 37 60 25 28 66 33 32 65 26 34 67 62 29 86 98 36 61 27 47 70 73</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.050</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">473</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">2.60 2.17 2.01 1.98 1.98 1.91 1.90 1.84 1.83 1.83 1.80 1.80 1.76 1.75 1.29 1.22 1.21 1.18 1.10 1.09 1.08 1.08 1.07 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:x P:x P:z P:y P:y P:y P:y P:y P:y P:z P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:y P:y P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">86 93 73 91 75 99 77 94 87 85 79 24 53 80 30 59 83 37 63 58 25 60 85 76 74</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-8.016</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">474</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">23.80 7.83 7.18 3.63 2.97 2.97 2.58 2.57 2.39 2.01 2.00 1.90 1.68 1.43 1.43 1.28 1.28</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:x P:z P:z D:z2 P:z P:z P:x P:x D:x2-y2 P:x P:x P:z D:xz P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">22 22 38 100 71 49 69 44 100 46 52 30 100 47 70 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O Tc O O O O Tc O O O Tc O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.993</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">475</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">13.11 4.87 4.82 2.37 2.36 2.36 2.35 2.27 2.26 2.25 2.25 1.41 1.39 1.35 1.34 1.31 1.30 1.30 1.27 1.02 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:y D:xy D:xy P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">39 103 101 90 46 72 52 58 63 47 70 82 57 41 45 55 50 71 49 95 83 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O Tc Tc O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.930</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">476</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">36.01 7.30 3.38 2.48 1.79 1.44 1.42 1.40 1.38 1.38 1.38 1.35 1.13 1.13 1.10 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:x P:z D:xz D:x2-y2 P:z P:y P:y P:z P:x P:z P:x S P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -24.020 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 2.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">21 21 102 102 23 59 83 83 88 59 78 21 72 90 75 91</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O Tc Tc O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.886</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">477</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.27 2.26 2.23 2.20 2.19 2.15 2.15 2.11 2.09 2.08 1.77 1.77 1.77 1.76 1.57 1.53 1.53 1.48 1.48 1.47 1.18 1.17 1.05 1.05 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:y P:y D:xy P:y P:y P:y P:y D:xy P:y P:y P:z P:z P:z P:z P:y P:z P:z P:y P:z P:z P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">46 52 100 90 72 47 70 102 58 63 51 97 95 35 22 52 46 21 72 90 44 69 89 84 36 98</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O Tc O O O O Tc O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.852</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">478</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">2.92 2.91 2.84 2.83 2.58 2.58 2.48 2.47 2.29 2.28 1.96 1.96 1.19 1.19 1.04 1.04 1.02 1.02 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:z P:z P:x P:x P:z P:z P:z P:z P:x P:x P:z P:z P:x P:x P:y P:y D:xy D:xy P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">95 51 74 76 56 81 97 35 61 27 54 43 24 79 51 95 9 19 62 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.834</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">479</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">4.25 4.24 3.49 3.49 3.03 3.02 2.35 2.35 1.62 1.62 1.21 1.21 1.16 1.16 1.16 1.15 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">P:z P:z P:z P:z P:x P:x P:x P:x P:z P:z P:x P:x P:z P:x P:z P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">54 43 56 81 61 27 74 76 97 35 65 32 95 97 51 35 80 53</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.817</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">480</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">1.53 1.46 1.45 1.44 1.39 1.36 1.35 1.32 1.32 1.31 1.31 1.26 1.26 1.23 1.22 1.22 1.21 1.21 1.20 1.20 1.20 1.20 1.16 1.15 1.14 1.13 1.07 1.03 1.03 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:x P:z P:y P:y P:x P:x P:x P:y P:y P:y P:y P:x P:x P:y P:y P:y P:y P:z P:z P:x P:z P:x P:x P:x P:x P:x P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">73 23 57 82 85 53 80 74 51 76 95 87 94 81 83 56 59 93 79 50 24 55 49 71 48 92 26 34 67 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.765</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">481</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">3.17 2.09 1.86 1.52 1.51 1.45 1.44 1.44 1.44 1.42 1.40 1.26 1.19 1.19 1.15 1.14 1.14 1.12 1.10 1.09 1.09 1.09 1.08 1.07 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:x P:x P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">39 26 28 43 54 34 67 27 61 65 32 85 29 62 66 33 22 89 80 84 33 66 53 73 37</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.761</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">482</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">5.74 2.47 2.46 2.44 2.41 2.39 2.26 2.25 2.25 2.24 2.22 1.86 1.80 1.68 1.61 1.12 1.08 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:y P:x P:x P:x P:x D:xy D:xy P:x P:x P:x P:x D:xy D:xy P:y P:y P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">39 52 46 90 72 102 100 84 69 44 89 101 103 21 22 96 40 49 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O Tc Tc O O O O Tc Tc O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.718</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">483</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.65 3.64 3.00 2.99 2.92 2.91 2.91 2.89 2.68 2.66 2.60 2.58 2.53 2.52 1.90 1.89 1.45 1.44 1.31 1.30 1.28 1.28 1.17 1.17 1.16 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">D:z2 D:z2 P:y P:y P:y P:y P:y P:y P:z P:z P:y P:y P:y P:y P:y P:y P:z P:z P:x P:x D:x2-y2 D:x2-y2 P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">1 14 98 36 61 27 43 54 25 60 35 97 60 25 45 41 61 27 67 34 14 1 33 66 29 62</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W O O O O O O O O O O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.717</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">484</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.48 3.47 3.06 3.06 2.84 2.84 2.72 2.72 2.53 2.50 2.48 2.46 2.43 2.41 1.63 1.63 1.43 1.41 1.33 1.33 1.21 1.21 1.14 1.13 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">D:z2 D:z2 P:y P:y P:y P:y P:y P:y P:z P:z P:y P:y P:y P:y P:y P:y P:z P:z P:x P:x D:x2-y2 D:x2-y2 P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">6 11 83 59 56 81 74 76 91 75 51 95 75 91 57 82 76 74 94 87 11 6 77 99 24 79</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W O O O O O O O O O O O O O O O O O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.675</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">485</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">9.19 6.28 4.99 3.46 3.46 2.78 2.77 2.67 2.65 2.65 2.58 2.33 2.32 2.32 1.95 1.34 1.28 1.15 1.14 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:z P:z P:x P:x P:x P:z P:z P:x P:x P:x P:x P:x P:z P:z P:z D:xz P:x P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">40 38 22 70 47 44 69 52 46 38 40 21 49 71 23 100 37 98 36 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O Tc O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.653</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">486</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">10.01 8.30 5.10 3.67 3.47 3.44 3.43 3.02 2.98 2.58 2.58 2.47 1.80 1.79 1.74 1.20 1.18 1.14 1.09 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:x P:z P:z P:x P:x P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">21 23 96 96 23 63 58 90 72 50 55 40 89 84 85 88 78 73 22 38</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.642</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">487</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">4.76 4.73 4.72 4.69 3.88 3.60 2.14 2.12 2.12 2.12 1.79 1.77 1.76 1.75 1.56 1.48 1.47 1.46 1.46 1.45 1.44 1.44 1.43 1.42 1.35 1.33 1.32 1.31 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:x P:x P:x P:x P:y P:y P:x P:x P:x P:x P:x P:x P:x P:x P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:x P:x D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">72 52 46 90 38 23 55 49 50 71 89 84 44 69 96 78 68 88 42 40 31 64 92 48 57 82 41 45 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.540</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">488</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.45 4.45 4.17 4.16 3.18 3.14 1.96 1.94 1.72 1.70 1.67 1.64 1.63 1.57 1.32 1.32 1.30 1.25 1.10 1.09 1.05 1.04 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:x P:x D:xz D:xz P:x P:x P:x P:x P:z P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">45 41 82 57 101 103 93 30 50 55 38 49 71 23 25 60 28 73 75 91 45 41 79 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O Tc Tc O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.520</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">489</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">10.03 9.48 5.84 2.50 2.50 2.30 2.29 1.45 1.45 1.44 1.42 1.37 1.33 1.31 1.30 1.23 1.21 1.20 1.19 1.16 1.14 1.09 1.09 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:y P:y P:y P:x P:x P:x P:x P:z P:z P:z P:z D:xy D:xy P:y P:y P:x P:x P:y P:y P:x P:x P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">23 38 39 90 72 46 52 52 90 72 46 103 101 55 50 48 92 49 71 64 31 48 92 31 64</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O Tc Tc O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.471</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">490</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">6.72 5.26 5.23 4.73 4.72 3.43 2.93 2.92 2.92 2.67 2.53 2.52 2.45 2.26 2.25 2.05 1.98 1.87 1.86 1.83 1.78 1.77 1.67 1.67 1.22 1.20 1.16 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:y P:y P:x P:x P:z P:y P:z P:y P:x P:y P:y P:z P:x P:x P:x P:z P:x P:x P:x P:z P:z P:y P:y P:z P:z P:z D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">85 77 99 83 59 73 94 96 87 86 53 80 86 77 99 73 93 84 89 21 87 94 79 24 75 91 21 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.460</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">491</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">8.10 6.93 4.82 4.79 3.79 3.78 3.72 3.72 3.50 3.12 2.92 2.30 2.29 2.25 2.24 1.81 1.79 1.76 1.75 1.61 1.55 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:z P:z P:y P:y P:y P:y P:y P:y P:x P:z P:z P:x P:x P:y P:y P:z P:z P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">26 28 66 33 32 65 67 34 28 37 30 66 33 62 29 67 34 36 98 26 22 37</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.402</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">492</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">10.58 6.38 6.15 4.45 4.08 2.87 1.71 1.70 1.68 1.67 1.61 1.60 1.55 1.54 1.21 1.21 1.20 1.19 1.16 1.12 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:y P:y P:y D:xy P:y D:xy P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -6.613 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.00 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">40 22 96 100 21 102 68 42 46 52 68 42 43 54 69 44 33 66 78 88 81 56</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O Tc O Tc O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.397</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">493</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">10.38 6.65 5.67 3.88 3.23 2.64 2.47 2.18 1.96 1.84 1.80 1.72 1.53 1.46 1.43 1.43 1.38 1.29 1.24 1.22 1.21 1.18 1.07 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:y P:y P:y D:xy P:y P:z P:z D:xy P:z P:z P:z P:z P:z P:z P:x P:z P:z P:x P:y P:y P:z P:z P:y P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">96 40 21 102 22 72 90 100 78 88 52 46 89 81 78 56 84 88 99 77 68 42 23 38 81</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O Tc O O O Tc O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.394</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">494</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">4.25 3.65 3.64 3.55 3.35 3.17 2.98 2.93 2.82 2.66 2.17 2.16 2.11 1.82 1.81 1.80 1.76 1.68 1.58 1.49 1.43 1.43 1.34 1.18 1.10 1.08 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:x P:x P:x P:x P:x P:z D:xz P:z P:z P:x P:z P:y P:y P:y D:x2-y2 P:y P:y P:y P:x P:z P:y P:z P:y P:z P:x D:x2-y2 P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">85 83 24 79 59 83 102 59 93 86 73 24 79 56 102 81 51 95 73 75 53 91 80 86 84 103 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O Tc O O O O O O O Tc O O O O O O O O O O Tc O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.386</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">495</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">3.72 3.72 3.63 3.61 3.33 3.33 1.90 1.77 1.77 1.71 1.71 1.58 1.58 1.54 1.54 1.53 1.48 1.48 1.47 1.40 1.37 1.34 1.34 1.32 1.32 1.30 1.29 1.20 1.20 1.20 1.19 1.18 1.11 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">P:x P:x D:z2 D:z2 P:x P:x P:x P:x P:x P:y P:y P:x P:x P:y P:y P:x P:x P:x P:x D:z2 D:z2 P:x P:x P:y P:y P:z P:z P:x P:y P:y P:y P:y D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">32 65 101 100 67 34 30 66 33 36 98 62 29 62 29 37 80 53 26 102 103 87 94 43 54 41 45 28 35 97 45 41 101 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">O O Tc Tc O O O O O O O O O O O O O O O Tc Tc O O O O O O O O O O O Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.380</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">496</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">3.73 3.73 3.45 3.44 3.16 3.10 2.50 2.50 2.32 2.29 1.57 1.57 1.55 1.54 1.51 1.37 1.36 1.23 1.23 1.22 1.19 1.19 1.11 1.07 1.06 1.05 1.04 1.03 1.02 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:x P:x P:x P:x D:z2 D:z2 P:y P:y P:y P:y P:x P:x P:z P:x D:z2 P:x P:x P:x P:x D:z2 P:x P:x P:x P:z P:z P:z P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">80 53 87 94 102 103 24 79 83 59 65 32 73 93 100 99 77 29 62 101 67 34 37 85 57 82 57 82 45 77 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O Tc Tc O O O O O O O O Tc O O O O Tc O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.343</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">497</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">6.93 6.67 2.52 2.43 2.01 1.99 1.96 1.96 1.77 1.72 1.69 1.69 1.63 1.62 1.62 1.61 1.54 1.50 1.42 1.42 1.25 1.23 1.13 1.13 1.11 1.09 1.08 1.07 1.05 1.04 1.03 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:y P:y D:xy D:xy P:x P:x P:x P:x P:y P:y P:z P:z P:y P:z P:z P:y P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -9.089 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 1.33 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">38 23 101 103 45 57 41 82 29 62 71 49 24 55 50 79 97 35 95 51 97 35 51 95 64 31 92 48 31 32 64 64 65</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O O Tc Tc O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.331</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">498</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.81 3.67 3.65 3.62 3.56 2.61 2.10 2.09 1.90 1.73 1.72 1.69 1.56 1.54 1.51 1.50 1.48 1.46 1.45 1.23 1.10 1.09 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">P:x P:x P:x P:y P:y P:z P:z P:z P:z P:x D:xz P:x P:x P:x P:y P:y P:x P:x P:x P:z P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">22 98 36 62 29 22 25 60 30 35 100 97 62 29 98 36 31 64 37 39 25 60 98 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">O O O O O O O O O O Tc O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.297</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">499</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">4.95 4.90 3.14 3.10 2.21 2.18 2.18 2.18 1.74 1.73 1.52 1.52 1.49 1.48 1.45 1.44 1.42 1.42 1.27 1.27 1.22 1.21 1.17 1.17 1.16 1.16 1.14 1.14 1.12 1.09 1.06 1.06 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:y P:y P:x P:x P:y P:y P:y P:y P:x P:x P:y P:y P:y P:y P:z P:z P:x P:x P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">27 61 74 76 43 54 36 98 45 41 35 97 62 29 59 83 31 64 46 52 51 95 79 24 36 98 35 97 56 81 92 48 66</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.282</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">500</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">4.70 4.66 3.43 3.43 2.85 2.82 2.77 2.74 2.51 2.51 2.32 2.30 1.67 1.65 1.57 1.56 1.28 1.28 1.20 1.19 1.10 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:z P:z P:x P:x P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">74 76 57 82 27 61 59 83 45 41 56 81 43 54 98 36 75 91 82 57 76 74</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.272</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">501</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">2.91 2.89 2.67 1.94 1.80 1.70 1.67 1.54 1.54 1.53 1.52 1.50 1.49 1.45 1.44 1.42 1.42 1.41 1.39 1.29 1.24 1.23 1.16 1.15 1.15 1.14 1.09</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:x P:x P:x P:x P:z P:z P:x P:x P:z P:z P:x P:y P:y P:y P:y P:x P:x P:z P:z D:xz P:z P:z P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">54 43 26 22 37 86 85 95 61 27 51 66 33 77 99 34 67 76 74 100 28 22 49 71 57 82 37</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O Tc O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.259</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">502</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">4.93 4.90 3.37 3.35 3.33 2.48 1.67 1.66 1.65 1.52 1.52 1.49 1.49 1.40 1.28 1.27 1.27 1.26 1.15 1.15 1.13 1.10 1.10 1.07 1.05 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:x P:x P:z P:z P:x P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:x P:z P:x P:x P:x P:x P:z P:z P:x P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">54 43 61 27 28 26 30 29 62 34 67 36 98 38 76 95 74 51 85 97 35 46 52 30 86 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.237</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">503</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">2.57 2.56 2.51 2.27 2.21 1.90 1.90 1.88 1.70 1.70 1.69 1.59 1.58 1.53 1.43 1.28 1.27 1.17 1.16 1.07 1.07 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:x P:x P:x P:x P:z P:z P:z P:z P:x P:x P:z P:x P:x P:z P:z P:x P:x P:z P:z P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">52 46 28 26 26 74 76 37 81 56 30 73 30 28 85 70 47 35 97 95 51 37</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.217</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">504</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">4.97 4.29 3.11 3.10 2.81 2.80 2.53 2.43 1.98 1.70 1.54 1.53 1.50 1.49 1.36 1.34 1.29 1.29 1.26 1.23 1.23 1.16 1.16 1.05 1.05 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:x P:x P:x P:x P:x P:z P:x P:x P:z P:z P:z P:x P:x P:z P:z P:z P:z P:z P:x P:x P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">85 73 72 90 56 81 93 93 21 86 59 83 63 58 56 81 24 79 23 48 92 51 95 28 48 92</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.184</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">505</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">9.19 2.95 2.66 2.65 2.36 2.17 2.11 2.10 2.01 1.91 1.70 1.67 1.63 1.63 1.60 1.60 1.37 1.36 1.36 1.36 1.35 1.34 1.32 1.22 1.21 1.13 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:x P:z P:z P:z P:z P:y P:y P:z P:x P:y P:y P:z P:z P:y P:y P:y P:x P:y P:x P:z P:z