<?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">ADF</scalar>
               </parameter>
               <parameter dictRef="cc:programVersion">
                  <scalar dataType="xsd:integer">2019</scalar>
               </parameter>
               <parameter dictRef="cc:compileDate">
                  <scalar dataType="xsd:string">2019-04-25</scalar>
               </parameter>
               <parameter dictRef="cc:programFlavour">
                  <scalar dataType="xsd:string">x86_64_linux_intel / intelmpi</scalar>
               </parameter>
               <parameter dictRef="cc:runDate">
                  <scalar dataType="xsd:string">Jul07-2020 12:51:51</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 id="method">DFT</scalar>
               </parameter>
               <parameter dictRef="cc:functional">
                  <scalar dataType="xsd:string">PBEc PBEx</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string" id="copy.0">TZP</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string" id="copy.1">TZP</scalar>
               </parameter>
               <parameter dictRef="cc:basis">
                  <scalar dataType="xsd:string" id="copy.2">TZP</scalar>
               </parameter>
            </parameterList>
            <molecule id="coordinates">
               <atomArray>
                  <atom elementType="Mo"
                        id="a1"
                        x3="2.0160"
                        y3="1.0805"
                        z3="-2.3749"/>
                  <atom elementType="Mo"
                        id="a2"
                        x3="0.0070"
                        y3="-0.5311"
                        z3="0.0353"/>
                  <atom elementType="H"
                        id="a3"
                        x3="-0.5826"
                        y3="5.2585"
                        z3="-2.3100"/>
                  <atom elementType="O"
                        id="a4"
                        x3="-0.6909"
                        y3="4.2435"
                        z3="1.1448"/>
                  <atom elementType="O"
                        id="a5"
                        x3="-1.0049"
                        y3="-1.9078"
                        z3="0.4183"/>
                  <atom elementType="Mo"
                        id="a6"
                        x3="0.8811"
                        y3="1.5626"
                        z3="5.7188"/>
                  <atom elementType="O"
                        id="a7"
                        x3="3.2656"
                        y3="2.3122"
                        z3="-2.5046"/>
                  <atom elementType="O" id="a8" x3="2.6791" y3="1.2757" z3="6.5130"/>
                  <atom elementType="O"
                        id="a9"
                        x3="2.7624"
                        y3="2.0831"
                        z3="-6.1063"/>
                  <atom elementType="O"
                        id="a10"
                        x3="-0.1422"
                        y3="2.4629"
                        z3="4.3595"/>
                  <atom elementType="O"
                        id="a11"
                        x3="3.5668"
                        y3="2.4298"
                        z3="1.4203"/>
                  <atom elementType="O"
                        id="a12"
                        x3="1.6268"
                        y3="1.2803"
                        z3="-0.2302"/>
                  <atom elementType="O"
                        id="a13"
                        x3="-0.7461"
                        y3="6.0788"
                        z3="-0.9246"/>
                  <atom elementType="O"
                        id="a14"
                        x3="0.1647"
                        y3="-0.4933"
                        z3="-1.7761"/>
                  <atom elementType="Mo"
                        id="a15"
                        x3="0.8047"
                        y3="2.2927"
                        z3="-5.8827"/>
                  <atom elementType="Mo"
                        id="a16"
                        x3="0.3475"
                        y3="2.8995"
                        z3="-0.1486"/>
                  <atom elementType="O"
                        id="a17"
                        x3="0.9074"
                        y3="-0.1748"
                        z3="1.8944"/>
                  <atom elementType="O"
                        id="a18"
                        x3="0.9663"
                        y3="4.8788"
                        z3="3.4478"/>
                  <atom elementType="O"
                        id="a19"
                        x3="1.4987"
                        y3="0.8626"
                        z3="-4.0851"/>
                  <atom elementType="O"
                        id="a20"
                        x3="0.3875"
                        y3="-0.0894"
                        z3="5.4275"/>
                  <atom elementType="O"
                        id="a21"
                        x3="-2.2081"
                        y3="2.2950"
                        z3="2.4031"/>
                  <atom elementType="Mo"
                        id="a22"
                        x3="-1.5347"
                        y3="2.9817"
                        z3="-2.9769"/>
                  <atom elementType="O"
                        id="a23"
                        x3="2.4666"
                        y3="1.2940"
                        z3="3.8069"/>
                  <atom elementType="Mo"
                        id="a24"
                        x3="-2.4796"
                        y3="5.3953"
                        z3="0.0960"/>
                  <atom elementType="O"
                        id="a25"
                        x3="-2.5910"
                        y3="6.7194"
                        z3="1.2643"/>
                  <atom elementType="O"
                        id="a26"
                        x3="0.8337"
                        y3="2.4792"
                        z3="1.7437"/>
                  <atom elementType="H"
                        id="a27"
                        x3="1.7047"
                        y3="4.2567"
                        z3="4.8317"/>
                  <atom elementType="O"
                        id="a28"
                        x3="0.2048"
                        y3="0.8700"
                        z3="-6.7126"/>
                  <atom elementType="H"
                        id="a29"
                        x3="-2.7227"
                        y3="2.9448"
                        z3="1.8020"/>
                  <atom elementType="H"
                        id="a30"
                        x3="-1.7898"
                        y3="1.6820"
                        z3="1.7395"/>