P:x P:x P:x P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">73 86 56 81 85 93 84 89 28 93 79 24 58 63 50 55 91 78 75 88 89 84 85 81 56 96 77 99</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.162</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">506</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">6.43 6.13 3.00 2.43 2.43 2.24 2.24 2.04 2.04 1.94 1.76 1.71 1.55 1.54 1.54 1.54 1.46 1.46 1.44 1.44 1.43 1.30 1.29 1.18 1.18 1.07 1.06 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:z P:z P:x P:y P:y P:y P:y P:z P:z P:z P:z P:x P:y P:z P:y P:z P:x P:x P:z P:z P:x P:z P:z P:x P:x P:z P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">28 26 30 69 44 71 49 54 43 73 85 37 66 44 33 69 54 43 47 70 22 97 35 42 68 49 71 25 60</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.128</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">507</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">3.24 2.45 2.44 2.40 2.39 2.22 2.21 2.15 2.14 1.84 1.67 1.47 1.46 1.44 1.43 1.36 1.35 1.24 1.24 1.23 1.23 1.15 1.14 1.12 1.12 1.11 1.11 1.09 1.09 1.08 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:y P:y P:y P:z P:z P:z P:z P:y P:y P:y P:y P:x P:x P:x P:x P:x P:x P:z P:x P:z P:x P:y P:y P:x P:x P:z P:z P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">39 90 72 91 75 25 60 46 52 21 22 45 41 57 82 56 81 72 43 90 54 53 80 59 83 52 46 81 56 32 65</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.070</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">508</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">2.26 2.25 2.07 2.05 1.88 1.87 1.69 1.69 1.67 1.66 1.59 1.59 1.50 1.49 1.48 1.44 1.43 1.39 1.35 1.34 1.32 1.31 1.24 1.23 1.17 1.17 1.16 1.15 1.14 1.14 1.08 1.07 1.06 1.05 1.03 1.02 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:x P:x P:y P:x P:x P:z P:z P:y P:x P:x P:y P:y P:x P:x P:y P:x P:x P:y P:y P:y P:x P:x P:x P:x P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">46 52 90 72 52 46 60 25 72 90 49 71 22 55 50 91 75 21 43 54 34 67 56 81 94 35 97 87 32 65 59 83 98 36 51 95 49 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.021</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">509</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">9.23 9.09 3.49 3.43 2.91 2.89 2.78 2.76 2.22 2.20 2.07 2.03 1.89 1.86 1.66 1.65 1.56 1.55 1.49 1.30 1.27 1.20 1.18 1.16 1.15</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:x P:x P:x P:x P:y P:y P:y P:y P:y P:y P:y P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">70 47 65 32 66 33 54 43 42 68 63 58 69 44 33 66 97 35 40 69 44 67 34 65 32</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-7.020</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">510</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">8.99 8.83 3.59 3.54 3.23 3.20 2.70 2.67 2.41 2.39 2.06 2.03 1.80 1.77 1.76 1.76 1.53 1.41 1.40 1.31 1.30 1.18 1.17 1.06 1.06 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:z P:z P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:z P:z P:x P:x P:y P:y P:y P:y P:y P:x P:x P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">63 58 53 80 99 77 56 81 78 88 89 84 70 47 77 99 96 51 95 89 84 53 80 94 59 83 87</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.992</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">511</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">6.77 6.64 5.77 5.15 2.72 2.71 2.29 2.29 2.13 2.11 2.07 2.04 2.00 2.00 1.82 1.65 1.55 1.53 1.24 1.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y P:z P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">47 70 30 37 34 67 32 65 58 63 32 65 67 34 93 86 31 64 68 42</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.990</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">512</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">6.61 6.52 5.71 5.37 2.66 2.64 2.34 2.34 2.15 2.12 2.10 2.09 2.06 1.97 1.80 1.68 1.51 1.41 1.38 1.28</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:z P:z P:z P:z P:z P:z P:z P:z P:y P:z P:y P:y P:z P:y P:z P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">63 58 93 86 87 94 80 53 80 70 94 53 47 87 30 37 92 48 88 78</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.986</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">513</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">3.71 3.65 3.50 3.37 2.47 2.41 2.21 2.12 1.95 1.89 1.85 1.78 1.72 1.71 1.57 1.55 1.36 1.35 1.22 1.21 1.15 1.11 1.10 1.10 1.09 1.09 1.08 1.07 1.07 1.06 1.05 1.04 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:y P:x P:x P:x P:y P:x P:x P:y P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">29 62 79 24 66 33 99 77 64 31 48 92 70 47 58 63 52 46 90 72 50 49 87 62 29 55 42 71 79 34 24 68 38</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.965</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">514</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">4.51 4.44 4.29 4.24 2.49 2.41 2.36 2.28 2.04 1.97 1.85 1.82 1.77 1.74 1.64 1.62 1.61 1.60 1.55 1.55 1.55 1.54 1.54 1.53 1.51 1.49 1.45 1.44 1.40 1.39 1.37 1.33 1.28 1.25 1.18 1.15 1.10 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:x P:x P:x P:x P:x P:y P:y P:x P:x P:x P:x P:x P:y P:y P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">79 24 29 62 92 48 31 64 23 38 95 51 35 97 58 77 99 63 47 70 90 72 66 33 52 46 92 48 31 64 79 24 29 62 95 51 35 97</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.953</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">515</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">8.30 4.21 3.92 3.82 3.71 3.53 3.46 2.82 2.65 1.70 1.69 1.56 1.54 1.47 1.37 1.29 1.12 1.04 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:z P:z P:z P:y P:y P:y P:y P:z P:z P:y P:y P:y P:y P:x P:z P:x P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">39 28 73 48 92 64 31 93 30 69 44 84 89 93 26 30 85 24 79</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.906</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">516</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">8.41 8.38 8.34 5.65 3.74 3.68 2.88 2.80 2.78 2.59 2.56 2.34 2.30 2.06 1.72 1.49 1.47 1.18 1.17 1.09 1.09 1.08 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:z P:y P:x P:x P:x P:x P:x P:x P:z P:z P:y P:y P:z P:z P:x P:x P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">88 86 78 86 63 58 93 84 89 78 88 48 92 85 93 83 59 89 84 53 99 77 80</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.898</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">517</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">7.71 6.50 6.45 6.09 3.68 3.59 3.54 2.87 2.78 2.77 2.48 2.44 2.17 2.17 2.05 2.04 1.94 1.91 1.61 1.61 1.37 1.28 1.25</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:z P:y P:y P:x P:x P:x P:x P:z P:y P:y P:y P:y P:x P:x P:y P:y P:z P:z P:x P:x P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">37 68 42 37 30 70 47 30 31 64 69 44 69 44 32 65 68 42 98 36 28 67 34</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.887</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">518</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">6.39 5.45 5.06 3.48 3.46 2.50 2.14 2.13 2.08 2.08 1.95 1.88 1.73 1.72 1.64 1.63 1.46 1.45 1.31 1.26 1.25 1.22 1.12 1.11 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z P:z P:y P:y P:z P:y P:y P:y P:y P:z P:x P:y P:y P:x P:x P:z P:z P:z P:z P:z P:z P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">85 93 28 48 92 30 31 64 55 50 73 93 69 44 55 50 75 91 37 92 48 86 73 88 78</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.884</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">519</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">5.85 4.96 4.35 4.27 3.70 3.58 3.47 2.39 2.38 2.08 1.91 1.83 1.79 1.78 1.69 1.60 1.59 1.58 1.57 1.49 1.43 1.42 1.41 1.36 1.36 1.22 1.22 1.14 1.12 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">P:z P:z P:y P:y P:z P:y P:y P:y P:y P:x P:z P:x P:y P:y P:y P:x P:x P:z P:y P:z P:z P:x P:x P:y P:x P:y P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">26 85 55 50 73 89 84 71 49 85 37 73 68 42 53 77 99 30 80 89 84 79 24 94 28 87 96 23 55 50</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.879</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">520</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">7.50 4.79 4.76 3.13 2.85 2.84 2.78 2.28 2.23 2.22 2.20 2.18 2.07 1.88 1.84 1.84 1.80 1.68 1.63 1.61 1.50 1.50 1.41 1.40 1.21 1.20 1.18 1.16 1.15 1.08 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:z P:y P:y P:z P:y P:y P:z P:y P:y P:z P:y P:y P:x P:z P:x P:x P:x P:z P:z P:z P:x P:x P:y P:y P:y P:x P:y P:z P:z P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">26 49 71 28 69 44 73 89 55 85 84 50 28 38 66 33 26 40 44 69 29 62 42 68 32 85 65 49 71 37 53</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.863</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">521</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">12.22 12.08 10.01 9.94 7.74 7.69 3.18 3.12 2.42 2.41 2.11 2.09 1.86 1.83 1.46 1.44 1.31 1.28 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:x P:x P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">70 47 67 34 65 32 71 49 69 44 67 34 65 32 71 49 67 34 38</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.861</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">522</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">12.28 12.07 9.99 9.95 7.74 7.67 3.25 3.05 2.50 2.34 2.12 2.05 1.88 1.84 1.48 1.45 1.33 1.26 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:x P:x P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">63 58 87 94 80 53 50 55 84 89 87 94 80 53 50 55 94 87 23</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.833</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">523</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">7.09 6.92 5.07 3.52 2.91 2.88 2.87 2.85 2.76 2.51 2.50 2.39 2.34 2.09 2.03 2.01 1.99 1.74 1.68 1.68 1.66 1.41 1.38 1.34 1.11 1.10 1.10 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:x P:x P:x P:x P:x P:x P:y P:z P:y P:x P:x P:x P:z P:y P:y P:x P:x P:x P:x P:x P:z P:y P:y P:x P:x P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">47 70 37 26 34 67 34 37 67 46 52 30 40 32 65 32 65 58 28 63 38 29 62 86 33 66 85 86</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.823</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">524</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">6.87 6.66 5.54 3.59 3.58 2.92 2.86 2.83 2.66 2.21 2.19 2.16 2.14 2.12 2.11 2.08 1.90 1.87 1.71 1.68 1.58 1.58 1.39 1.39 1.38 1.31 1.26 1.15 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:x P:x P:x P:x P:x P:x P:x P:y P:y P:y P:x P:x P:y P:x P:x P:x P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:z P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">58 63 86 93 85 87 94 87 94 80 72 90 53 73 80 53 86 96 47 70 99 77 24 37 79 30 23 79 24</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.787</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">525</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">2.98 2.98 2.91 2.82 2.79 2.70 2.51 2.51 2.51 2.47 2.45 2.38 2.30 2.23 2.04 2.00 1.98 1.96 1.69 1.69 1.54 1.49 1.30 1.29 1.19 1.16 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:x P:x P:x P:x P:y P:y P:x P:x P:x P:y P:x P:y P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">46 52 45 41 38 40 72 82 90 23 57 96 98 36 43 83 54 59 35 97 56 81 95 51 39 42 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.784</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">526</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">7.29 2.67 2.62 2.37 2.37 1.78 1.78 1.47 1.46 1.46 1.41 1.29 1.27 1.26 1.26 1.25 1.22 1.21 1.20 1.20 1.19 1.17 1.15 1.15 1.14 1.14 1.13 1.13 1.12 1.12 1.06 1.05 1.05 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">P:z P:z P:x P:x P:z P:z P:z P:z P:y P:y P:z P:z P:z P:z P:z P:z P:y P:y P:y P:z P:y P:z P:y P:y P:z P:z P:y P:y P:x P:x P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">39 86 30 93 37 74 76 28 48 92 26 29 62 93 27 61 78 88 50 85 55 24 49 71 79 73 64 31 41 36 98 45 28 73 62 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.769</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">527</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">2.82 2.80 2.79 2.78 2.65 2.44 2.43 2.42 2.41 2.32 2.31 2.10 2.10 2.08 2.03 1.94 1.94 1.84 1.82 1.70 1.70 1.69 1.68 1.63 1.36 1.35 1.28 1.26 1.14 1.14 1.13 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">P:x P:x P:x P:x P:y P:x P:x P:x P:x P:x P:x P:y P:x P:x P:y P:x P:x P:x P:x P:x P:x P:x P:x P:y P:x P:x P:z P:z P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">51 95 72 90 96 35 97 83 59 46 52 40 82 57 23 36 98 56 81 54 43 41 45 38 84 89 88 78 44 69 42 68</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.752</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">528</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">7.45 3.58 3.58 3.50 2.78 2.77 2.46 2.11 2.11 2.06 2.03 2.03 2.02 1.93 1.92 1.77 1.76 1.71 1.59 1.59 1.44 1.44 1.18 1.14 1.13 1.13 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:z P:x P:x P:z P:x P:x P:z P:x P:x P:y P:x P:y P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:z P:y P:z P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">30 54 43 37 97 35 28 42 68 64 36 31 98 69 44 33 66 40 62 29 68 42 40 98 64 36 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.743</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">529</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">5.93 5.38 4.07 4.04 2.88 2.86 2.14 1.88 1.87 1.84 1.84 1.80 1.66 1.66 1.65 1.64 1.56 1.36 1.36 1.30 1.29 1.28 1.28 1.26 1.14 1.13 1.11 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">P:z P:z P:x P:x P:x P:x P:z P:x P:x P:x P:x P:x P:z P:x P:x P:z P:z P:x P:x P:y P:x P:x P:x P:y P:z P:z P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">93 86 81 56 95 51 73 96 59 83 89 84 78 78 88 88 96 24 79 48 77 99 21 92 92 48 23 78 88</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.729</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">530</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">3.08 2.39 2.38 2.18 2.17 2.15 1.90 1.88 1.60 1.59 1.42 1.35 1.32 1.31 1.30 1.29 1.29 1.25 1.25 1.22 1.20 1.20 1.17 1.13 1.12 1.09 1.09 1.09 1.08 1.06 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">P:z P:z P:z P:z P:z P:z P:y P:y P:z P:z P:z P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:y P:z P:y P:y P:y P:y P:y P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">93 63 58 47 70 73 92 48 26 37 30 42 68 71 50 55 49 89 84 31 64 28 76 85 94 74 78 87 88 27 78</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.728</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">531</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">7.49 7.41 3.91 3.86 3.80 3.73 3.57 3.52 3.20 3.18 1.88 1.86 1.79 1.78 1.77 1.72 1.66 1.61 1.47 1.43</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:z P:y P:z P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">25 60 75 91 61 27 41 45 36 98 36 41 98 74 45 76 82 57 83 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.719</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">532</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">5.63 5.62 4.65 4.64 4.36 4.33 3.99 3.98 2.79 2.78 2.77 2.77 2.50 2.49 2.19 2.18 1.75 1.72 1.70 1.68</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">75 91 74 76 82 57 83 59 27 61 41 45 98 36 60 25 57 82 59 83</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.712</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">533</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">7.79 7.54 4.80 4.73 4.07 3.99 3.54 3.49 2.38 2.27 2.06 2.00 1.94 1.87 1.82 1.76 1.24 1.21 1.19 1.18 1.16 1.15 1.11 1.11 1.10 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:x P:x P:x P:x P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:y P:x P:y P:y P:x P:y P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">25 60 49 71 44 69 25 60 91 75 49 71 47 70 44 69 32 55 65 41 50 45 31 64 89 84</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.707</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">534</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">4.15 4.08 3.85 3.79 2.72 2.27 2.23 2.11 1.95 1.89 1.89 1.77 1.71 1.54 1.53 1.48 1.47 1.45 1.43 1.37 1.33 1.23 1.18 1.18 1.04 1.03 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">61 27 76 74 39 60 86 25 37 91 75 85 26 95 51 35 97 78 88 68 42 73 59 83 58 63 98 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.706</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">535</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">7.34 7.16 5.26 5.19 5.04 4.98 4.16 4.02 2.16 2.11 1.99 1.99 1.98 1.96 1.93 1.93 1.77 1.74 1.46 1.46 1.44 1.39 1.23 1.17 1.11 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">P:z P:z P:y P:x P:y P:x P:x P:x P:z P:z P:z P:z P:z P:z P:y P:y P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">91 75 91 55 75 50 89 84 55 50 60 25 58 63 25 60 89 84 71 49 92 48 95 51 69 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.689</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">536</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">6.45 6.43 4.13 4.11 2.99 2.99 2.64 2.49 2.30 1.95 1.92 1.91 1.83 1.79 1.64 1.55 1.44 1.44 1.42 1.34 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:z P:z P:x P:x P:x P:x P:z P:z P:z P:y P:y P:z P:z P:z P:x P:x P:z P:z P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">60 25 71 49 69 44 75 91 30 25 60 38 74 76 50 55 71 49 84 89 38</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.687</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">537</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">9.52 9.45 8.18 8.07 2.30 2.28 2.14 2.14 2.11 2.08 1.52 1.49 1.47 1.46 1.44 1.40 1.40 1.38 1.14 1.13 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:x P:z P:x P:z P:z P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">27 61 76 74 42 68 31 64 78 88 92 48 42 68 73 91 28 75 78 88 64 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.679</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">538</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">7.11 6.89 4.34 4.19 3.34 3.31 2.72 2.62 2.58 2.55 2.25 2.23 1.82 1.76 1.63 1.57 1.45 1.42 1.41 1.37 1.37 1.29 1.28 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z P:x P:x P:z P:z P:x P:x P:z P:z P:x P:x P:y P:y P:z P:z P:x P:z P:x P:z P:x P:x P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">75 91 50 55 60 25 84 89 93 23 71 49 75 91 50 55 51 30 95 38 23 69 44 48 48</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.641</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">539</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">13.95 3.14 3.04 3.01 2.71 2.41 2.40 2.29 2.06 2.01 1.98 1.87 1.80 1.41 1.37 1.36 1.31 1.31 1.26 1.21 1.14 1.07 1.06 1.05 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:x P:x P:x P:x P:z P:z P:z P:x P:x P:z P:x P:x P:z P:z P:z P:x P:x P:z P:x P:x P:x P:x P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">39 31 64 92 48 27 76 61 35 97 74 95 51 31 64 92 73 28 48 55 50 71 78 49 99</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.639</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">540</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">6.49 6.22 5.57 5.51 3.13 3.04 3.03 3.03 2.59 2.58 2.46 2.40 2.18 2.10 1.99 1.96 1.92 1.88 1.86 1.71 1.65 1.65 1.39 1.32 1.31 1.18 1.17 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x P:x P:y P:x P:x P:x P:x P:x P:y P:y P:y P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">74 76 27 61 75 91 90 72 52 46 60 25 88 78 48 23 42 68 92 31 64 38 96 76 74 27 61 