                  <atom elementType="O"
                        id="a31"
                        x3="2.9891"
                        y3="-0.4808"
                        z3="-1.9468"/>
                  <atom elementType="O"
                        id="a32"
                        x3="3.5296"
                        y3="-0.2922"
                        z3="1.5403"/>
                  <atom elementType="O"
                        id="a33"
                        x3="0.0497"
                        y3="2.0051"
                        z3="7.1881"/>
                  <atom elementType="Mo"
                        id="a34"
                        x3="2.2651"
                        y3="1.0826"
                        z3="2.0651"/>
                  <atom elementType="H"
                        id="a35"
                        x3="0.0519"
                        y3="5.7839"
                        z3="-0.4408"/>
                  <atom elementType="H"
                        id="a36"
                        x3="2.9018"
                        y3="3.6142"
                        z3="5.6346"/>
                  <atom elementType="O"
                        id="a37"
                        x3="0.6134"
                        y3="3.5730"
                        z3="-7.0562"/>
                  <atom elementType="H"
                        id="a38"
                        x3="2.2870"
                        y3="3.5980"
                        z3="-3.7064"/>
                  <atom elementType="O"
                        id="a39"
                        x3="-1.7734"
                        y3="4.7420"
                        z3="3.7494"/>
                  <atom elementType="O"
                        id="a40"
                        x3="-1.0172"
                        y3="0.9512"
                        z3="0.3158"/>
                  <atom elementType="O"
                        id="a41"
                        x3="1.5032"
                        y3="4.1532"
                        z3="-0.4613"/>
                  <atom elementType="O"
                        id="a42"
                        x3="0.4392"
                        y3="2.2469"
                        z3="-2.0538"/>
                  <atom elementType="H"
                        id="a43"
                        x3="-1.1616"
                        y3="0.5555"
                        z3="-2.3728"/>
                  <atom elementType="O"
                        id="a44"
                        x3="-0.7190"
                        y3="2.6014"
                        z3="-4.7020"/>
                  <atom elementType="H"
                        id="a45"
                        x3="3.5100"
                        y3="2.5343"
                        z3="0.4471"/>
                  <atom elementType="Mo"
                        id="a46"
                        x3="-0.4376"
                        y3="3.8737"
                        z3="3.0381"/>
                  <atom elementType="H"
                        id="a47"
                        x3="0.8852"
                        y3="4.3437"
                        z3="-3.8201"/>
                  <atom elementType="O"
                        id="a48"
                        x3="1.9431"
                        y3="-1.6587"
                        z3="-0.0264"/>
                  <atom elementType="O"
                        id="a49"
                        x3="-3.1546"
                        y3="3.4414"
                        z3="-3.3926"/>
                  <atom elementType="O"
                        id="a50"
                        x3="-1.9433"
                        y3="1.0903"
                        z3="-2.6904"/>
                  <atom elementType="O"
                        id="a51"
                        x3="-0.5444"
                        y3="4.7223"
                        z3="-3.1857"/>
                  <atom elementType="O"
                        id="a52"
                        x3="-1.4242"
                        y3="3.4029"
                        z3="-1.0661"/>
                  <atom elementType="O"
                        id="a53"
                        x3="-3.4944"
                        y3="5.8859"
                        z3="-1.2658"/>
                  <atom elementType="O"
                        id="a54"
                        x3="-3.4198"
                        y3="4.0461"
                        z3="0.8608"/>
                  <atom elementType="H"
                        id="a55"
                        x3="3.2735"
                        y3="0.9607"
                        z3="5.8000"/>
                  <atom elementType="H"
                        id="a56"
                        x3="3.0119"
                        y3="-0.9881"
                        z3="1.0104"/>
                  <atom elementType="H"
                        id="a57"
                        x3="2.5604"
                        y3="-1.0840"
                        z3="-1.1654"/>
                  <atom elementType="H"
                        id="a58"
                        x3="1.7876"
                        y3="-2.6165"
                        z3="-0.1380"/>
                  <atom elementType="O"
                        id="a59"
                        x3="1.9408"
                        y3="3.7835"
                        z3="5.6842"/>
                  <atom elementType="O"
                        id="a60"
                        x3="1.6919"
                        y3="4.0293"
                        z3="-4.3633"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a31" order="S"/>
                  <bond atomRefs2="a1 a19" order="S"/>
                  <bond atomRefs2="a1 a12" order="S"/>
                  <bond atomRefs2="a1 a7" order="S"/>
                  <bond atomRefs2="a1 a42" order="S"/>
                  <bond atomRefs2="a2 a5" order="S"/>
                  <bond atomRefs2="a2 a40" order="S"/>
                  <bond atomRefs2="a2 a14" order="S"/>
                  <bond atomRefs2="a2 a48" order="S"/>
                  <bond atomRefs2="a2 a17" order="S"/>
                  <bond atomRefs2="a3 a51" order="S"/>
                  <bond atomRefs2="a4 a46" order="S"/>
                  <bond atomRefs2="a4 a16" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a6 a33" order="S"/>
                  <bond atomRefs2="a6 a20" order="S"/>
                  <bond atomRefs2="a6 a10" order="S"/>
                  <bond atomRefs2="a8 a55" order="S"/>
                  <bond atomRefs2="a9 a15" order="S"/>
                  <bond atomRefs2="a10 a46" order="S"/>
                  <bond atomRefs2="a11 a45" order="S"/>
                  <bond atomRefs2="a11 a34" order="S"/>
                  <bond atomRefs2="a12 a16" order="S"/>
                  <bond atomRefs2="a13 a35" order="S"/>
                  <bond atomRefs2="a13 a24" order="S"/>
                  <bond atomRefs2="a15 a37" order="S"/>
                  <bond atomRefs2="a15 a28" order="S"/>
                  <bond atomRefs2="a15 a44" order="S"/>
                  <bond atomRefs2="a16 a42" order="S"/>
                  <bond atomRefs2="a16 a52" order="S"/>
                  <bond atomRefs2="a16 a41" order="S"/>
                  <bond atomRefs2="a16 a26" order="S"/>
                  <bond atomRefs2="a17 a34" order="S"/>
                  <bond atomRefs2="a18 a46" order="S"/>
                  <bond atomRefs2="a21 a29" order="S"/>
                  <bond atomRefs2="a21 a30" order="S"/>
                  <bond atomRefs2="a22 a52" order="S"/>
                  <bond atomRefs2="a22 a49" order="S"/>
                  <bond atomRefs2="a22 a51" order="S"/>
                  <bond atomRefs2="a22 a50" order="S"/>
                  <bond atomRefs2="a22 a44" order="S"/>
                  <bond atomRefs2="a22 a42" order="S"/>
                  <bond atomRefs2="a23 a34" order="S"/>
                  <bond atomRefs2="a24 a25" order="S"/>
                  <bond atomRefs2="a24 a54" order="S"/>
                  <bond atomRefs2="a24 a53" order="S"/>
                  <bond atomRefs2="a26 a34" order="S"/>
                  <bond atomRefs2="a26 a46" order="S"/>
                  <bond atomRefs2="a27 a59" order="S"/>
                  <bond atomRefs2="a31 a57" order="S"/>
                  <bond atomRefs2="a32 a56" order="S"/>
                  <bond atomRefs2="a32 a34" order="S"/>
                  <bond atomRefs2="a36 a59" order="S"/>
                  <bond atomRefs2="a38 a60" order="S"/>
                  <bond atomRefs2="a39 a46" order="S"/>
                  <bond atomRefs2="a43 a50" order="S"/>
                  <bond atomRefs2="a47 a60" order="S"/>
                  <bond atomRefs2="a48 a58" order="S"/>
               </bondArray>
               <formula concise="H14Mo9O37"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">1455.4377999999992</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:2.016,1.0805,-2.3749;.007,-.5311,.0353;-.5826,5.2585,-2.31;-.6909,4.2435,1.1448;-1.0049,-1.9078,.4183;.8811,1.5626,5.7188;3.2656,2.3122,-2.5046;2.6791,1.2757,6.513;2.7624,2.0831,-6.1063;-.1422,2.4629,4.3595;3.5668,2.4298,1.4203;1.6268,1.2803,-.2302;-.7461,6.0788,-.9246;.1647,-.4933,-1.7761;.8047,2.2927,-5.8827;.3475,2.8995,-.1486;.9074,-.1748,1.8944;.9663,4.8788,3.4478;1.4987,.8626,-4.0851;.3875,-.0894,5.4275;-2.2081,2.295,2.4031;-1.5347,2.9817,-2.9769;2.4666,1.294,3.8069;-2.4796,5.3953,.096;-2.591,6.7194,1.2643;.8337,2.4792,1.7437;1.7047,4.2567,4.8317;.2048,.87,-6.7126;-2.7227,2.9448,1.802;-1.7898,1.682,1.7395;2.9891,-.4808,-1.9468;3.5296,-.2922,1.5403;.0497,2.0051,7.1881;2.2651,1.0826,2.0651;.0519,5.7839,-.4408;2.9018,3.6142,5.6346;.6134,3.573,-7.0562;2.287,3.598,-3.7064;-1.7734,4.742,3.7494;-1.0172,.9512,.3158;1.5032,4.1532,-.4613;.4392,2.2469,-2.0538;-1.1616,.5555,-2.3728;-.719,2.6014,-4.702;3.51,2.5343,.4471;-.4376,3.8737,3.0381;.8852,4.3437,-3.8201;1.9431,-1.6587,-.0264;-3.1546,3.4414,-3.3926;-1.9433,1.0903,-2.6904;-.5444,4.7223,-3.1857;-1.4242,3.4029,-1.0661;-3.4944,5.8859,-1.2658;-3.4198,4.0461,.8608;3.2735,.9607,5.8;3.0119,-.9881,1.0104;2.5604,-1.084,-1.1654;1.7876,-2.6165,-.138;1.9408,3.7835,5.6842;1.6919,4.0293,-4.3633;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="parameters" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="scf" endLine="231" startLine="229">
                     <scalar dataType="xsd:string" dictRef="cc:functional">PW92                                    == Not Default ==</scalar>
                  </list>
                  <list cmlx:templateRef="spin" endLine="235" startLine="233">
                     <scalar dataType="xsd:string" dictRef="cc:spinMolecule">Restricted</scalar>
                     <scalar dataType="xsd:string" dictRef="cc:spinFragments">Restricted</scalar>
                  </list>
                  <list cmlx:templateRef="other" endLine="244" startLine="237">
                     <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 cmlx:templateRef="solvation" dictRef="cc:userDefinedModule">
                  <list id="cosmo">
                     <scalar dataType="xsd:integer" dictRef="a:ndiv">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:nfdiv">1</scalar>
                     <scalar dataType="xsd:double" dictRef="a:rsol" units="nonsi:angstrom">1.93000</scalar>
                     <scalar dataType="xsd:double" dictRef="a:epsl">78.39000</scalar>
                     <scalar dataType="xsd:string" dictRef="a:cosmomethod">conjugate-gradient</scalar>
                     <scalar dataType="xsd:double" dictRef="a:ncix">1000</scalar>
                     <scalar dataType="xsd:double" dictRef="a:ccnv">1.0E-08</scalar>
                     <scalar dataType="xsd:double" dictRef="a:gdsf">0.00000</scalar>
                  </list>
               </module>
               <module cmlx:templateRef="fragment.files" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="atom">
                     <list cmlx:templateRef="elementType">
                        <atom elementType="Mo" id="a1">
                           <scalar dataType="xsd:string" dictRef="a:file">t21.Mo</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2019</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:runtime">Jul07-2020 12:51:46</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:nodes">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:processors">1</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:elementName">Molybdenum</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:contraction">4p</scalar>
                        </atom>
                     </list>
                  </module>
                  <module cmlx:templateRef="atom">
                     <list cmlx:templateRef="elementType">
                        <atom elementType="H" id="a1">
                           <scalar dataType="xsd:string" dictRef="a:file">t21.H</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2019</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:runtime">Jul07-2020 12:51:43</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:nodes">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:processors">1</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:elementName">Hydrogen</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
                        </atom>
                     </list>
                  </module>
                  <module cmlx:templateRef="atom">
                     <list cmlx:templateRef="elementType">
                        <atom elementType="O" id="a1">