40</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.634</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">541</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">6.73 6.43 5.70 5.40 3.01 2.78 2.73 2.67 2.63 2.61 2.58 2.45 2.39 2.36 2.30 2.28 2.14 2.03 1.77 1.69 1.67 1.45 1.13 1.09 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">P:z P:z P:z P:z P:x P:x P:z P:z P:z P:z P:x P:z P:x P:z P:z P:z P:x P:x P:x P:y P:x P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">61 27 74 76 64 31 52 46 25 60 48 75 92 91 90 72 68 42 88 38 78 23 40 61 27</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.460</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">542</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">27.26 4.32 3.43 3.32 3.31 3.06 3.05 1.82 1.80 1.77 1.74 1.63 1.63 1.49 1.49 1.37 1.37 1.37 1.35</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:y P:y P:y P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:x P:x P:x P:y P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">39 21 22 51 95 35 97 35 97 95 51 81 56 82 57 41 43 54 45</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.454</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">543</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">53.56 4.79 4.79 2.67 2.48 2.47 2.28 2.25 1.87 1.86 1.66 1.65 1.25</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">P:y P:x P:x P:y P:x P:x P:y P:y P:y P:y P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 11.031</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">22 54 43 21 68 42 54 43 36 98 98 36 106</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">O O O O O O O O O O O O H</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.450</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">544</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">43.84 4.83 3.38 3.36 3.34 3.30 1.86 1.84 1.58 1.46 1.46 1.13 1.12 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">P:y P:y P:x P:x P:y P:y P:x P:x P:y P:x P:x P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 11.031</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">21 39 56 81 81 56 83 59 22 78 88 35 97 107</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">O O O O O O O O O O O O O H</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.442</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">545</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">3.71 3.70 3.49 3.26 2.69 2.68 2.31 2.29 2.25 2.23 2.07 2.06 1.80 1.80 1.76 1.76 1.51 1.50 1.50 1.50 1.46 1.46 1.37 1.37 1.34 1.33 1.29 1.28 1.23 1.23 1.20 1.19 1.19 1.19 1.17 1.16 1.09 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:z P:z P:y P:y P:y P:y P:y P:y P:z P:z P:x P:x P:x P:x P:z P:z P:x P:y P:y P:x P:z P:z P:y P:y P:y P:y P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">97 35 21 39 35 97 43 54 36 98 97 35 31 64 54 43 32 95 51 65 41 45 98 36 62 29 27 61 33 66 32 65 47 70 62 29 62 29</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.440</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">546</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">6.70 3.85 3.83 3.82 2.72 2.71 2.39 2.38 2.21 2.19 2.17 2.16 2.08 2.06 2.06 2.03 1.80 1.72 1.53 1.52 1.46 1.45 1.36 1.33 1.28 1.24 1.21 1.19 1.18 1.18 1.18 1.17 1.11 1.06 1.04 1.03 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">P:y P:z P:z P:y P:x P:x P:y P:y P:x P:x P:y P:y P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:y P:y P:x P:x P:z P:z P:z P:z P:y P:z P:z P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">39 95 51 21 95 51 59 83 92 48 51 95 59 83 81 56 53 80 56 81 88 78 79 24 79 24 79 24 35 97 57 82 53 80 99 58 63 77</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.437</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">547</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">2.77 2.75 2.69 2.69 2.68 2.61 2.55 2.53 2.52 2.49 2.41 2.40 2.39 2.35 2.35 2.34 2.19 2.14 2.09 2.08 1.72 1.70 1.70 1.69 1.59 1.58 1.55 1.55 1.44 1.43 1.40 1.39 1.39 1.38 1.38 1.34 1.32 1.27 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">P:x P:x P:x P:x P:x P:x P:z P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">80 53 32 65 94 87 24 67 34 79 77 62 29 99 33 66 94 87 67 34 80 32 65 53 24 79 62 29 73 77 93 33 99 66 28 85 30 26 37 86</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.406</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">548</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="45">4.89 2.30 2.29 2.28 2.28 2.23 2.21 2.20 2.17 2.17 2.13 2.12 2.09 2.07 2.06 1.93 1.92 1.90 1.90 1.90 1.89 1.83 1.82 1.64 1.64 1.53 1.52 1.50 1.42 1.40 1.39 1.38 1.35 1.35 1.33 1.33 1.32 1.29 1.28 1.26 1.22 1.21 1.21 1.17 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="45">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="45">P:z P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x P:x P:x P:x P:x P:x P:z P:z P:x P:x P:z P:z P:x P:x P:x P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="45"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="45">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="45">39 62 29 24 79 94 32 53 65 34 67 26 85 80 87 66 33 77 94 34 67 99 87 93 30 62 79 29 24 37 32 65 73 28 53 80 86 77 66 33 41 57 45 99 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="45">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.391</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">549</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">6.10 6.03 5.16 5.10 4.94 4.93 4.45 4.40 4.34 4.32 4.06 4.00 3.80 3.79 2.91 2.90 2.77 1.15 1.12 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">P:x P:x P:x P:x P:y P:y P:x P:x P:y P:y P:x P:x P:y P:y P:y P:y P:y P:z P:z P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">67 34 33 66 45 41 65 32 43 54 29 62 98 36 35 97 22 67 34 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.388</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">550</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">6.24 6.00 5.32 5.15 5.11 5.06 4.51 4.43 4.26 4.06 3.96 3.80 3.57 3.52 2.94 2.81 2.77 1.25 1.18 1.16 1.15 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:x P:x P:x P:x P:y P:y P:y P:y P:x P:x P:x P:x P:y P:y P:y P:y P:y P:z P:x P:x P:z P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">87 94 99 77 82 57 56 81 80 53 24 79 83 59 21 51 95 87 56 81 94 57 82</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.288</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">551</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="42">4.05 3.92 3.74 3.21 3.11 3.09 2.97 2.96 2.88 2.88 2.87 2.87 2.73 2.58 2.53 2.18 1.95 1.94 1.94 1.93 1.89 1.88 1.84 1.83 1.82 1.61 1.61 1.60 1.52 1.50 1.20 1.17 1.14 1.14 1.10 1.09 1.08 1.08 1.07 1.06 1.05 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="42">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="42">P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y P:z P:z P:x P:x P:z P:y P:y P:y P:y P:y P:y P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="42"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="42">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="42">30 37 26 28 97 35 54 43 36 45 98 41 93 86 85 73 95 81 51 56 59 83 57 82 37 30 35 97 43 54 26 86 61 27 93 45 41 98 36 51 95 28</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="42">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.282</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">552</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">3.80 3.58 3.56 3.42 3.22 3.12 3.10 2.93 2.86 2.83 2.82 2.81 2.42 2.41 2.39 2.19 2.06 2.05 2.04 1.85 1.85 1.84 1.83 1.81 1.67 1.55 1.54 1.52 1.51 1.34 1.18 1.17 1.14 1.09 1.03 1.03 1.02 1.02 1.02 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">P:x P:z P:z P:x P:x P:z P:z P:x P:z P:z P:z P:z P:x P:z P:z P:x P:z P:z P:x P:z P:z P:z P:z P:x P:z P:y P:y P:y P:y P:z P:y P:y P:z P:z P:y P:z P:x P:x P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">93 95 51 86 73 57 82 85 81 56 59 83 30 97 35 37 45 41 28 54 43 36 98 26 86 51 95 56 81 93 83 59 39 37 43 85 74 76 54 35</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.261</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">553</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">9.02 9.00 7.63 7.56 4.44 4.41 3.85 3.85 3.51 3.48 3.47 3.47 3.43 3.43 3.09 3.08 1.67 1.54 1.47 1.34 1.34 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">61 27 25 60 61 27 33 66 25 32 65 60 29 62 34 67 26 28 37 32 65 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.259</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">554</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">9.12 8.78 7.82 7.50 4.39 4.36 3.86 3.83 3.59 3.50 3.47 3.47 3.46 3.46 3.10 3.10 1.69 1.53 1.47 1.36 1.33 1.31 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:y P:y P:y P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:x P:x P:y P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">76 74 91 75 76 74 99 77 91 53 75 79 80 24 94 87 85 73 86 53 80 93 79</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.252</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">555</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">11.96 11.17 10.00 9.94 9.87 9.78 7.66 7.64 1.44 1.44</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">P:x P:x P:y P:y P:y P:y P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">28 26 27 61 60 25 37 30 60 25</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.249</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">556</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">11.67 11.23 10.27 9.97 9.88 9.60 7.85 7.62 1.42 1.36</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">P:x P:x P:y P:y P:y P:y P:x P:x P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">73 85 74 75 76 91 86 93 75 91</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.071</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">557</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">3.42 3.39 3.33 3.33 3.17 3.15 3.11 3.10 2.92 2.91 2.83 2.83 2.78 2.77 2.67 2.67 2.31 2.30 2.28 2.28 2.24 2.22 1.97 1.97 1.87 1.87 1.78 1.78 1.74 1.73 1.68 1.68</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">P:y P:y P:z P:z P:z P:z P:x P:x P:y P:y P:x P:x P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">43 54 29 62 33 66 29 62 35 97 32 65 33 66 34 67 36 98 34 67 41 45 97 35 54 43 65 32 45 41 98 36</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-6.068</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">558</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">3.34 3.32 3.31 3.29 3.15 3.14 3.04 3.03 2.90 2.88 2.87 2.83 2.73 2.73 2.73 2.72 2.31 2.30 2.29 2.29 2.27 2.24 1.99 1.98 1.88 1.87 1.81 1.80 1.80 1.78 1.72 1.70</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">P:y P:y P:z P:z P:z P:z P:x P:x P:x P:x P:y P:y P:x P:x P:x P:x P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:z P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">56 81 24 79 99 77 24 79 80 53 51 95 99 87 77 94 59 87 83 94 57 82 95 51 81 56 80 53 82 57 83 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-5.943</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">559</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">11.10 11.06 8.26 7.95 7.14 6.54 5.40 5.38 1.60 1.57 1.57 1.16 1.10 1.09 1.02 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">P:y P:y P:x P:x P:x P:x P:y P:y P:z P:z P:z P:z P:x P:x P:x P:x P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">61 27 37 30 28 26 60 25 37 25 60 30 65 32 62 29 43</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">O O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-5.941</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">1.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">560</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">10.94 10.92 8.16 7.81 7.26 6.69 5.50 5.49 1.59 1.58 1.57 1.14 1.11 1.10 1.03 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">P:y P:y P:x P:x P:x P:x P:y P:y P:z P:z P:z P:z P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">74 76 86 93 73 85 75 91 91 86 75 93 53 80 79 24</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">O O O O O O O O O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.587</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">561</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="6">25.60 25.35 5.34 5.31 2.79 2.57</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="6">1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="6">D:xz D:xz D:z2 D:z2 D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="6"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="6">1.00 1.00 1.00 1.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="6">101 103 101 103 101 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="6">Tc Tc Tc Tc Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.577</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">562</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">9.90 9.43 6.58 6.37 2.90 2.64 2.41 2.39 2.29 2.29 2.14 2.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">1.00 1.00 1.00 1.00 1.00 1.00 0.80 0.80 0.80 0.80 1.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">103 101 102 100 103 101 6 11 1 14 102 100 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">Tc Tc Tc Tc Tc Tc W W W W Tc Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.568</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">563</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="12">8.56 8.21 7.21 6.70 3.46 3.36 2.43 2.43 2.35 2.31 2.29 2.26</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="12">1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="12">D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:z2 D:z2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="12"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -4.498 -4.498 -6.613 -4.498 -4.498 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="12">1.00 1.00 1.00 1.00 1.00 1.00 0.80 0.80 1.00 0.80 0.80 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="12">101 103 100 102 101 103 1 14 100 6 11 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="12">Tc Tc Tc Tc Tc Tc W W Tc W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.495</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">564</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="2">34.89 34.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="2">1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="2">D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="2"
                               units="nonsi:electronvolt">-6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="2">1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="2">101 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="2">Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.378</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">565</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">55.64 9.62 3.87 1.22 1.21 1.12 1.10 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">D:xz D:xz D:z2 P:x P:x D:z2 D:z2 P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">1.00 1.00 1.00 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">102 100 102 88 78 8 13 21</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">Tc Tc Tc O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.367</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">566</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">55.97 9.09 3.52 1.20 1.17 1.17 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">D:xz D:xz D:z2 P:z P:x P:x D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">1.00 1.00 1.00 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">100 102 100 22 42 68 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">Tc Tc Tc O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.328</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">567</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">11.04 9.92 7.74 7.23 4.04 3.68 2.83 2.60 1.53 1.41 1.24 1.15 1.12 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">102 100 103 101 102 100 103 101 73 28 86 85 37 26</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">Tc Tc Tc Tc Tc Tc Tc Tc O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.321</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">568</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">10.24 9.53 8.43 7.71 3.80 3.56 3.26 2.94 1.48 1.36 1.24 1.19 1.13 1.11 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">100 102 101 103 100 102 101 103 28 73 26 37 85 86 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">Tc Tc Tc Tc Tc Tc Tc Tc O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.190</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">569</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="8">52.70 8.98 7.58 1.32 1.32 1.31 1.29 1.28</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="8">1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="8">D:xy D:xy P:y D:z2 D:z2 P:y D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="8"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="8">1.00 1.00 1.33 0.80 0.80 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="8">100 102 22 17 4 21 2 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="8">Tc Tc O W W O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.186</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">570</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="9">51.87 9.03 7.48 1.37 1.36 1.36 1.35 1.29 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="9">1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="9">D:xy D:xy P:y D:z2 D:z2 D:xz D:xz P:y D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="9"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="9">1.00 1.00 1.33 0.80 0.80 0.80 0.80 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="9">102 100 21 13 8 10 20 22 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="9">Tc Tc O W W W W O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.124</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">571</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">4.92 4.90 4.83 4.81 3.37 3.37 3.15 3.15 2.72 1.84 1.83 1.64 1.64 1.47 1.46 1.36 1.36 1.21 1.20 1.13 1.13 1.12 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xz D:xz P:y P:y D:xz D:xz D:z2 D:z2 P:y P:y P:y P:y D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">18 5 15 2 3 16 4 17 100 5 18 45 41 2 15 5 18 35 97 98 36 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">W W W W W W W W Tc W W O O W W W W O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-3.119</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">572</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">4.84 4.82 4.74 4.73 3.39 3.37 3.33 3.18 3.17 1.85 1.82 1.64 1.63 1.38 1.35 1.34 1.33 1.23 1.23 1.16 1.14 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xz D:xz P:y P:y D:xz D:xz D:z2 D:z2 P:y P:y D:yz D:yz P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">12 7 20 10 9 19 102 8 13 7 12 82 57 10 20 7 12 51 95 8 13 83 59</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">W W W W W W Tc W W W W O O W W W W O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.942</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">573</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="6">21.66 21.43 12.96 12.64 2.45 1.48</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="6">1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="6">D:xz D:xz D:x2-y2 D:x2-y2 P:z S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="6"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -9.089 -24.020</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="6">1.00 1.00 1.00 1.00 1.33 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="6">101 103 101 103 39 39</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="6">Tc Tc Tc Tc O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.890</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">574</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">8.62 8.61 3.36 3.36 3.05 3.03 1.91 1.90 1.90 1.89 1.59 1.59 1.42 1.41 1.25 1.25 1.19 1.19 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 P:y P:y P:y P:y D:xy D:xy D:xy D:xy D:xy D:xy D:x2-y2 D:x2-y2 P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">14 1 14 1 6 11 60 25 27 61 15 2 18 5 4 17 6 11 25 60</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">W W W W W W O O O O W W W W W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.884</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">575</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">8.69 8.63 3.36 3.35 3.08 3.07 1.98 1.98 1.93 1.92 1.59 1.59 1.46 1.46 1.19 1.19 1.17 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 P:y P:y P:y P:y D:xy D:xy D:xy D:xy D:x2-y2 D:x2-y2 D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">6 11 6 11 1 14 74 76 75 91 20 10 12 7 14 1 8 13</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W O O O O W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.779</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">576</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">3.57 3.55 3.11 3.10 2.56 2.55 1.93 1.93 1.90 1.90 1.62 1.61 1.39 1.38 1.24 1.23 1.11 1.10 1.09 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy P:y P:y P:y P:y D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">3 16 4 17 15 2 9 19 18 5 8 13 20 10 35 97 43 54 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">W W W W W W W W W W W W W W O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.774</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">577</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">3.33 3.32 3.20 3.19 2.63 2.61 2.27 2.25 1.77 1.77 1.77 1.76 1.40 1.40 1.28 1.28 1.27 1.26 1.14 1.14 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy P:y P:y P:y P:y D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">9 19 8 13 20 10 12 7 4 3 17 16 15 2 18 5 51 95 56 81 8 13</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">W W W W W W W W W W W W W W W W O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.683</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">578</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="9">13.95 13.75 12.41 7.96 7.72 3.99 3.98 1.51 1.49</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="9">1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="9">D:x2-y2 D:x2-y2 P:z D:xz D:xz D:z2 D:z2 D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="9"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="9">1.00 1.00 1.33 1.00 1.00 1.00 1.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="9">101 103 39 103 101 103 101 100 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="9">Tc Tc O Tc Tc Tc Tc Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.566</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">579</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="3">26.76 26.12 16.47</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="3">1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="3">D:xy D:xy P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="3"
                               units="nonsi:electronvolt">-6.613 -6.613 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="3">1.00 1.00 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="3">103 101 39</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="3">Tc Tc O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.503</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">580</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">5.89 5.88 5.87 5.87 4.96 4.91 3.15 3.08 2.89 2.88 2.88 2.87 2.80 2.75 2.08 2.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 1.00 1.00 1.00 1.00 0.80 0.80 0.80 0.80 1.00 1.00 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">11 6 1 14 100 102 103 101 11 14 1 6 101 103 102 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W Tc Tc Tc Tc W W W W Tc Tc Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.440</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">581</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">7.19 7.11 5.97 5.96 5.96 5.96 3.26 3.22 2.71 2.71 2.71 2.70 2.12 2.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.00 1.00 0.80 0.80 0.80 0.80 1.00 1.00 0.80 0.80 0.80 0.80 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">101 103 11 1 6 14 100 102 11 14 1 6 102 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">Tc Tc W W W W Tc Tc W W W W Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.373</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">582</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">10.24 10.20 5.14 5.12 3.68 3.67 2.56 2.56 2.04 2.03 2.01 2.00 1.88 1.88 1.70 1.70 1.65 1.65 1.51 1.51 1.38 1.37 1.27 1.27 1.24 1.24 1.23 1.22 1.19 1.18 1.08 1.07 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">D:xy D:xy P:x P:x D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 P:y P:y P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:y D:yz D:yz D:xy D:xy D:xy D:xy D:z2 D:z2 D:yz D:yz D:z2 D:z2 P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">14 1 70 47 2 15 5 18 15 2 69 44 31 64 42 68 18 5 71 49 3 16 3 16 4 17 16 3 4 17 17 4 44</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">W W O O W W W W W W O O O O O O W W O O W W W W W W W W W W W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.372</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">583</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">10.29 10.20 5.16 5.13 3.58 3.57 2.66 2.66 1.98 1.98 1.96 1.96 1.82 1.80 1.77 1.76 1.71 1.70 1.56 1.56 1.33 1.30 1.29 1.28 1.25 1.24 1.24 1.21 1.18 1.16 1.13 1.12</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:xy D:xy P:x P:x D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 P:y P:y P:y P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:y D:yz D:yz D:xy D:xy D:xy D:yz D:xy D:yz D:z2 D:z2 D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">6 11 63 58 10 20 7 12 10 20 84 89 48 92 88 78 7 12 50 55 9 19 8 13 9 8 19 13 19 9 13 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W O O W W W W W W O O O O O O W W O O W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.357</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">584</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">8.86 8.86 4.93 4.92 3.44 3.44 3.19 3.18 2.01 2.00 1.99 1.99 1.96 1.96 1.78 1.77 1.69 1.69 1.60 1.59 1.42 1.42 1.26 1.24 1.23 1.23 1.22 1.22 1.10 1.10 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:yz D:yz P:z P:z D:z2 D:z2 D:z2 D:z2 P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:y P:y D:x2-y2 D:x2-y2 D:xy D:xy P:y P:y D:z2 D:yz D:yz D:z2 D:z2 D:z2 D:xy D:xy P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">1 14 70 47 18 5 15 2 71 49 18 5 42 68 69 44 15 2 4 17 31 64 14 4 17 17 1 4 16 3 49 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W O O W W W W O O W W O O O O W W W W O O W W W W W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.357</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">585</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">8.96 8.84 4.96 4.92 3.32 3.32 3.29 3.29 1.94 1.93 1.92 1.91 1.91 1.91 1.85 1.84 1.76 1.76 1.56 1.56 1.48 1.47 1.27 1.22 1.21 1.20 1.19 1.19 1.15 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:yz D:yz P:z P:z D:z2 D:z2 D:z2 D:z2 P:y P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:y D:x2-y2 D:x2-y2 D:xy D:xy P:y P:y D:z2 D:yz D:z2 D:z2 D:z2 D:yz D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">6 11 63 58 12 7 10 20 50 55 88 7 12 78 84 89 20 10 8 13 48 92 11 8 6 13 8 13 9 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W O O W W W W O O O W W O O O W W W W O O W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.266</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">586</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="20">4.32 3.81 3.76 3.61 3.56 3.43 1.90 1.89 1.86 1.86 1.35 1.35 1.31 1.31 1.28 1.28 1.19 1.17 1.08 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="20">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="20">D:yz D:xy D:xy D:xy D:xy D:yz P:y P:y P:y P:y D:xy D:xy D:xy D:xz D:xy D:xz D:z2 D:z2 D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="20"
                               units="nonsi:electronvolt">-6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="20">1.00 0.80 0.80 0.80 0.80 1.00 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="20">101 15 2 5 18 100 27 61 25 60 17 3 4 3 16 16 3 16 17 4</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="20">Tc W W W W Tc O O O O W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.263</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">587</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">4.59 3.77 3.75 3.71 3.69 3.38 1.90 1.89 1.82 1.82 1.36 1.35 1.34 1.33 1.32 1.31 1.26 1.24 1.22 1.03 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:yz D:xy D:xy D:xy D:xy D:yz P:y P:y P:y P:y D:z2 D:xy D:xy D:z2 D:xz D:xz D:xy D:xy D:yz D:xz D:xz D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.00 0.80 0.80 0.80 0.80 1.00 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">103 12 7 20 10 102 75 91 74 76 19 8 13 9 19 9 9 19 101 13 8 5 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">Tc W W W W Tc O O O O W W W W W W W W Tc W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.249</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">588</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">3.95 3.89 3.43 3.38 1.96 1.90 1.87 1.74 1.48 1.47 1.47 1.47 1.46 1.44 1.43 1.42 1.41 1.39 1.32 1.31 1.17 1.14 1.10 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:xy D:xy D:xy D:xy P:x P:x P:x P:x D:xy D:z2 D:z2 D:xz D:z2 D:xy D:z2 D:xz D:xy D:xy D:xz D:xz D:yz D:yz D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">16 3 4 17 30 37 26 28 18 18 5 16 2 2 15 3 5 15 4 17 18 5 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">W W W W O O O O W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.246</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">589</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">4.00 3.98 3.48 3.46 2.00 1.93 1.86 1.70 1.56 1.56 1.54 1.52 1.45 1.45 1.41 1.39 1.38 1.36 1.34 1.32 1.16 1.14 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:xy D:xy D:xy D:xy P:x P:x P:x P:x D:xy D:xy D:xz D:xz D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:xz D:xz D:yz D:yz D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">9 19 8 13 93 86 85 73 12 7 19 9 20 10 7 12 10 20 13 8 12 7 8 13</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">W W W W O O O O W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.101</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">590</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">7.37 7.35 5.06 3.78 3.78 3.16 3.15 2.52 2.51 2.41 1.84 1.84 1.63 1.62 1.29 1.29 1.28 1.28</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:xy D:xy D:x2-y2 D:xy D:xy P:x P:x D:xz D:xz D:x2-y2 D:xz D:xz P:x P:x D:xz D:xz D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 1.00 0.80 0.80 1.33 1.33 0.80 0.80 1.00 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">1 14 100 11 6 47 70 2 15 102 5 18 58 63 20 10 5 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W Tc W W O O W W Tc W W O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.091</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">591</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">8.10 8.06 4.21 4.17 3.66 3.44 3.44 2.62 2.61 1.92 1.91 1.91 1.79 1.78 1.36 1.35 1.27 1.27</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:xy D:xy D:xy D:xy D:x2-y2 P:x P:x D:xz D:xz D:xz D:xz D:x2-y2 P:x P:x D:xz D:xz D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -6.613 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -6.613 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 1.00 1.33 1.33 0.80 0.80 0.80 0.80 1.00 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">6 11 1 14 102 58 63 20 10 12 7 100 47 70 2 15 12 7</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W Tc O O W W W W Tc O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.041</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">592</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">4.12 4.11 3.62 3.61 2.72 2.70 2.70 2.67 2.49 2.49 2.47 2.46 2.34 2.33 2.18 2.18 2.18 2.14 2.11 2.07 1.96 1.95 1.68 1.67 1.59 1.58 1.42 1.42 1.07 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:z2 D:z2 D:z2 D:z2 D:yz D:yz D:yz D:yz P:y P:y D:xy D:xy P:y P:y D:z2 D:xy D:xy D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">18 5 15 2 4 17 3 16 68 42 17 4 31 64 16 3 16 3 17 4 18 5 49 71 15 2 69 44 49 71</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W O O W W O O W W W W W W W W O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.040</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">593</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">4.22 4.16 3.60 3.55 2.74 2.68 2.67 2.62 2.51 2.48 2.48 2.45 2.31 2.29 2.20 2.19 2.16 2.12 2.10 2.07 2.01 1.96 1.72 1.68 1.59 1.56 1.42 1.39 1.10 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:z2 D:z2 D:z2 D:z2 D:yz D:yz D:yz D:yz P:y P:y D:xy D:xy P:y P:y D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 P:y P:y D:x2-y2 D:x2-y2 P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">12 7 20 10 8 13 9 19 88 78 8 13 48 92 9 19 19 13 9 8 12 7 50 55 20 10 84 89 55 50</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W O O W W O O W W W W W W W W O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-2.006</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">594</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">7.84 7.82 4.37 4.33 3.83 3.83 2.29 2.15 2.15 1.88 1.85 1.70 1.23 1.20 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:yz D:yz D:yz D:yz P:z P:z D:x2-y2 P:z P:z D:z2 D:z2 D:x2-y2 D:z2 D:z2 D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -6.613 -9.089 -9.089 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 1.33 1.33 1.00 1.33 1.33 0.80 0.80 1.00 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">1 14 6 11 47 70 100 63 58 14 1 102 11 6 18 5</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W O O Tc O O W W Tc W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.997</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">595</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="10">9.92 9.80 5.61 5.55 4.55 4.55 2.57 2.57 1.28 1.23</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="10">1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="10">D:yz D:yz D:yz D:yz P:z P:z P:z P:z D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="10"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="10">0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="10">6 11 1 14 63 58 47 70 11 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="10">W W W W O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.971</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">596</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">13.29 10.17 3.60 3.55 2.97 2.84 2.13 2.11 1.32 1.31 1.19 1.18 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">D:x2-y2 D:x2-y2 D:z2 P:x P:x D:z2 D:yz D:yz D:yz D:yz P:x D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -9.089 -9.089 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">1.00 1.00 1.00 1.33 1.33 1.00 0.80 0.80 0.80 0.80 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">100 102 100 22 21 102 1 14 11 6 39 2 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">Tc Tc Tc O O Tc W W W W O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.948</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">597</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">3.85 3.82 3.60 3.57 3.25 3.22 2.87 2.84 2.06 2.05 1.73 1.72 1.38 1.38 1.34 1.34 1.27 1.27 1.19 1.18 1.16 1.16 1.15 1.14 1.09 1.08 1.08 1.06 1.05 1.04 1.03 1.03 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:xy D:xy D:z2 D:z2 P:y P:y D:z2 D:z2 D:z2 D:z2 P:y P:y P:z P:z P:z P:z P:z P:z D:yz P:z D:z2 D:yz D:z2 P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33 0.80 1.33 0.80 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">2 15 5 18 16 3 17 4 3 16 4 17 20 10 31 64 12 7 19 9 42 68 64 31 44 69 49 71 3 68 13 16 8 42</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">W W W W W W W W W W W W W W O O W W W W O O O O O O O O W O W W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.945</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">598</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">3.80 3.78 3.50 3.47 3.23 3.21 2.84 2.83 2.13 2.13 1.73 1.73 1.40 1.39 1.35 1.34 1.25 1.24 1.18 1.17 1.16 1.15 1.13 1.12 1.11 1.08 1.06 1.06 1.03 1.03 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:xy D:xy P:y P:y D:z2 D:z2 D:z2 D:z2 P:y P:y P:z P:z D:z2 D:z2 D:yz D:yz P:z P:z P:z P:z P:z P:z D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">20 10 12 7 19 9 13 8 9 19 8 13 48 92 2 15 5 18 88 78 92 48 16 3 9 19 84 89 55 78 50 88 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">W W W W W W W W W W W W O O W W W W O O O O W W W W O O O O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.925</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">599</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">11.93 8.41 3.67 3.66 3.26 3.26 2.58 1.59 1.44 1.44 1.34 1.33 1.28 1.28 1.27 1.14 1.13 1.12 1.11 1.06 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">D:x2-y2 D:x2-y2 D:xy D:xy D:xy D:xy P:x P:x P:x P:x D:z2 D:z2 P:x P:x D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.00 1.00 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.00 0.80 0.80 0.80 0.80 1.00 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">102 100 6 11 1 14 21 22 63 58 12 7 70 47 101 18 5 13 8 103 4</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">Tc Tc W W W W O O O O W W O O Tc W W W W Tc W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.866</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">600</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.81 2.78 2.58 2.55 2.54 2.45 2.33 2.33 2.15 2.14 2.01 2.01 1.88 1.87 1.79 1.79 1.74 1.72 1.46 1.45 1.38 1.37 1.35 1.22 1.08 1.08 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:xy D:xy D:x2-y2 D:xy D:xy D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:x P:x D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-4.498 -4.498 -6.613 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.80 0.80 1.00 0.80 0.80 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 1.00 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">14 1 103 11 6 101 15 2 20 10 5 18 3 16 12 7 19 9 4 17 13 8 100 102 70 47 2 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W Tc W W Tc W W W W W W W W W W W W W W W W Tc Tc O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.805</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">601</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">3.63 3.56 3.25 3.15 2.96 2.89 2.55 2.46 2.24 1.96 1.51 1.48 1.46 1.40 1.21 1.17 1.12 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:x2-y2 D:x2-y2 P:x P:x P:x P:x P:x P:x P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 1.00 1.33 1.33 1.33 1.33 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">2 15 20 10 5 18 12 7 102 100 44 84 69 89 49 71 50 55</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W W W Tc Tc O O O O O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.778</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">602</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">3.30 