                           <scalar dataType="xsd:string" dictRef="a:file">t21.O</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:jobname">ADF 2019</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:runtime">Jul07-2020 12:51:48</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:nodes">1</scalar>
                           <scalar dataType="xsd:integer" dictRef="cc:processors">1</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:elementName">Oxygen</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:basis">TZP</scalar>
                           <scalar dataType="xsd:string" dictRef="cc:contraction">1s</scalar>
                        </atom>
                     </list>
                  </module>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation">
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">1</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">1</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.86763446</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.20107564</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01947606</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.20107564</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01947606</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.11052440</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.02139398</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="2.016387"
                                 y3="1.08867"
                                 z3="-2.37591"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.008382"
                                 y3="-0.527026"
                                 z3="0.035484"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.604813"
                                 y3="5.271076"
                                 z3="-2.299771"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.694199"
                                 y3="4.244375"
                                 z3="1.154898"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-1.003462"
                                 y3="-1.907182"
                                 z3="0.417376"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.876516"
                                 y3="1.556557"
                                 z3="5.721004"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.268236"
                                 y3="2.326388"
                                 z3="-2.50129"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.675816"
                                 y3="1.277969"
                                 z3="6.515915"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.699179"
                                 y3="2.039528"
                                 z3="-6.146432"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.149124"
                                 y3="2.45404"
                                 z3="4.363242"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.564818"
                                 y3="2.434383"
                                 z3="1.42289"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.626252"
                                 y3="1.285961"
                                 z3="-0.226274"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.749704"
                                 y3="6.112458"
                                 z3="-0.873532"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.166245"
                                 y3="-0.48888"
                                 z3="-1.774048"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.823864"
                                 y3="2.274022"
                                 z3="-5.91166"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.346895"
                                 y3="2.904258"
                                 z3="-0.14416"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.908088"
                                 y3="-0.17342"
                                 z3="1.896397"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.958365"
                                 y3="4.875283"
                                 z3="3.463217"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.505854"
                                 y3="0.867545"
                                 z3="-4.075051"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.390294"
                                 y3="-0.098152"
                                 z3="5.430515"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.206456"
                                 y3="2.289162"
                                 z3="2.393265"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.528035"
                                 y3="2.989464"
                                 z3="-2.9786"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.464846"
                                 y3="1.295178"
                                 z3="3.811302"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.487399"
                                 y3="5.392629"
                                 z3="0.112552"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.615742"
                                 y3="6.701594"
                                 z3="1.297778"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.831835"
                                 y3="2.480676"
                                 z3="1.749861"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.6828"
                                 y3="4.253869"
                                 z3="4.831646"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.161929"
                                 y3="0.830442"
                                 z3="-6.70871"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.71743"
                                 y3="2.942309"
                                 z3="1.79229"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.780721"
                                 y3="1.682611"
                                 z3="1.727571"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.99252"
                                 y3="-0.478802"
                                 z3="-1.947325"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.530412"
                                 y3="-0.28731"
                                 z3="1.539701"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.043129"
                                 y3="1.995595"
                                 z3="7.19097"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.264018"
                                 y3="1.085529"
                                 z3="2.067465"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.044686"
                                 y3="5.808002"
                                 z3="-0.389707"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.885551"
                                 y3="3.618795"
                                 z3="5.632623"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.535515"
                                 y3="3.565413"
                                 z3="-7.09498"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.380177"
                                 y3="3.556999"
                                 z3="-3.80266"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.783308"
                                 y3="4.732194"
                                 z3="3.757263"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.01728"
                                 y3="0.953768"
                                 z3="0.318687"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.502152"
                                 y3="4.162009"
                                 z3="-0.450408"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.440138"
                                 y3="2.256669"
                                 z3="-2.047774"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.158823"
                                 y3="0.569089"
                                 z3="-2.357061"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.699956"
                                 y3="2.605274"
                                 z3="-4.68272"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.502322"
                                 y3="2.538774"
                                 z3="0.449751"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.443361"
                                 y3="3.869006"
                                 z3="3.044764"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.995685"
                                 y3="4.334386"
                                 z3="-3.857699"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.945226"
                                 y3="-1.654739"
                                 z3="-0.024866"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.153229"
                                 y3="3.446054"
                                 z3="-3.40002"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-1.940148"
                                 y3="1.096508"
                                 z3="-2.683217"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.552166"
                                 y3="4.741968"
                                 z3="-3.175727"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.422587"
                                 y3="3.411077"
                                 z3="-1.061459"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.498429"
                                 y3="5.895274"
                                 z3="-1.248171"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.424554"
                                 y3="4.02986"
                                 z3="0.858406"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.271409"
                                 y3="0.967456"
                                 z3="5.801987"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.013135"
                                 y3="-0.978728"
                                 z3="1.003168"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.563866"
                                 y3="-1.078153"
                                 z3="-1.16604"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.788707"
                                 y3="-2.612197"
                                 z3="-0.136624"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.923914"
                                 y3="3.783189"
                                 z3="5.684653"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.775468"
                                 y3="4.0153"
                                 z3="-4.430549"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:2.0164,1.0887,-2.3759;.0084,-.527,.0355;-.6048,5.2711,-2.2998;-.6942,4.2444,1.1549;-1.0035,-1.9072,.4174;.8765,1.5566,5.721;3.2682,2.3264,-2.5013;2.6758,1.278,6.5159;2.6992,2.0395,-6.1464;-.1491,2.454,4.3632;3.5648,2.4344,1.4229;1.6263,1.286,-.2263;-.7497,6.1125,-.8735;.1662,-.4889,-1.774;.8239,2.274,-5.9117;.3469,2.9043,-.1442;.9081,-.1734,1.8964;.9584,4.8753,3.4632;1.5059,.8675,-4.0751;.3903,-.0982,5.4305;-2.2065,2.2892,2.3933;-1.528,2.9895,-2.9786;2.4648,1.2952,3.8113;-2.4874,5.3926,.1126;-2.6157,6.7016,1.2978;.8318,2.4807,1.7499;1.6828,4.2539,4.8316;.1619,.8304,-6.7087;-2.7174,2.9423,1.7923;-1.7807,1.6826,1.7276;2.9925,-.4788,-1.9473;3.5304,-.2873,1.5397;.0431,1.9956,7.191;2.264,1.0855,2.0675;.0447,5.808,-.3897;2.8856,3.6188,5.6326;.5355,3.5654,-7.095;2.3802,3.557,-3.8027;-1.7833,4.7322,3.7573;-1.0173,.9538,.3187;1.5022,4.162,-.4504;.4401,2.2567,-2.0478;-1.1588,.5691,-2.3571;-.7,2.6053,-4.6827;3.5023,2.5388,.4498;-.4434,3.869,3.0448;.9957,4.3344,-3.8577;1.9452,-1.6547,-.0249;-3.1532,3.4461,-3.4;-1.9401,1.0965,-2.6832;-.5522,4.742,-3.1757;-1.4226,3.4111,-1.0615;-3.4984,5.8953,-1.2482;-3.4246,4.0299,.8584;3.2714,.9675,5.802;3.0131,-.9787,1.0032;2.5639,-1.0782,-1.166;1.7887,-2.6122,-.1366;1.9239,3.7832,5.6847;1.7755,4.0153,-4.4305;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">2</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">2</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.88068606</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.13318059</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01418406</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.13318059</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01418406</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.29388586</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.05000854</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="2.031788"
                                 y3="1.070544"
                                 z3="-2.38605"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.015667"
                                 y3="-0.528055"
                                 z3="0.037796"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.464926"
                                 y3="5.22229"
                                 z3="-2.342498"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.676071"
                                 y3="4.254445"
                                 z3="1.136476"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-1.000472"
                                 y3="-1.907616"
                                 z3="0.426541"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.866703"
                                 y3="1.562501"
                                 z3="5.71048"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.291933"