3.25 2.76 2.72 2.68 2.55 2.53 2.39 2.28 2.15 1.85 1.77 1.67 1.67 1.63 1.59 1.42 1.39 1.36 1.34 1.30 1.26 1.20 1.15 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">D:xz D:xz P:x D:xz D:xz P:x P:x D:xy P:x D:xy D:xy D:x2-y2 D:x2-y2 D:xy D:x2-y2 D:x2-y2 P:x D:x2-y2 D:x2-y2 P:x P:x P:x D:x2-y2 D:x2-y2 D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">0.80 0.80 1.33 0.80 0.80 1.33 1.33 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">2 15 44 5 18 49 69 2 71 5 15 5 18 18 2 15 41 16 3 36 45 98 17 4 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">W W O W W O O W O W W W W W W W O W W O O O W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.773</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">603</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">3.82 3.79 3.70 3.66 3.62 3.57 3.54 3.50 3.01 2.98 1.78 1.70 1.50 1.49 1.42 1.32 1.16 1.11 1.07 1.06 1.06 1.02 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:xy D:xy D:xy D:z2 D:xy D:xy D:xy D:z2 D:xy D:xy D:z2 D:z2 D:xy D:xy D:xy D:xy P:x D:x2-y2 P:x P:x P:x P:x P:x D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -9.089 -6.613 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.80 0.80 0.80 1.00 0.80 0.80 0.80 1.00 0.80 0.80 1.00 1.00 0.80 0.80 0.80 0.80 1.33 1.00 1.33 1.33 1.33 1.33 1.33 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">20 10 15 100 18 12 7 102 2 5 101 103 9 19 16 3 73 103 71 85 28 26 50 101</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">W W W Tc W W W Tc W W Tc Tc W W W W O Tc O O O O O Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.768</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">604</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.31 3.23 2.84 2.83 2.75 2.71 2.59 2.54 2.43 2.28 2.03 1.82 1.80 1.71 1.60 1.55 1.52 1.42 1.39 1.32 1.30 1.22 1.16 1.11 1.10 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">D:xz D:xz P:x D:xz D:xz P:x P:x D:xy P:x D:xy D:xy D:xy D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x P:x P:x D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">0.80 0.80 1.33 0.80 0.80 1.33 1.33 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">10 20 89 7 12 55 84 10 50 7 20 12 7 12 10 20 57 59 82 83 19 9 13 2 15 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W O W W O O W O W W W W W W W O O O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.733</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">605</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">8.51 8.00 4.11 3.98 3.57 3.07 2.24 1.79 1.39 1.39 1.39 1.38 1.22 1.21 1.14 1.13 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 P:x P:x D:xy D:xy D:xy D:xy D:z2 D:z2 D:xz D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">1.00 1.00 1.00 1.00 1.00 1.00 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">102 100 101 103 102 100 21 22 9 3 19 16 10 20 102 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">Tc Tc Tc Tc Tc Tc O O W W W W W W Tc W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.633</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">606</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.48 3.46 3.32 3.31 3.22 3.19 2.82 2.81 2.28 2.26 1.74 1.73 1.71 1.69 1.63 1.50 1.47 1.41 1.33 1.32 1.32 1.24 1.22 1.21 1.20 1.20 1.17 1.16 1.15</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">D:xy D:xy D:z2 D:z2 D:xy D:xy D:xy D:xy D:z2 D:z2 D:xy D:xy D:yz D:yz P:z D:yz D:yz P:z D:yz D:yz P:x P:x P:y P:y P:y P:y D:z2 D:z2 P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">4 17 5 18 15 2 18 5 2 15 3 16 18 5 26 15 2 28 4 17 37 26 60 25 27 61 16 3 28</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W W W W W W W W W W W W W O W W O W W O O O O O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.630</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">607</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">3.44 3.44 3.29 3.25 3.10 3.09 3.06 3.05 2.25 2.23 1.81 1.77 1.77 1.77 1.67 1.52 1.49 1.41 1.33 1.30 1.25 1.24 1.24 1.24 1.20 1.20 1.09 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">D:xy D:xy D:z2 D:z2 D:xy D:xy D:xy D:xy D:z2 D:z2 D:yz D:yz D:xy D:xy P:z D:yz D:yz P:z P:x P:x D:yz D:yz P:y P:y P:y P:y P:x D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">8 13 7 12 12 7 10 20 10 20 12 7 9 19 85 20 10 73 85 86 8 13 75 91 74 76 73 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W W W W W W W W W W W W W O W W O O O W W O O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.573</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">608</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">2.33 2.32 2.14 2.10 1.74 1.67 1.65 1.65 1.52 1.51 1.45 1.44 1.43 1.43 1.39 1.38 1.38 1.38 1.35 1.34 1.23 1.23 1.11 1.10 1.09 1.08 1.08 1.07 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:xy D:x2-y2 D:xy D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz D:xy D:xy P:x P:x D:xz D:xz P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">0.80 0.80 0.80 0.80 1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">3 16 9 19 100 102 4 17 8 13 8 4 17 13 103 3 101 16 9 19 3 16 15 2 31 64 9 19 48 92</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W Tc Tc W W W W W W W W Tc W Tc W W W W W W W O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.565</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">609</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">5.24 5.24 3.65 3.64 1.99 1.98 1.96 1.95 1.94 1.93 1.53 1.53 1.50 1.49 1.36 1.36 1.33 1.33 1.28 1.27 1.18 1.17</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:xy D:xy D:x2-y2 D:x2-y2 D:xy D:xy D:xy D:xy D:x2-y2 D:x2-y2 D:xy D:xy D:xy D:xy D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">1 14 11 6 16 3 4 17 1 14 15 2 8 13 6 11 20 10 5 18 9 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.559</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">610</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">4.83 4.83 3.01 3.00 2.51 2.47 1.82 1.80 1.75 1.75 1.75 1.74 1.42 1.42 1.28 1.28 1.08 1.08</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:xy D:xy D:x2-y2 D:xy D:x2-y2 D:xy D:xy D:xy D:xy D:xy D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">11 6 1 14 9 19 12 7 11 3 6 16 8 13 18 5 1 14</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.545</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">611</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="21">4.40 4.20 2.37 2.26 2.26 2.22 1.83 1.75 1.49 1.48 1.45 1.41 1.41 1.37 1.36 1.35 1.33 1.32 1.31 1.29 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="21">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="21">D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:z2 D:x2-y2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="21"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="21">1.00 1.00 0.80 0.80 0.80 0.80 1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="21">103 101 8 17 13 4 102 100 9 16 3 9 19 8 17 16 19 4 3 13 39</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="21">Tc Tc W W W W Tc Tc W W W W W W W W W W W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.540</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">612</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">2.09 2.05 2.04 1.95 1.94 1.87 1.66 1.63 1.52 1.49 1.45 1.42 1.29 1.22 1.22 1.21 1.20 1.19 1.18 1.17 1.16 1.16 1.14 1.13 1.12 1.09 1.09 1.08 1.05 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz D:z2 D:yz D:z2 P:x D:xy D:yz D:yz P:x D:z2 D:yz D:xy P:x D:z2 P:x P:x P:x P:x P:x D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 1.00 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">103 102 19 13 9 8 3 16 4 17 100 101 13 19 8 92 19 13 9 48 19 8 9 81 9 95 78 56 51 88 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">Tc Tc W W W W W W W W Tc Tc W W W O W W W O W W W O W O O O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.515</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">613</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.93 2.13 2.05 2.02 1.84 1.81 1.57 1.56 1.54 1.30 1.28 1.27 1.26 1.19 1.18 1.17 1.16 1.15 1.13 1.13 1.08 1.08 1.08 1.07 1.04 1.03 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:z2 P:x P:x D:yz D:yz D:xz D:xy D:xy P:x D:xy D:xy P:x P:x P:x P:z D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -6.613 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.00 1.00 0.80 0.80 0.80 0.80 0.80 1.00 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.00 0.80 0.80 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">101 103 17 4 16 3 13 100 8 19 9 17 4 54 43 16 3 102 18 5 97 16 3 35 68 42 39 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">Tc Tc W W W W W Tc W W W W W O O W W Tc W W O W W O O O O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.325</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">614</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">8.64 6.38 3.94 3.92 3.33 3.32 3.32 3.30 3.09 3.06 2.89 2.86 2.39 2.38 2.01 2.00 1.99 1.98 1.66 1.65 1.19 1.19 1.18 1.18 1.18 1.17 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:yz D:yz D:x2-y2 D:x2-y2 P:z D:x2-y2 P:z D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:xz D:xz P:x P:x P:x P:x D:xz D:xz D:xy D:xy D:xy D:xy P:y P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.00 1.00 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">101 100 5 18 25 2 60 15 18 5 15 2 2 15 44 69 49 71 5 18 4 3 16 17 35 97 43 54</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">Tc Tc W W O W O W W W W W W W O O O O W W W W W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.322</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">615</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">8.77 6.35 3.95 3.94 3.31 3.31 3.30 3.29 2.98 2.97 2.93 2.93 2.40 2.38 2.01 2.00 1.96 1.95 1.63 1.62 1.22 1.21 1.18 1.17 1.17 1.17 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:yz D:yz D:x2-y2 D:x2-y2 P:z D:x2-y2 P:z D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:xz D:xz P:x P:x P:x P:x D:xz D:xz D:xy D:xy D:xy P:y D:xy P:y P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-6.613 -6.613 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.00 1.00 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 1.33 0.80 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">103 102 12 7 75 20 91 10 12 7 20 10 20 10 84 89 50 55 12 7 13 8 19 95 9 51 81 56</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">Tc Tc W W O W O W W W W W W W O O O O W W W W W O W O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.290</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">616</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">3.01 2.11 2.10 2.10 2.08 2.07 2.04 1.76 1.46 1.45 1.36 1.36 1.35 1.35 1.23 1.22 1.21 1.21</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:z2 D:yz D:yz D:z2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:yz D:yz D:z2 D:yz D:yz D:z2 D:z2 D:yz D:yz D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-6.613 -4.498 -4.498 -6.613 -6.613 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">1.00 0.80 0.80 1.00 1.00 0.80 0.80 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">100 14 1 102 101 2 15 103 16 3 10 17 4 20 5 11 6 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">Tc W W Tc Tc W W Tc W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.284</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">617</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">2.46 2.45 2.00 1.97 1.96 1.89 1.86 1.76 1.75 1.75 1.73 1.56 1.54 1.24 1.23 1.16 1.14 1.14 1.14 1.13 1.13 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">D:yz D:yz D:z2 D:z2 D:z2 D:yz D:yz D:z2 D:z2 D:yz D:yz D:yz D:yz D:yz D:yz D:z2 D:z2 D:z2 D:yz D:yz D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">0.80 0.80 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">11 6 102 10 20 8 13 7 12 9 19 14 1 4 17 5 18 2 3 16 15 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">W W Tc W W W W W W W W W W W W W W W W W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.219</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">618</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="19">6.33 5.28 5.26 3.19 2.99 2.37 2.36 1.88 1.81 1.64 1.64 1.53 1.53 1.26 1.25 1.18 1.18 1.17 1.15</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="19">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="19">P:x D:x2-y2 D:x2-y2 D:xz D:xz D:x2-y2 D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:z2 D:x2-y2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="19"
                               units="nonsi:electronvolt">-9.089 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -6.613</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="19">1.33 1.00 1.00 1.00 1.00 1.00 1.00 1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 0.80 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="19">39 103 101 103 101 102 100 103 101 5 18 12 7 17 4 13 100 8 102</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="19">O Tc Tc Tc Tc Tc Tc Tc Tc W W W W W W W Tc W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.177</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">619</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.07 2.05 2.01 2.01 1.82 1.82 1.81 1.81 1.61 1.60 1.60 1.60 1.40 1.39 1.36 1.36 1.35 1.35 1.34 1.34 1.29 1.28 1.23 1.23 1.10 1.09 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">D:xy D:xy D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:xy D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">8 13 17 4 17 4 13 8 20 2 10 15 16 3 18 5 12 7 3 16 9 19 19 9 12 7 5 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.150</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">620</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">3.06 2.30 2.29 2.26 2.25 2.18 2.17 2.12 2.12 1.94 1.92 1.80 1.71 1.71 1.66 1.54 1.53 1.39 1.38 1.35 1.34 1.26 1.25 1.08 1.08 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">P:x D:xy D:xy D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:x2-y2 D:x2-y2 D:xz D:xz D:z2 D:z2 D:z2 D:z2 D:xy D:xy D:z2 D:z2 D:xy D:xy D:xy D:xy D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -6.613 -6.613 -6.613 -6.613 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.00 1.00 1.00 1.00 1.00 1.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">39 9 19 9 19 16 3 3 16 101 103 103 101 103 101 8 13 8 13 4 17 17 4 10 20 2 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">O W W W W W W W W Tc Tc Tc Tc Tc Tc W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.130</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">621</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">13.70 13.68 3.76 3.75 2.20 2.19 1.98 1.97 1.56 1.56 1.55 1.54 1.15 1.15 1.06 1.04 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:xy D:xy P:x P:x D:xy D:xy P:y P:y D:xy D:xy P:y P:y D:yz D:yz D:z2 D:z2 D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 4.055 4.055 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.00 0.00 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">1 14 47 70 11 6 62 29 1 14 32 65 16 3 2 15 2 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W O O W W O O W W O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.127</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">622</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">13.88 13.84 3.81 3.79 2.22 2.21 1.88 1.88 1.59 1.59 1.46 1.46 1.12 1.09 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 2 2 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:xy D:xy P:x P:x D:xy D:xy P:y P:y D:xy D:xy P:y P:y D:yz D:yz D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 4.055 4.055 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.00 0.00 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">11 6 58 63 1 14 79 24 11 6 53 80 9 19 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W O O W W O O W W O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.112</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">623</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">13.10 13.04 3.80 3.75 2.31 2.31 2.02 1.98 1.78 1.77 1.71 1.70 1.45 1.45 1.18 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:yz D:yz P:z P:z D:yz D:yz D:z2 D:z2 P:y P:y P:y P:y D:yz D:yz D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.00 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">1 14 47 70 6 11 5 18 66 33 34 67 1 14 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W O O W W W W O O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.110</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">624</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">13.15 13.12 3.79 3.78 2.23 2.22 2.03 2.03 1.77 1.77 1.70 1.69 1.46 1.46 1.21 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 2 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:yz D:yz P:z P:z D:yz D:yz D:z2 D:z2 P:y P:y P:y P:y D:yz D:yz D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 4.055 4.055 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.00 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">6 11 63 58 1 14 12 7 77 99 87 94 6 11 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W O O W W W W O O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.087</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">625</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">2.56 2.54 2.31 2.31 1.72 1.70 1.57 1.54 1.48 1.40 1.39 1.33 1.31 1.30 1.26 1.17 1.16 1.14 1.13 1.07 1.07 1.06 1.04 1.04 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:z D:z2 D:z2 P:z D:z2 D:z2 P:z D:x2-y2 D:x2-y2 P:z P:z D:z2 D:z2 P:z D:x2-y2 P:z D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">2 15 10 20 18 5 7 12 28 16 3 73 19 9 26 18 5 30 85 4 17 93 7 37 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">W W W W W W W W O W W O W W O W W O O W W O W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.081</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">626</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">2.02 2.02 1.91 1.88 1.84 1.82 1.72 1.70 1.60 1.58 1.53 1.40 1.39 1.38 1.31 1.30 1.23 1.18 1.18 1.12 1.07 1.05 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:z D:z2 D:z2 P:z D:x2-y2 D:x2-y2 P:z D:x2-y2 D:x2-y2 P:z P:z D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 1.33 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">10 20 7 12 2 15 18 5 13 8 73 4 17 28 10 20 85 15 2 26 93 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">W W W W W W W W W W O W W O W W O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-1.030</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">627</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">2.02 2.01 1.62 1.62 1.62 1.61 1.61 1.61 1.58 1.58 1.42 1.42 1.41 1.41 1.38 1.37 1.26 1.26 1.25 1.25 1.24 1.23 1.14 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">D:xz D:xz D:x2-y2 D:x2-y2 P:z D:x2-y2 P:z D:x2-y2 D:xz D:xz D:x2-y2 D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:z P:z D:x2-y2 D:x2-y2 D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.80 0.80 0.80 0.80 1.33 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">15 2 4 17 60 3 25 16 20 10 19 18 5 9 13 8 15 2 91 75 18 5 12 7</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">W W W W O W O W W W W W W W W W W W O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.995</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">628</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">2.31 2.30 1.96 1.96 1.77 1.76 1.73 1.72 1.68 1.67 1.45 1.45 1.36 1.36 1.34 1.34 1.26 1.26 1.22 1.22 1.04 1.04 1.04 1.04 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:z P:z D:x2-y2 D:x2-y2 D:xz D:xz P:z P:z D:xz D:xz D:x2-y2 D:x2-y2 D:xz D:xz P:x P:x D:z2 D:z2 P:x P:x D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">7 12 5 18 91 75 19 9 12 7 60 25 18 5 16 3 20 10 55 50 10 20 71 49 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W W W O O W W W W O O W W W W W W O O W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.911</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">629</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">4.15 4.14 3.06 3.03 2.46 2.46 1.96 1.95 1.65 1.64 1.43 1.30 1.07 1.06 1.05 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">D:xy D:xy D:xy D:xy D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:z P:z P:z D:x2-y2 D:x2-y2 D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">1 14 11 6 16 3 19 9 17 4 30 37 93 4 17 8 13</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">W W W W W W W W W W O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.902</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">630</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="13">3.96 3.95 3.26 3.25 2.81 2.79 2.28 2.27 1.49 1.07 1.04 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="13">1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="13">D:xy D:xy D:z2 D:z2 D:xy D:xy D:z2 D:z2 P:z P:z P:z D:z2 D:z2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="13"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="13">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="13">11 6 13 8 1 14 4 17 86 93 37 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="13">W W W W W W W W O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.864</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">631</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">3.95 3.86 2.84 2.79 2.78 2.77 2.64 2.60 2.11 2.10 1.86 1.85 1.85 1.80 1.73 1.54 1.54 1.33 1.32 1.30 1.25 1.23 1.22 1.22 1.20 1.20 1.20 1.17 1.15 1.14 1.13 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">D:z2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 P:z P:z D:x2-y2 D:x2-y2 P:x P:x D:z2 D:z2 D:yz P:x P:x D:x2-y2 D:x2-y2 D:z2 D:z2 P:z P:x D:xz P:x D:xz P:z P:x P:x D:yz D:yz D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -6.613 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.00 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 1.33 1.33 1.33 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">8 13 9 13 8 19 74 76 19 9 56 81 4 17 103 88 78 4 17 3 16 27 48 9 92 19 61 51 95 13 8 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">W W W W W W O O W W O O W W Tc O O W W W W O O W O W O O O W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.854</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">632</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">4.26 3.64 3.26 2.85 2.84 2.82 2.69 2.56 2.38 2.22 2.07 1.97 1.73 1.70 1.65 1.61 1.44 1.41 1.40 1.39 1.35 1.34 1.26 1.25 1.24 1.24 1.21 1.20 1.18 1.17 1.16 1.09 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">D:z2 D:z2 D:z2 P:z D:x2-y2 D:z2 D:x2-y2 P:z D:x2-y2 D:x2-y2 D:z2 P:x P:x D:z2 D:z2 P:x P:x P:x P:z P:x D:x2-y2 D:z2 D:xz P:x P:x D:x2-y2 P:z D:x2-y2 D:xz D:yz D:yz D:yz D:x2-y2 D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498 -4.498 -6.613 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 1.33 0.80 0.80 0.80 1.33 1.33 0.80 1.33 0.80 0.80 1.00 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">4 17 3 27 4 16 17 61 3 16 13 43 54 8 19 42 68 35 76 31 13 9 3 64 97 8 74 19 16 101 4 17 9 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">W W W O W W W O W W W O O W W O O O O O W W W O O W O W W Tc W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.849</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">633</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="15">3.73 3.17 3.10 3.05 2.81 2.74 2.34 1.90 1.25 1.20 1.18 1.07 1.07 1.06 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="15">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="15">D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:z P:x P:z P:x P:z D:x2-y2 P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="15"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -9.089 -6.613 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="15">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 1.33 1.00 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="15">17 8 4 9 13 19 16 3 74 54 61 56 76 100 51</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="15">W W W W W W W W O O O O O Tc O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.767</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">634</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.47 4.47 4.36 3.56 3.54 3.09 3.06 2.21 2.09 1.71 1.70 1.65 1.63 1.57 1.55 1.51 1.51 1.30 1.27 1.26 1.25 1.21 1.19 1.10 1.08 1.06 1.06 1.06 1.06 1.05 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">D:x2-y2 P:x D:x2-y2 D:z2 D:z2 D:z2 D:z2 D:z2 D:z2 P:x P:x D:z2 D:z2 P:z P:z P:x P:x D:x2-y2 D:x2-y2 P:z P:z D:x2-y2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 P:x P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-6.613 -9.089 -6.613 -4.498 -4.498 -4.498 -4.498 -6.613 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">1.00 1.33 1.00 0.80 0.80 0.80 0.80 1.00 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">101 39 103 16 3 9 19 101 103 97 35 17 4 61 27 51 95 17 4 74 76 16 3 8 13 19 13 9 8 64 31</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">Tc O Tc W W W W Tc Tc O O W W O O O O W W O O W W W W W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.686</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">635</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">4.25 4.24 2.01 2.00 1.80 1.80 1.60 1.59 1.52 1.51 1.49 1.48 1.48 1.47 1.36 1.34 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:yz D:yz D:xz D:xz D:xz D:xz D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:yz D:yz D:yz D:yz P:z P:z D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">1 14 2 15 5 18 17 4 16 3 4 3 17 16 30 37 11 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W W W W W W W W W O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.681</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">636</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">4.33 4.30 2.00 1.99 1.79 1.78 1.34 1.34 1.31 1.30 1.28 1.28 1.27 1.24 1.24 1.24 1.19 1.17 1.14 1.13 1.10 1.09 1.06 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">D:yz D:yz D:xz D:xz D:xz D:xz D:yz P:z D:yz D:yz D:x2-y2 D:x2-y2 D:yz D:x2-y2 P:z D:x2-y2 D:z2 D:z2 D:yz D:yz D:x2-y2 D:x2-y2 P:x D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">11 6 10 20 7 12 9 93 19 8 13 8 13 19 86 9 19 9 1 14 7 12 85 20 10</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">W W W W W W W O W W W W W W O W W W W W W W O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.522</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">637</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">21.67 15.99 5.51 4.11 1.53 1.52 1.45 1.45 1.14 1.13 1.10 1.09 1.05 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">D:yz D:yz D:yz D:yz P:y P:y D:xz D:xz P:z P:z P:y P:y D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.00 1.00 1.00 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">103 101 102 100 57 82 12 7 82 57 41 45 18 5</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">Tc Tc Tc Tc O O W W O O O O W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.509</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">638</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="14">21.45 15.63 5.74 4.16 1.64 1.63 1.52 1.51 1.23 1.22 1.13 1.12 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="14">1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="14">D:yz D:yz D:yz D:yz P:y P:y D:xz D:xz P:y P:y D:xz D:xz P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="14"
                               units="nonsi:electronvolt">-6.613 -6.613 -6.613 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="14">1.00 1.00 1.00 1.00 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="14">101 103 100 102 41 45 18 5 57 82 12 7 45 41</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="14">Tc Tc Tc Tc O O W W O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.388</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">639</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">29.49 3.50 3.49 2.48 2.47 2.26 2.25 1.95 1.67 1.65 1.45 1.44 1.19 1.19 1.14 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:yz D:xz D:xz P:y P:y D:xy D:xy D:yz P:z P:z D:xz D:xz P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-6.613 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.00 0.80 0.80 1.33 1.33 0.80 0.80 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">100 15 2 36 98 2 15 102 98 36 4 17 54 43 60 25</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">Tc W W O O W W Tc O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.383</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">640</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">29.62 3.53 3.50 2.48 2.46 2.28 2.26 2.00 1.67 1.65 1.45 1.45 1.21 1.21 1.14 1.14</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:yz D:xz D:xz P:y P:y D:xy D:xy D:yz P:z P:z D:xz D:xz P:y P:y P:z P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-6.613 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -6.613 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">1.00 0.80 0.80 1.33 1.33 0.80 0.80 1.00 1.33 1.33 0.80 0.80 1.33 1.33 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">102 20 10 59 83 10 20 100 83 59 8 13 81 56 91 75</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">Tc W W O O W W Tc O O W W O O O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.211</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">641</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="35">5.88 5.44 4.96 4.93 4.13 4.13 3.83 3.83 3.04 3.04 2.96 2.96 2.14 2.14 2.01 2.01 1.84 1.84 1.72 1.72 -1.65 1.63 1.63 -1.53 1.44 1.43 1.41 1.41 1.35 1.35 1.27 1.27 1.21 1.21 1.16</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="35">3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 3 2 2 3 2 2 3 3 3 3 3 3 3 2 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="35">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="35"
                               units="nonsi:electronvolt">0.762 0.762 0.762 0.762 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 3.091 -5.688 -5.688 3.091 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 2.471</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="35">0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="35">102 100 101 103 9 19 16 3 12 7 18 5 8 13 6 11 14 1 9 19 105 16 3 104 2 15 17 4 10 20 12 7 18 5 107</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="35">Tc Tc Tc Tc W W W W W W W W W W W W W W W W P W W P W W W W W W W W W W H</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">-0.115</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">642</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">13.11 11.78 3.69 3.17 3.17 3.16 2.83 2.48 2.31 2.31 2.25 2.25 2.07 2.00 1.99 1.98 -1.92 -1.75 1.69 1.69 1.61 1.61 1.51 1.51 -1.38 1.28 1.28 1.25 1.25 -1.22 1.08 1.08 -1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">3 3 2 3 3 2 2 1 3 3 3 3 2 1 3 3 3 2 3 3 3 3 3 3 3 3 3 3 3 2 2 2 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">0.762 0.762 -5.052 1.231 1.231 -5.052 2.471 -6.493 1.231 1.231 1.231 1.231 2.471 -6.493 1.231 1.231 0.762 -5.052 1.231 1.231 1.231 1.231 1.231 1.231 0.762 1.231 1.231 1.231 1.231 -5.052 -5.688 -5.688 3.091</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">0.00 0.00 2.00 0.00 0.00 2.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">100 102 100 8 13 102 107 107 2 15 17 4 106 106 14 1 101 101 6 11 16 3 10 20 103 9 19 18 5 103 8 13 104</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">Tc Tc Tc W W Tc H H W W W W H H W W Tc Tc W W W W W W Tc W W W W Tc W W P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.080</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">643</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">14.68 11.77 7.06 5.70 5.66 5.56 4.69 4.61 2.26 -1.99 1.98 -1.86 -1.57 1.18 -1.17 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">3 3 2 2 1 2 1 2 3 3 3 3 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S S P:x S P:x P:x S P:x S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">0.762 0.762 -5.052 -5.052 -6.493 2.471 -6.493 2.471 0.762 2.188 0.762 2.188 -1.119 -5.052 -1.119 -5.052</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.00 0.00 2.00 2.00 1.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">100 102 100 102 106 106 107 107 101 104 103 105 100 101 102 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">Tc Tc Tc Tc H H H H Tc P Tc P Tc Tc Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.094</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">644</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">6.62 5.09 3.10 2.64 2.53 2.24 2.07 2.05 1.98 1.74 1.74 1.73 1.66 1.66 1.46 1.46 1.41 1.40 1.13 1.09 1.09 1.04 1.04 1.03 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">3 3 2 1 2 2 1 2 2 2 1 1 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">S S S S S S S S S S D:z2 D:z2 D:x2-y2 D:x2-y2 D:z2 D:z2 D:x2-y2 D:x2-y2 S D:xy D:xy D:xy D:xy D:yz D:yz D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">0.762 0.762 -5.052 -6.493 2.471 -5.052 -6.493 2.471 -13.975 -13.975 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 3.091 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">0.00 0.00 2.00 1.00 0.00 2.00 1.00 0.00 2.00 2.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">102 100 102 107 107 100 106 106 104 105 14 1 14 1 6 11 6 11 104 3 16 9 19 16 3 19 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">Tc Tc Tc H H Tc H H P P W W W W W W W W P W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.118</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">645</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">5.55 4.94 2.72 2.72 2.34 2.33 2.33 1.68 1.58 1.58 1.48 1.48 1.47 -1.33 1.19 1.19 1.17 1.17 1.17 1.17 1.16 1.09 1.09 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">3 3 3 3 3 3 3 2 1 1 1 1 2 3 3 3 2 3 3 1 1 1 1 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S S S S S D:z2 D:z2 D:x2-y2 D:x2-y2 S P:x S S S S S D:z2 D:z2 D:x2-y2 D:x2-y2 S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">0.762 0.762 1.231 1.231 0.762 1.231 1.231 -5.052 -4.498 -4.498 -4.498 -4.498 -5.052 2.188 1.231 1.231 -13.975 1.231 1.231 -4.498 -4.498 -4.498 -4.498 -5.052</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.80 0.80 0.80 0.80 2.00 0.00 0.00 0.00 2.00 0.00 0.00 0.80 0.80 0.80 0.80 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">101 103 12 7 100 18 5 100 6 11 6 11 101 104 3 16 105 19 9 14 1 14 1 103</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc W W Tc W W Tc W W W W Tc P W W P W W W W W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.228</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">646</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">5.47 5.46 2.71 2.69 2.24 2.24 2.20 2.20 2.11 2.10 1.74 1.73 1.44 1.44 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:xz D:xz D:yz D:yz D:yz D:yz D:xz D:xz D:yz D:yz D:yz D:yz D:xy D:xy D:yz D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">14 1 2 15 17 4 6 11 5 18 16 3 17 4 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.230</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">647</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">5.44 5.44 2.63 2.62 2.34 2.32 2.22 2.22 2.19 2.15 1.59 1.59 1.49 1.48 1.07 1.07 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">D:xz D:xz D:yz D:yz D:yz D:yz D:xz D:xz D:yz D:yz D:yz D:yz D:xy D:xy D:yz P:x D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">6 11 10 20 13 8 14 1 7 12 9 19 13 8 2 86 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">W W W W W W W W W W W W W W W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.313</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">648</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="35">8.33 8.32 6.73 6.73 5.36 5.36 4.81 4.81 3.97 3.97 3.60 3.60 3.24 -3.06 2.84 2.71 2.65 2.65 2.33 2.25 2.25 1.92 1.92 1.89 1.89 1.83 1.81 -1.71 -1.54 -1.31 1.28 1.28 1.21 1.21 -1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="35">3 3 3 3 3 3 2 2 2 2 2 2 1 3 2 1 3 3 2 3 3 2 2 3 3 2 2 3 2 3 2 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="35">S S S S S S S S S S S S S P:z S S S S S S S S S S S S S P:z P:x S S S S S P:x</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="35"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -6.493 2.188 2.471 -6.493 1.231 1.231 2.471 1.231 1.231 -5.688 -5.688 1.231 1.231 -5.052 -5.052 2.188 -1.119 0.762 -5.688 -5.688 -5.688 -5.688 -1.119</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="35">0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="35">12 7 16 3 20 10 12 7 16 3 20 10 107 105 107 106 11 6 106 4 17 11 6 14 1 100 102 104 102 103 4 17 14 1 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="35">W W W W W W W W W W W W H P H H W W H W W W W W W Tc Tc P Tc Tc W W W W Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.342</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">649</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">10.65 10.64 8.98 8.98 6.51 6.50 5.71 5.70 -4.07 3.78 3.77 -3.10 2.62 2.52 2.51 1.93 1.87 1.86 1.70 1.70 1.48 1.48 1.46 1.45 1.45 -1.42 1.40 1.24 1.24 -1.16 1.07 1.03 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">3 3 3 3 2 2 2 2 3 3 3 3 2 2 2 1 3 3 3 3 3 3 2 2 2 2 2 3 3 2 3 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">S S S S S S S S P:z S S P:z S S S S S S S S S S S S S P:x S S S P:z S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 2.188 1.231 1.231 2.188 -5.052 -5.688 -5.688 -6.493 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.052 -1.119 2.471 1.231 1.231 -1.119 0.762 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">5 18 9 19 5 18 9 19 104 2 15 105 100 2 15 106 1 14 16 3 12 7 1 14 102 100 106 13 8 101 102 16 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">W W W W W W W W P W W P Tc W W H W W W W W W W W Tc Tc H W W Tc Tc W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.396</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">650</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">7.99 7.99 7.90 7.88 -5.98 -5.97 4.33 4.32 4.31 4.30 4.16 4.14 4.08 4.08 4.00 3.98 3.93 3.93 2.60 2.59 2.58 2.57 2.53 2.52 2.52 2.51 -1.87 -1.86 1.86 1.84 1.82 1.81 1.64 1.61 1.60 1.58 1.08 1.08 1.08 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">3 3 3 3 3 3 2 2 2 2 3 3 3 3 3 3 3 3 2 2 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">S S S S P:y P:y S S S S S S S S S S S S S S S S S S S S P:y P:y S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 2.188 2.188 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.506 -5.506 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">14 11 6 1 105 104 6 1 14 11 18 12 7 5 19 16 9 3 9 3 19 16 5 7 18 12 105 104 15 20 2 10 13 17 8 4 2 10 15 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">W W W W P P W W W W W W W W W W W W W W W W W W W W P P W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.486</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">651</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">9.15 9.15 7.31 7.29 6.89 6.89 5.61 5.59 3.51 3.27 3.05 -2.86 2.69 2.39 1.85 1.85 1.82 1.60 1.57 1.56 1.45 1.44 1.37 1.37 1.36 1.36 1.17 -1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">3 3 3 3 2 2 2 2 2 3 2 3 3 1 3 3 2 1 2 2 3 3 2 2 3 3 2 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">S S S S S S S S S S S P:z S S S S S S S S S S S S S S S P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.052 0.762 -5.052 2.188 0.762 -6.493 1.231 1.231 2.471 -6.493 -5.688 -5.688 1.231 1.231 -5.688 -5.688 1.231 1.231 2.471 2.188</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 0.00 2.00 0.00 0.00 1.00 0.00 0.00 0.00 1.