                                 y3="2.313485"
                                 z3="-2.508589"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.657298"
                                 y3="1.258232"
                                 z3="6.517482"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.613954"
                                 y3="2.198239"
                                 z3="-6.052372"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.142015"
                                 y3="2.471407"
                                 z3="4.349682"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.575299"
                                 y3="2.429595"
                                 z3="1.412228"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.636639"
                                 y3="1.278578"
                                 z3="-0.226329"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.731185"
                                 y3="6.127406"
                                 z3="-0.900329"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.177948"
                                 y3="-0.505008"
                                 z3="-1.768034"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.910932"
                                 y3="2.29299"
                                 z3="-5.932616"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.364958"
                                 y3="2.902408"
                                 z3="-0.161357"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.910825"
                                 y3="-0.168675"
                                 z3="1.90211"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.97092"
                                 y3="4.894008"
                                 z3="3.442689"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.542754"
                                 y3="0.853784"
                                 z3="-4.063583"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.366096"
                                 y3="-0.085656"
                                 z3="5.402772"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.187664"
                                 y3="2.290193"
                                 z3="2.389691"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.495801"
                                 y3="2.985204"
                                 z3="-3.010607"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.466333"
                                 y3="1.305081"
                                 z3="3.812049"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.462621"
                                 y3="5.403309"
                                 z3="0.085075"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.59589"
                                 y3="6.711366"
                                 z3="1.273746"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.843144"
                                 y3="2.486731"
                                 z3="1.742016"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.71831"
                                 y3="4.259053"
                                 z3="4.863456"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.308137"
                                 y3="0.81598"
                                 z3="-6.791643"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.70653"
                                 y3="2.934993"
                                 z3="1.783903"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.756709"
                                 y3="1.682763"
                                 z3="1.72608"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="3.008474"
                                 y3="-0.510098"
                                 z3="-1.948391"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.531535"
                                 y3="-0.292501"
                                 z3="1.547939"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.02391"
                                 y3="1.998493"
                                 z3="7.177311"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.267857"
                                 y3="1.089263"
                                 z3="2.065606"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.06219"
                                 y3="5.770823"
                                 z3="-0.452742"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.901069"
                                 y3="3.598901"
                                 z3="5.67692"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.452621"
                                 y3="3.619982"
                                 z3="-7.08577"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.086291"
                                 y3="3.529002"
                                 z3="-3.617606"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.772863"
                                 y3="4.750246"
                                 z3="3.731691"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.007287"
                                 y3="0.955979"
                                 z3="0.313323"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.525655"
                                 y3="4.158714"
                                 z3="-0.461919"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.456531"
                                 y3="2.244821"
                                 z3="-2.056228"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.195617"
                                 y3="0.57056"
                                 z3="-2.342271"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.680279"
                                 y3="2.595732"
                                 z3="-4.667245"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.500692"
                                 y3="2.526711"
                                 z3="0.438752"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.430838"
                                 y3="3.884295"
                                 z3="3.022802"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.707478"
                                 y3="4.260681"
                                 z3="-3.805745"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.95078"
                                 y3="-1.662441"
                                 z3="-0.011107"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.124912"
                                 y3="3.458953"
                                 z3="-3.438915"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-1.967995"
                                 y3="1.103317"