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">17 4 20 10 17 4 20 10 103 103 101 104 101 106 18 5 106 107 11 6 11 6 14 1 14 1 107 105</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W W W Tc Tc Tc P Tc H W W H H W W W W W W W W H P</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.501</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">652</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="36">10.13 10.12 10.10 10.09 6.39 6.38 6.36 6.35 -6.18 -6.16 3.20 3.20 3.17 3.15 2.91 2.89 2.87 2.86 2.07 2.07 2.05 2.04 2.02 2.00 2.00 1.99 -1.95 -1.95 1.31 1.31 1.29 1.28 1.13 1.12 1.11 1.11</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="36">3 3 3 3 2 2 2 2 3 3 3 3 3 3 3 3 3 3 2 2 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="36">S S S S S S S S P:y P:y S S S S S S S S S S S S S S S S P:y P:y S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="36"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 2.188 2.188 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.506 -5.506 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="36">0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="36">14 1 6 11 14 1 6 11 104 105 2 15 10 20 13 8 17 4 2 15 10 20 13 8 17 4 105 104 18 5 7 12 19 9 16 3</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="36">W W W W W W W W P P W W W W W W W W W W W W W W W W P P W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.541</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">653</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="34">7.95 7.94 7.91 7.91 6.26 6.26 6.22 6.20 -3.82 -2.73 2.65 2.39 2.39 1.86 1.78 1.77 1.73 1.72 1.60 1.58 1.58 1.41 1.40 1.40 1.40 1.32 -1.29 1.15 1.14 -1.10 1.08 1.07 1.06 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="34">3 3 3 3 2 2 2 2 3 3 2 3 3 2 3 3 3 3 3 3 3 2 2 3 3 2 2 2 2 2 2 2 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="34">S S S S S S S S P:z P:z S S S S S S S S S S S S S S S S P:z S S P:z S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="34"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 2.188 2.188 -5.052 1.231 1.231 -5.052 1.231 1.231 1.231 1.231 0.762 1.231 1.231 -5.688 -5.688 1.231 1.231 -5.052 -1.119 -5.688 -5.688 -5.506 -5.688 -5.688 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="34">0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 2.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 2.00 0.00 2.00 2.00 1.00 2.00 2.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="34">8 13 15 2 15 2 8 13 105 104 102 9 19 101 4 17 12 7 101 3 16 9 19 20 10 103 100 6 11 105 4 17 6 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="34">W W W W W W W W P P Tc W W Tc W W W W Tc W W W W W W Tc Tc W W P W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.697</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">654</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="33">2.64 2.56 2.43 2.37 2.30 2.29 2.22 2.14 1.93 1.92 1.48 1.46 1.45 1.44 1.44 1.38 1.36 1.33 1.29 1.27 1.27 1.24 1.23 1.22 1.10 1.08 1.07 1.06 1.04 1.04 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="33">2 2 2 2 2 2 3 3 3 3 2 1 1 2 1 2 1 2 2 1 2 1 1 1 1 2 1 1 1 1 2 1 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="33">P:y P:y S S S S S S S S S D:xz D:xz S D:xz S D:xz S S D:x2-y2 S D:x2-y2 D:x2-y2 D:x2-y2 D:yz S D:yz D:yz D:xz D:yz S D:xz S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="33"
                               units="nonsi:electronvolt">-5.506 -5.506 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -4.498 -4.498 -5.688 -4.498 -5.688 -4.498 -5.688 -5.688 -4.498 -5.688 -4.498 -4.498 -4.498 -4.498 -5.688 -4.498 -4.498 -4.498 -4.498 -5.688 -4.498 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="33">1.00 1.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 0.80 0.80 2.00 0.80 2.00 0.80 2.00 2.00 0.80 2.00 0.80 0.80 0.80 0.80 2.00 0.80 0.80 0.80 0.80 2.00 0.80 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="33">105 104 12 18 7 5 12 18 7 5 16 16 19 19 9 10 3 2 9 6 3 1 11 14 19 20 9 16 4 3 15 8 10</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="33">P P W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.699</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">655</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">5.94 5.69 5.51 5.36 5.36 5.17 5.11 5.10 5.00 4.97 4.93 4.84 4.77 4.76 4.76 4.63 -2.84 -2.78 2.23 2.20 2.00 1.98 1.80 1.71 1.56 1.40 1.13 1.10 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">3 3 3 3 2 2 2 2 2 3 2 2 3 3 2 3 2 2 3 2 3 2 3 2 2 2 2 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">S S S S S S S S S S S S S S S S P:z P:z S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 -5.688 -5.688 1.231 1.231 -5.688 1.231 -1.119 -1.119 0.762 -5.688 1.231 -5.688 1.231 -5.688 -5.688 -5.052 -5.688 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 0.00 2.00 2.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 2.00 0.00 2.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">20 10 17 4 17 4 13 20 15 15 8 10 2 13 2 8 100 102 102 7 7 12 12 3 16 102 5 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W W W W W W W W W W W W W W W Tc Tc Tc W W W W W W Tc W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.750</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">656</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">2.65 2.61 2.42 2.41 2.37 2.36 1.54 1.54 1.51 1.51 1.17 1.16 1.15 1.15 1.12 1.12 1.12 1.10 1.10 1.10 1.09 1.09 1.05 1.04 1.02 1.02 1.01 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">2 2 1 1 1 1 2 2 2 2 1 1 1 1 1 1 1 1 1 1 1 1 1 1 3 3 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">P:y P:y D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 S S S S P:y P:y P:y P:y D:yz D:yz D:yz D:yz D:xz D:xz D:xz D:xz D:xz D:xz S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">-5.506 -5.506 -4.498 -4.498 -4.498 -4.498 -5.688 -5.688 -5.688 -5.688 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 1.231 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">1.00 1.00 0.80 0.80 0.80 0.80 2.00 2.00 2.00 2.00 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">104 105 14 1 6 11 2 15 20 10 70 47 63 58 16 19 3 9 3 16 19 9 4 17 2 15 13 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">P P W W W W W W W W O O O O W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.882</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">657</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="38">3.46 3.42 3.33 3.33 3.30 3.27 3.27 3.18 2.85 2.83 2.67 2.62 1.60 1.59 1.59 1.55 1.35 1.33 1.29 1.28 1.28 1.27 1.27 1.27 1.20 1.20 1.17 1.16 1.16 1.15 1.15 1.14 1.14 1.12 1.10 1.10 1.08 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="38">3 3 1 1 3 3 1 1 2 2 2 2 1 1 1 1 1 1 1 3 3 3 1 3 2 2 3 3 3 2 2 3 2 2 2 2 1 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="38">S S D:x2-y2 D:x2-y2 S S D:x2-y2 D:x2-y2 S S S S P:y P:y P:y P:y D:z2 D:z2 D:z2 S S S D:z2 S S S S S S P:y P:y S P:y P:y S S D:yz S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="38"
                               units="nonsi:electronvolt">1.231 1.231 -4.498 -4.498 1.231 1.231 -4.498 -4.498 -5.688 -5.688 -5.688 -5.688 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 1.231 1.231 1.231 -4.498 1.231 -5.688 -5.688 1.231 1.231 1.231 -0.500 -0.500 1.231 -0.500 -0.500 -5.688 -5.688 -4.498 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="38">0.00 0.00 0.80 0.80 0.00 0.00 0.80 0.80 2.00 2.00 2.00 2.00 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.00 0.00 0.00 0.80 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.80 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="38">16 19 1 6 3 9 14 11 9 3 16 19 70 47 63 58 1 6 14 2 10 7 11 5 18 12 15 18 12 14 1 20 6 11 7 5 20 15</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="38">W W W W W W W W W W W W O O O O W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.889</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">658</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">8.64 8.59 4.39 4.30 2.23 2.22 1.65 1.65 1.60 1.58 1.57 1.57 1.47 1.46 1.37 1.37 1.30 1.30 1.28 1.26 1.23 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2 P:z P:z D:xy D:yz D:xy D:yz P:z P:z D:xy D:xy P:z P:z D:yz D:yz P:x P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">2 15 16 3 16 3 32 65 16 20 3 10 44 69 15 2 64 31 4 17 30 40</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">W W W W W W O O W W W W O O W W O O W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.891</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">659</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="22">8.71 8.57 4.39 4.32 2.28 2.25 1.69 1.66 1.66 1.60 1.60 1.59 1.51 1.50 1.39 1.38 1.35 1.35 1.25 1.24 1.22 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="22">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="22">D:yz D:yz D:yz D:yz D:x2-y2 D:x2-y2 D:yz P:z P:z D:xy D:xy D:yz P:z P:z D:xy D:xy P:z P:z P:x D:yz D:yz P:z</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="22"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -9.089 -9.089 -9.089 -4.498 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="22">0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 1.33 1.33 0.80 0.80 1.33 1.33 1.33 0.80 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="22">10 20 19 9 19 9 15 53 80 19 9 2 84 89 10 20 48 92 93 8 13 96</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="22">W W W W W W W O O W W W O O W W O O O W W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.949</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">660</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="44">3.49 3.45 3.13 3.07 3.02 3.00 2.95 2.88 2.78 2.69 2.63 2.58 2.57 2.55 2.53 2.53 2.46 2.42 2.41 2.40 2.22 2.13 2.10 2.09 2.05 2.05 2.00 1.96 1.82 1.78 1.56 1.53 1.44 1.43 1.38 1.34 1.31 1.29 1.25 1.23 -1.03 1.02 -1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="44">2 2 3 3 2 2 2 2 3 3 2 3 3 2 3 3 3 2 2 3 3 3 3 2 2 3 2 2 3 3 2 2 1 1 2 2 1 1 2 2 2 3 2 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="44">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S D:xz D:xz S S D:xz D:xz S S P:y S P:y S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="44"
                               units="nonsi:electronvolt">-5.688 -5.688 1.231 1.231 -5.688 -5.688 -5.688 -5.688 1.231 1.231 -5.688 1.231 1.231 -5.688 1.231 1.231 1.231 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -5.688 1.231 -5.688 -5.688 1.231 1.231 -5.688 -5.688 -4.498 -4.498 -5.688 -5.688 -4.498 -4.498 -5.688 -5.688 -1.119 1.231 -1.119 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="44">2.00 2.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 2.00 0.00 0.00 2.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 2.00 2.00 0.00 0.00 2.00 2.00 0.80 0.80 2.00 2.00 0.80 0.80 2.00 2.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="44">8 13 13 8 16 3 4 17 7 12 19 15 17 9 4 2 5 12 7 18 3 16 20 18 5 10 2 15 9 19 10 20 14 1 6 11 6 11 1 14 100 11 102 6</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="44">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W Tc W Tc W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.960</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">661</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="42">3.07 3.05 2.83 2.80 2.80 2.77 2.69 2.67 2.64 2.63 2.32 2.32 2.27 2.24 2.24 2.21 2.20 2.20 2.19 2.13 1.55 1.55 1.53 1.53 1.51 1.47 1.35 1.34 1.34 1.30 1.17 1.15 1.15 1.14 1.13 1.10 1.09 1.09 1.07 1.07 1.04 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="42">2 2 2 3 2 3 3 3 2 2 2 3 3 1 2 1 1 3 3 1 3 3 1 2 2 1 2 2 1 1 1 3 1 3 1 1 3 3 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="42">S S S S S S S S S S S S S D:x2-y2 S D:x2-y2 D:x2-y2 S S D:x2-y2 S S D:yz S S D:yz S S D:yz D:yz P:y S P:y S P:y P:y S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="42"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 1.231 -5.688 1.231 1.231 1.231 -5.688 -5.688 -5.688 1.231 1.231 -4.498 -5.688 -4.498 -4.498 1.231 1.231 -4.498 1.231 1.231 -4.498 -5.688 -5.688 -4.498 -5.688 -5.688 -4.498 -4.498 -9.089 1.231 -9.089 1.231 -9.089 -9.089 1.231 1.231 -5.688 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="42">2.00 2.00 2.00 0.00 2.00 0.00 0.00 0.00 2.00 2.00 2.00 0.00 0.00 0.80 2.00 0.80 0.80 0.00 0.00 0.80 0.00 0.00 0.80 2.00 2.00 0.80 2.00 2.00 0.80 0.80 1.33 0.00 1.33 0.00 1.33 1.33 0.00 0.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="42">10 20 17 17 4 4 10 20 15 2 8 8 13 14 13 1 6 15 2 11 9 19 20 19 9 10 18 5 2 15 70 16 47 3 63 58 18 5 16 3 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="42">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W O W O W O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.962</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">662</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="17">7.80 7.64 3.66 3.61 2.09 2.00 1.98 1.94 1.47 1.47 1.31 1.30 1.20 1.18 1.12 1.10 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="17">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="17">D:yz D:yz D:yz D:yz D:yz D:yz D:xy D:xy P:z P:z P:z P:z D:x2-y2 D:x2-y2 D:xy D:xy D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="17"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="17">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="17">18 5 7 12 17 4 5 18 67 34 71 49 4 17 4 17 13</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="17">W W W W W W W W O O O O W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">0.968</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">663</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">8.17 8.10 4.05 3.97 2.09 2.07 2.07 2.07 1.51 1.50 1.42 1.42 1.28 1.28 1.07 1.07 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:yz D:yz D:yz D:yz D:yz D:xy D:yz D:xy P:z P:z P:z P:z D:x2-y2 D:x2-y2 D:xy D:xy D:xy D:xy</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 1.33 1.33 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">7 12 5 18 13 12 8 7 94 87 50 55 13 8 13 8 18 5</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W W W O O O O W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.011</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">664</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">7.96 7.96 7.77 7.76 1.60 1.58 1.33 1.31 1.31 1.26 1.14 1.12 1.10 1.09 1.08 1.08 1.07 1.05</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:xz D:xz D:xz D:xz P:y P:y D:yz D:yz D:yz D:yz P:y D:yz D:yz P:y P:y D:yz P:y D:yz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -4.498 -9.089 -4.498 -4.498 -9.089 -9.089 -4.498 -9.089 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 0.80 1.33 0.80 0.80 1.33 1.33 0.80 1.33 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">1 14 6 11 37 86 17 13 4 8 30 16 3 93 26 19 85 9</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W O O W W W W O W W O O W O W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.021</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">665</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">7.34 7.33 6.95 6.94 6.71 6.64 6.48 6.45 1.93 1.86 1.73 1.69 1.61 1.58 1.28 1.23</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">2 2 3 3 2 2 3 3 1 1 1 1 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">S S S S S S S S D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-5.688 -5.688 1.231 1.231 -5.688 -5.688 1.231 1.231 -4.498 -4.498 -4.498 -4.498 -5.688 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.80 0.80 0.80 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">14 1 1 14 6 11 6 11 1 14 11 6 3 16 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.023</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">666</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="16">6.52 6.51 6.30 6.29 1.44 1.40 1.38 1.36 1.32 1.25 1.20 1.16 1.15 1.14 1.14 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="16">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="16">D:xz D:xz D:xz D:xz D:yz D:yz D:yz D:yz P:y P:y D:yz D:yz D:yz P:y D:yz P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="16"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089 -4.498 -4.498 -4.498 -9.089 -4.498 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="16">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33 0.80 0.80 0.80 1.33 0.80 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="16">6 11 14 1 13 8 17 4 86 37 19 9 16 93 3 30</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="16">W W W W W W W W O O W W W O W O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.047</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="30">7.73 7.72 7.44 7.40 5.94 5.94 5.75 5.73 3.40 3.38 2.10 2.06 2.00 1.98 1.73 1.72 1.67 1.66 -1.64 1.57 1.55 1.55 -1.43 1.29 1.27 1.10 1.09 1.05 1.02 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="30">2 2 2 2 3 3 3 3 2 2 2 2 2 2 3 3 3 3 2 3 1 3 2 2 2 1 1 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="30">S S S S S S S S S S S S S S S S S S P:z S S S P:z S S D:xz D:xz S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="30"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -1.119 1.231 -6.493 1.231 -1.119 -5.688 -5.688 -4.498 -4.498 2.471 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="30">2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 2.00 2.00 0.80 0.80 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="30">9 19 16 3 19 9 16 3 17 4 12 7 5 18 17 4 5 18 103 12 106 7 101 8 13 8 13 106 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="30">W W W W W W W W W W W W W W W W W W Tc W H W Tc W W W W H W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.057</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">668</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="28">5.64 5.63 5.50 5.49 5.23 5.23 5.23 5.22 3.28 3.27 2.43 2.41 2.04 2.03 1.88 1.87 1.79 1.78 1.52 1.51 1.50 1.49 1.41 1.39 1.16 1.15 -1.05 -1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="28">3 3 2 2 3 2 3 2 2 2 2 2 3 3 2 2 1 1 1 1 2 2 3 3 3 3 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="28">S S S S S S S S S S S S S S S S D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="28"
                               units="nonsi:electronvolt">1.231 1.231 -5.688 -5.688 1.231 -5.688 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 -5.688 -5.688 1.231 1.231 1.231 1.231 0.762 0.762</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="28">0.00 0.00 2.00 2.00 0.00 2.00 0.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 2.00 2.00 0.80 0.80 0.80 0.80 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="28">6 11 6 11 14 14 1 1 2 15 10 20 15 2 13 8 11 6 1 14 17 4 10 20 13 8 102 100</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="28">W W W W W W W W W W W W W W W W W W W W W W W W W W Tc Tc</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.151</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">669</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">8.16 8.12 7.45 7.42 6.75 6.70 6.41 6.37 -6.21 -6.03 3.54 3.52 3.41 3.40 3.17 -3.16 3.16 3.16 3.15 3.02 -3.02 3.00 2.65 2.64 1.29 1.21 1.20 1.05 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">2 2 2 2 3 3 3 3 2 2 3 3 3 3 2 3 2 2 2 2 3 2 2 2 3 3 3 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.052 -5.052 1.231 1.231 1.231 1.231 -5.688 0.762 -5.688 -5.688 -5.688 -5.688 0.762 -5.688 -5.688 -5.688 0.762 1.231 1.231 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 0.00 2.00 2.00 2.00 2.00 0.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">18 5 7 12 18 5 7 12 101 103 3 16 19 9 19 101 9 3 16 1 103 14 11 6 102 14 1 6 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">W W W W W W W W Tc Tc W W W W W Tc W W W W Tc W W W Tc W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.180</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">670</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">2.58 2.48 2.11 2.07 1.85 1.78 1.72 1.68 1.66 1.66 1.63 1.62 1.57 1.57 1.51 1.48 1.46 1.45 1.45 1.44 1.21 1.19 1.15 1.15 1.12 1.08 1.06 1.04 1.03 1.03 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 1 1 1 1 1 1 1 3 1 1 2 3 2 1 1 1 1 1 1 1 1 1 1 3 2 3 1 2 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">D:xz D:xz D:xz D:xz D:xz D:xz D:xz D:xz S D:x2-y2 D:x2-y2 S S S D:xz D:x2-y2 D:xz D:xz D:xz D:x2-y2 D:xz D:xz D:x2-y2 D:x2-y2 S S S D:x2-y2 S D:x2-y2 D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 -4.498 -4.498 -5.688 1.231 -5.688 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 -5.688 1.231 -4.498 -5.688 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.80 0.80 2.00 0.00 2.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.00 2.00 0.00 0.80 2.00 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">3 16 4 17 9 19 5 18 4 15 2 4 17 17 8 5 13 15 2 18 7 12 10 20 8 8 13 7 13 12 10 20</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.188</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">671</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.74 4.62 4.23 4.13 3.87 3.84 3.01 3.01 2.84 2.63 2.54 2.44 2.22 2.15 2.05 1.95 1.89 1.82 1.81 1.68 1.67 1.64 1.56 1.52 1.51 -1.47 -1.16 1.08 1.07 1.04 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">2 3 2 3 2 2 3 3 3 3 1 1 1 1 1 2 2 3 3 2 1 1 2 1 2 2 2 2 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">S S S S S S S S S S D:xz S D:xz D:xz D:xz S S S S S S D:xz S D:xz S P:x P:x S S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-5.688 1.231 -5.688 1.231 -5.688 -5.688 1.231 1.231 1.231 1.231 -4.498 -6.493 -4.498 -4.498 -4.498 -5.688 -5.688 1.231 1.231 -5.688 -6.493 -4.498 2.471 -4.498 -5.688 -1.119 -1.119 -5.052 -5.052 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">2.00 0.00 2.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.80 1.00 0.80 0.80 0.80 2.00 2.00 0.00 0.00 2.00 1.00 0.80 0.00 0.80 2.00 0.00 0.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">13 13 8 8 2 15 2 15 4 17 19 106 3 9 16 20 10 20 10 4 107 4 106 17 17 100 102 103 101 3 16</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">W W W W W W W W W W W H W W W W W W W W H W H W W Tc Tc Tc Tc W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.192</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">672</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">2.76 2.65 2.47 2.44 2.22 2.05 1.96 1.95 1.82 1.78 1.73 1.72 1.69 1.63 1.61 1.61 1.55 1.53 1.48 1.47 1.42 1.34 1.31 1.20 1.14 1.13 1.13 1.07 1.04 1.04 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">1 2 3 1 2 3 1 2 3 1 2 1 1 1 1 1 1 3 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">D:xz S S D:xz S S D:xz S S D:xz S D:xz D:xz D:xz D:x2-y2 D:x2-y2 D:xz S D:xz D:xz D:x2-y2 D:x2-y2 D:xz D:xz D:x2-y2 D:xz D:x2-y2 D:xz D:xz D:xz D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">-4.498 -5.688 1.231 -4.498 -5.688 1.231 -4.498 -5.688 1.231 -4.498 -5.688 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 1.231 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">0.80 2.00 0.00 0.80 2.00 0.00 0.80 2.00 0.00 0.80 2.00 0.80 0.80 0.80 0.80 0.80 0.80 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">9 8 8 19 13 13 16 17 17 8 4 13 3 7 10 20 12 4 10 20 7 12 17 18 2 4 15 5 15 2 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.272</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">673</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="31">4.07 4.05 3.16 3.12 2.67 2.66 2.53 1.84 1.83 1.83 1.82 1.82 1.81 1.72 1.69 1.69 1.58 1.58 1.54 1.53 1.50 1.48 1.48 1.46 1.45 -1.14 1.05 1.04 1.04 1.02 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="31">3 3 1 1 2 2 1 3 2 3 1 2 1 1 2 2 3 3 1 1 2 3 3 1 1 2 2 2 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="31">S S D:xz D:xz S S S S S S D:xz S D:xz S S S S S D:xz D:xz S S S D:xz D:xz P:x S S S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="31"
                               units="nonsi:electronvolt">1.231 1.231 -4.498 -4.498 -5.688 -5.688 -6.493 1.231 -5.688 1.231 -4.498 -5.688 -4.498 -6.493 -5.688 -5.688 1.231 1.231 -4.498 -4.498 2.471 1.231 1.231 -4.498 -4.498 -1.119 2.471 -5.688 -5.688 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="31">0.00 0.00 0.80 0.80 2.00 2.00 1.00 0.00 2.00 0.00 0.80 2.00 0.80 1.00 2.00 2.00 0.00 0.00 0.80 0.80 0.00 0.00 0.00 0.80 0.80 0.00 0.00 2.00 2.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="31">8 13 9 19 8 13 107 20 20 10 16 10 3 106 15 2 17 4 17 4 107 2 15 8 13 102 106 18 5 6 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="31">W W W W W W H W W W W W W H W W W W W W H W W W W Tc H W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.311</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">674</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="40">3.92 3.91 3.57 3.56 3.53 3.52 3.10 3.10 2.35 2.35 2.23 2.23 2.06 2.05 2.00 2.00 1.96 1.95 1.81 1.80 1.74 1.74 1.72 1.72 1.54 1.54 1.47 1.47 1.47 1.47 1.47 1.47 1.32 1.32 1.30 1.29 1.28 1.28 1.20 1.20</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="40">2 2 2 2 2 2 2 2 2 2 3 3 2 2 3 3 3 3 3 3 2 2 2 2 2 2 3 3 3 3 3 3 1 1 2 2 3 3 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="40">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S D:xz D:xz S S S S D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="40"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 -4.498 -4.498 -5.688 -5.688 1.231 1.231 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="40">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.80 2.00 2.00 0.00 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="40">13 8 4 17 2 15 20 10 9 19 15 2 3 16 10 20 13 8 4 17 14 1 11 6 18 5 19 9 11 6 14 1 13 8 7 12 3 16 17 4</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="40">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.367</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">675</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">5.49 5.45 5.04 5.04 5.00 5.00 4.54 4.51 3.38 3.35 3.15 3.11 2.78 2.74 2.67 2.62 2.50 2.47 2.41 2.37 2.32 2.28 2.15 2.12 2.01 1.97 1.80 1.75 1.59 1.55 1.43 1.39</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">2 2 2 2 2 2 2 2 2 2 2 2 2 2 3 3 2 2 3 3 3 3 3 3 3 3 3 3 3 3 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">20 10 15 4 2 17 8 13 7 12 5 18 16 3 10 20 19 9 2 15 12 7 18 5 17 4 13 8 3 16 9 19</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.402</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">676</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="29">9.78 9.47 2.98 2.96 2.77 2.52 2.07 2.06 1.79 1.79 1.62 1.53 1.53 1.53 1.52 1.52 1.52 1.52 1.51 1.26 1.26 -1.25 1.15 1.15 1.13 1.13 -1.08 1.06 1.06</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="29">2 2 1 1 3 3 1 1 2 2 1 1 3 1 1 1 3 3 3 2 2 2 2 2 1 1 2 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="29">S S D:xz D:xz S S D:xz D:xz S S S D:x2-y2 S D:x2-y2 D:x2-y2 D:x2-y2 S S S S S P:x S S D:xz D:xz P:x D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="29"
                               units="nonsi:electronvolt">-5.052 -5.052 -4.498 -4.498 0.762 0.762 -4.498 -4.498 -5.688 -5.688 -6.493 -4.498 1.231 -4.498 -4.498 -4.498 1.231 1.231 1.231 -5.688 -5.688 -1.119 -5.688 -5.688 -4.498 -4.498 -1.119 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="29">2.00 2.00 0.80 0.80 0.00 0.00 0.80 0.80 2.00 2.00 1.00 0.80 0.00 0.80 0.80 0.80 0.00 0.00 0.00 2.00 2.00 0.00 2.00 2.00 0.80 0.80 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="29">101 103 8 13 101 103 4 17 9 19 107 18 9 5 12 7 19 16 3 3 16 101 5 18 18 5 103 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="29">Tc Tc W W Tc Tc W W W W H W W W W W W W W W W Tc W W W W Tc W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.495</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">677</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">8.61 8.60 8.58 8.56 4.36 4.32 4.28 4.28 2.87 2.86 2.85 2.84 2.69 2.69 2.67 2.66 1.16 1.15 1.13 1.13 1.07 1.05 1.04 1.03 1.00 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">2 2 2 2 3 3 3 3 2 2 2 2 2 2 2 2 3 3 3 3 3 3 3 3 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">S S S S S S S S S S S S S S S S S S S S S S S S D:x2-y2 D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">6 1 11 14 11 14 1 6 17 13 8 4 15 20 10 2 8 4 17 13 10 2 20 15 14 11</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.553</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">678</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">3.80 3.79 2.82 2.82 2.79 2.79 2.50 2.50 2.37 2.36 2.31 2.30 1.92 1.92 1.88 1.87 1.10 1.10</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz D:xz D:xz D:x2-y2 D:x2-y2 D:xz D:xz D:xz D:xz D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">20 10 18 5 2 15 5 18 20 10 12 7 12 7 2 15 4 17</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.582</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">679</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="24">5.50 5.21 3.12 2.77 2.71 2.70 2.55 2.53 1.99 1.76 1.75 1.75 1.73 1.36 1.36 1.33 1.31 1.31 1.16 1.15 1.14 1.13 1.07 1.07</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="24">2 2 3 3 1 1 1 1 3 1 1 1 1 1 1 2 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="24">S S S S D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 S D:xz D:xz D:xz D:xz D:x2-y2 D:x2-y2 S D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:x2-y2 D:xz D:xz</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="24"
                               units="nonsi:electronvolt">-5.052 -5.052 0.762 0.762 -4.498 -4.498 -4.498 -4.498 0.762 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -5.052 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="24">2.00 2.00 0.00 0.00 0.80 0.80 0.80 0.80 0.00 0.80 0.80 0.80 0.80 0.80 0.80 2.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="24">101 103 101 103 2 15 20 10 100 20 10 2 15 3 16 100 5 18 9 19 12 7 5 18</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="24">Tc Tc Tc Tc W W W W Tc W W W W W W Tc W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.614</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">680</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="27">4.52 4.50 4.08 4.06 3.67 3.64 3.17 3.16 2.29 1.77 1.55 1.55 1.52 1.51 1.50 1.50 1.29 1.29 1.27 1.26 1.12 1.09 1.08 1.06 1.06 1.05 1.03</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="27">2 2 2 2 3 3 3 3 2 2 2 2 1 1 2 2 1 1 1 1 1 1 1 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="27">S S S S S S S S P:y P:y S S D:x2-y2 D:x2-y2 S S D:xz D:xz D:x2-y2 D:x2-y2 D:yz D:xz D:xz S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="27"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.506 -5.506 -5.688 -5.688 -4.498 -4.498 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 -6.613 -4.498 -4.498 -5.688 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="27">2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 1.00 1.00 2.00 2.00 0.80 0.80 2.00 2.00 0.80 0.80 0.80 0.80 1.00 0.80 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="27">2 15 20 10 15 2 10 20 104 105 9 19 1 14 16 3 16 3 11 6 100 9 19 6 11 14 1</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="27">W W W W W W W W P P W W W W W W W W W W Tc W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.626</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">681</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="23">3.57 3.18 2.26 2.12 2.07 2.05 1.93 1.86 1.84 1.83 1.83 1.73 1.67 1.61 1.35 1.31 1.27 1.23 1.19 1.19 1.10 1.03 1.01</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="23">2 2 3 3 1 1 2 1 1 1 2 3 1 3 2 1 2 1 1 1 3 3 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="23">P:y P:y S S D:yz D:yz S D:yz D:yz D:yz S S D:yz S S D:yz S D:x2-y2 D:yz D:x2-y2 S S D:x2-y2</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="23"
                               units="nonsi:electronvolt">-5.506 -5.506 1.231 1.231 -4.498 -4.498 -5.688 -6.613 -4.498 -4.498 -5.688 1.231 -6.613 1.231 -5.688 -6.613 -5.688 -4.498 -6.613 -4.498 1.231 1.231 -4.498</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="23">1.00 1.00 0.00 0.00 0.80 0.80 2.00 1.00 0.80 0.80 2.00 0.00 1.00 0.00 2.00 1.00 2.00 0.80 1.00 0.80 0.00 0.00 0.80</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="23">105 104 20 10 10 20 10 102 2 15 20 15 100 2 2 103 15 6 101 11 3 16 1</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="23">P P W W W W W Tc W W W W Tc W W Tc W W Tc W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.661</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">682</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="26">3.74 3.74 3.71 3.70 2.96 2.95 2.95 2.94 2.91 2.90 2.89 2.88 2.31 2.30 2.29 2.28 2.09 2.08 2.00 1.99 1.65 1.54 1.27 1.27 1.24 1.24</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="26">2 2 2 2 2 2 2 2 1 1 1 1 3 3 3 3 3 3 3 3 2 2 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="26">S S S S S S S S D:yz D:yz D:yz D:yz S S S S S S S S P:y P:y S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="26"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -4.498 -4.498 -4.498 -4.498 1.231 1.231 1.231 1.231 1.231 1.231 1.231 1.231 -5.506 -5.506 -5.688 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="26">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.00 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="26">14 1 6 11 19 9 3 16 5 18 7 12 8 17 13 4 9 19 16 3 105 104 4 17 13 8</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="26">W W W W W W W W W W W W W W W W W W W W P P W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.699</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">683</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="18">3.97 3.97 3.97 3.95 1.74 1.74 1.70 1.69 1.63 1.63 1.56 1.56 1.18 1.17 1.17 1.16 1.14 1.13</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="18">1 1 1 1 3 3 3 3 1 1 1 1 1 1 1 1 1 1</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="18">D:yz D:yz D:yz D:yz S S S S D:yz D:yz D:yz D:yz D:xz D:xz D:xz D:xz P:y P:y</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="18"
                               units="nonsi:electronvolt">-4.498 -4.498 -4.498 -4.498 1.231 1.231 1.231 1.231 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -9.089 -9.089</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="18">0.80 0.80 0.80 0.80 0.00 0.00 0.00 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 1.33 1.33</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="18">5 18 7 12 8 4 17 13 2 15 10 20 8 17 13 4 26 85</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="18">W W W W W W W W W W W W W W W W O O</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.740</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">684</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">5.38 5.38 5.38 5.38 5.10 5.10 5.08 5.07 2.92 2.91 2.87 2.85 2.15 2.14 2.09 2.09 1.85 1.84 1.83 1.83 1.70 1.70 1.63 1.62 1.15 1.14 1.12 1.12 1.06 1.06 1.04 1.04</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">2 2 2 2 2 2 2 2 3 3 3 3 2 2 2 2 3 3 3 3 1 1 1 1 1 1 1 1 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">S S S S S S S S S S S S S S S S S S S S D:yz D:yz D:yz D:yz D:yz D:yz D:yz D:yz S S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -4.498 -5.688 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">2.00 2.00 2.00 2.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 0.80 0.80 0.80 0.80 0.80 0.80 0.80 0.80 2.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">18 5 7 12 19 9 3 16 19 9 3 16 4 17 13 8 7 18 5 12 10 20 15 2 7 12 18 5 20 10 15 2</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.792</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">685</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="25">6.59 6.56 6.55 6.52 3.93 3.87 3.86 3.82 1.71 1.70 1.69 1.69 1.57 1.57 1.56 1.56 1.56 1.55 1.52 1.51 -1.10 -1.08 1.02 1.01 1.00</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="25">2 2 2 2 3 3 3 3 2 2 2 2 3 1 3 1 3 3 1 1 2 2 2 2 2</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="25">S S S S S S S S S S S S S D:yz S D:yz S S D:yz D:yz P:y P:y S S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="25"
                               units="nonsi:electronvolt">-5.688 -5.688 -5.688 -5.688 1.231 1.231 1.231 1.231 -5.688 -5.688 -5.688 -5.688 1.231 -4.498 1.231 -4.498 1.231 1.231 -4.498 -4.498 -1.119 -1.119 -5.688 -5.688 -5.688</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="25">2.00 2.00 2.00 2.00 0.00 0.00 0.00 0.00 2.00 2.00 2.00 2.00 0.00 0.80 0.00 0.80 0.00 0.00 0.80 0.80 0.00 0.00 2.00 2.00 2.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="25">7 18 12 5 12 5 7 18 16 9 3 19 19 10 3 20 9 16 2 15 103 101 1 11 14</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="25">W W W W W W W W W W W W W W W W W W W W Tc Tc W W W</array>
                     </list>
                     <list cmlx:templateRef="mo">
                        <scalar dataType="xsd:double"
                                dictRef="cc:mo.energy"
                                units="nonsi:electronvolt">1.843</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:mo.occupation">0.00</scalar>
                        <scalar dataType="xsd:integer" dictRef="cc:mo.number">686</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:mo.label">A</scalar>
                        <array dataType="xsd:double" dictRef="cc:percent" size="32">8.30 5.21 3.62 3.42 2.80 2.78 2.54 2.25 2.22 2.10 2.09 1.84 1.78 1.78 1.73 1.71 -1.60 1.55 1.54 1.51 1.50 1.44 1.35 1.34 1.24 1.16 -1.10 1.10 -1.09 1.09 1.05 1.02</array>
                        <array dataType="xsd:integer" dictRef="cc:sfo1" size="32">1 2 2 2 1 1 2 3 3 2 2 2 1 1 1 1 2 1 1 1 1 1 1 1 3 2 2 1 2 1 3 3</array>
                        <array dataType="xsd:string" dictRef="cc:sfo2" size="32">S S P:z P:x D:x2-y2 D:x2-y2 S S S S S S D:x2-y2 D:x2-y2 D:yz D:yz D:x2-y2 D:xz D:xz D:x2-y2 D:x2-y2 S P:y P:y S P:z D:xz D:xz P:z D:xz S S</array>
                        <array dataType="xsd:double"
                               dictRef="cc:energy"
                               size="32"
                               units="nonsi:electronvolt">-6.493 -5.052 -5.506 -5.506 -4.498 -4.498 2.471 1.231 1.231 -5.052 -5.052 -5.052 -4.498 -4.498 -4.498 -4.498 3.846 -4.498 -4.498 -4.498 -4.498 -6.493 -9.089 -9.089 0.762 -5.506 3.846 -4.498 9.585 -4.498 1.231 1.231</array>
                        <array dataType="xsd:double" dictRef="cc:occupation" size="32">1.00 2.00 1.00 1.00 0.80 0.80 0.00 0.00 0.00 2.00 2.00 2.00 0.80 0.80 0.80 0.80 0.00 0.80 0.80 0.80 0.80 1.00 1.33 1.33 0.00 1.00 0.00 0.80 0.00 0.80 0.00 0.00</array>
                        <array dataType="xsd:integer" dictRef="cc:fragment1" size="32">107 102 105 105 11 6 107 6 11 101 103 100 10 20 13 8 102 11 6 9 19 106 63 58 102 104 102 19 21 9 7 12</array>
                        <array dataType="xsd:string" dictRef="cc:fragment2" size="32">H Tc P P W W H W W Tc Tc Tc W W W W Tc W W W W H O O Tc P Tc W O W W W</array>
                     </list>
                  </module>
               </module>
            </module>
         </module>
      </module>
   </module>
</module>