                                 z3="-2.670908"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.460636"
                                 y3="4.712816"
                                 z3="-3.218296"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.391231"
                                 y3="3.421149"
                                 z3="-1.080476"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.47236"
                                 y3="5.914003"
                                 z3="-1.274788"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.410951"
                                 y3="4.045258"
                                 z3="0.828972"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.253651"
                                 y3="0.951101"
                                 z3="5.802763"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.010448"
                                 y3="-0.983268"
                                 z3="1.012991"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.57701"
                                 y3="-1.091819"
                                 z3="-1.163176"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.789249"
                                 y3="-2.619741"
                                 z3="-0.114855"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.941272"
                                 y3="3.775962"
                                 z3="5.716871"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.562206"
                                 y3="4.037582"
                                 z3="-4.28157"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:2.0318,1.0705,-2.3861;.0157,-.5281,.0378;-.4649,5.2223,-2.3425;-.6761,4.2544,1.1365;-1.0005,-1.9076,.4265;.8667,1.5625,5.7105;3.2919,2.3135,-2.5086;2.6573,1.2582,6.5175;2.614,2.1982,-6.0524;-.142,2.4714,4.3497;3.5753,2.4296,1.4122;1.6366,1.2786,-.2263;-.7312,6.1274,-.9003;.1779,-.505,-1.768;.9109,2.293,-5.9326;.365,2.9024,-.1614;.9108,-.1687,1.9021;.9709,4.894,3.4427;1.5428,.8538,-4.0636;.3661,-.0857,5.4028;-2.1877,2.2902,2.3897;-1.4958,2.9852,-3.0106;2.4663,1.3051,3.812;-2.4626,5.4033,.0851;-2.5959,6.7114,1.2737;.8431,2.4867,1.742;1.7183,4.2591,4.8635;.3081,.816,-6.7916;-2.7065,2.935,1.7839;-1.7567,1.6828,1.7261;3.0085,-.5101,-1.9484;3.5315,-.2925,1.5479;.0239,1.9985,7.1773;2.2679,1.0893,2.0656;.0622,5.7708,-.4527;2.9011,3.5989,5.6769;.4526,3.62,-7.0858;2.0863,3.529,-3.6176;-1.7729,4.7502,3.7317;-1.0073,.956,.3133;1.5257,4.1587,-.4619;.4565,2.2448,-2.0562;-1.1956,.5706,-2.3423;-.6803,2.5957,-4.6672;3.5007,2.5267,.4388;-.4308,3.8843,3.0228;.7075,4.2607,-3.8057;1.9508,-1.6624,-.0111;-3.1249,3.459,-3.4389;-1.968,1.1033,-2.6709;-.4606,4.7128,-3.2183;-1.3912,3.4211,-1.0805;-3.4724,5.914,-1.2748;-3.411,4.0453,.829;3.2537,.9511,5.8028;3.0104,-.9833,1.013;2.577,-1.0918,-1.1632;1.7892,-2.6197,-.1149;1.9413,3.776,5.7169;1.5622,4.0376,-4.2816;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">3</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">3</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.87929132</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.10876135</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01576510</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.10876135</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01576510</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.27170941</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.04272201</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="2.019931"
                                 y3="1.077211"
                                 z3="-2.380045"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.011849"
                                 y3="-0.528938"
                                 z3="0.045814"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.529492"
                                 y3="5.237778"
                                 z3="-2.316765"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.692761"
                                 y3="4.2486"
                                 z3="1.154784"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.998405"
                                 y3="-1.910424"
                                 z3="0.433825"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.869872"
                                 y3="1.558076"
                                 z3="5.719871"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.273666"
                                 y3="2.316811"
                                 z3="-2.50438"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.666424"
                                 y3="1.264122"
                                 z3="6.518167"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.646532"
                                 y3="2.117625"
                                 z3="-6.163884"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.147477"
                                 y3="2.462343"
                                 z3="4.363871"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.565205"
                                 y3="2.437967"
                                 z3="1.418284"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.626912"
                                 y3="1.282707"
                                 z3="-0.218564"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.750198"
                                 y3="6.114111"
                                 z3="-0.878888"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.170457"
                                 y3="-0.502205"
                                 z3="-1.760856"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.895223"
                                 y3="2.277149"
                                 z3="-5.958777"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.349695"
                                 y3="2.902825"
                                 z3="-0.147997"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.909429"
                                 y3="-0.169638"
                                 z3="1.908863"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.955494"
                                 y3="4.888743"
                                 z3="3.460423"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.514578"
                                 y3="0.860264"
                                 z3="-4.067061"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.379217"
                                 y3="-0.094015"
                                 z3="5.419357"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.197413"
                                 y3="2.279921"
                                 z3="2.40648"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.516627"
                                 y3="2.985412"
                                 z3="-2.995565"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.463479"
                                 y3="1.307312"
                                 z3="3.816304"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.483548"
                                 y3="5.392379"
                                 z3="0.106536"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.61932"
                                 y3="6.698358"
                                 z3="1.296181"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.833248"
                                 y3="2.485082"
                                 z3="1.753301"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.698364"
                                 y3="4.255741"
                                 z3="4.859459"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.173104"
                                 y3="0.837617"
                                 z3="-6.751201"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.71773"
                                 y3="2.92489"
                                 z3="1.803648"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.767289"
                                 y3="1.674712"
                                 z3="1.740918"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.998869"
                                 y3="-0.498714"
                                 z3="-1.947572"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.530439"
                                 y3="-0.284276"
                                 z3="1.550521"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.032417"
                                 y3="1.991465"
                                 z3="7.190097"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.262966"
                                 y3="1.092388"
                                 z3="2.071903"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.042456"
                                 y3="5.757764"
                                 z3="-0.428686"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.890751"
                                 y3="3.60822"
                                 z3="5.666929"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.458379"
                                 y3="3.592526"
                                 z3="-7.101215"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.32053"
                                 y3="3.546649"
                                 z3="-3.802087"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.785704"
                                 y3="4.73627"
                                 z3="3.752915"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.014692"
                                 y3="0.950981"
                                 z3="0.325537"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.504571"
                                 y3="4.163545"
                                 z3="-0.448331"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.440285"
                                 y3="2.248867"
                                 z3="-2.044434"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.207913"
                                 y3="0.569737"
                                 z3="-2.336335"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.676367"
                                 y3="2.596763"
                                 z3="-4.648825"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.489281"
                                 y3="2.536799"
                                 z3="0.445344"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.442961"
                                 y3="3.876473"
                                 z3="3.039861"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.979187"
                                 y3="4.370577"
                                 z3="-3.9041"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.949522"
                                 y3="-1.657669"
                                 z3="-0.008549"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.141889"
                                 y3="3.453838"
                                 z3="-3.422628"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-1.981877"
                                 y3="1.100391"
                                 z3="-2.665644"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.513225"
                                 y3="4.72924"
                                 z3="-3.194081"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.408845"
                                 y3="3.417241"
                                 z3="-1.062601"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.495795"
                                 y3="5.900604"
                                 z3="-1.252167"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.425068"
                                 y3="4.029848"
                                 z3="0.850965"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.260896"
                                 y3="0.959168"
                                 z3="5.800818"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.011512"
                                 y3="-0.976941"
                                 z3="1.015618"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.571174"
                                 y3="-1.082629"
                                 z3="-1.16177"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.790384"
                                 y3="-2.615378"
                                 z3="-0.113477"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.929822"
                                 y3="3.778902"
                                 z3="5.712236"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.772182"
                                 y3="4.048863"
                                 z3="-4.448151"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:2.0199,1.0772,-2.38;.0118,-.5289,.0458;-.5295,5.2378,-2.3168;-.6928,4.2486,1.1548;-.9984,-1.9104,.4338;.8699,1.5581,5.7199;3.2737,2.3168,-2.5044;2.6664,1.2641,6.5182;2.6465,2.1176,-6.1639;-.1475,2.4623,4.3639;3.5652,2.438,1.4183;1.6269,1.2827,-.2186;-.7502,6.1141,-.8789;.1705,-.5022,-1.7609;.8952,2.2771,-5.9588;.3497,2.9028,-.148;.9094,-.1696,1.9089;.9555,4.8887,3.4604;1.5146,.8603,-4.0671;.3792,-.094,5.4194;-2.1974,2.2799,2.4065;-1.5166,2.9854,-2.9956;2.4635,1.3073,3.8163;-2.4835,5.3924,.1065;-2.6193,6.6984,1.2962;.8332,2.4851,1.7533;1.6984,4.2557,4.8595;.1731,.8376,-6.7512;-2.7177,2.9249,1.8036;-1.7673,1.6747,1.7409;2.9989,-.4987,-1.9476;3.5304,-.2843,1.5505;.0324,1.9915,7.1901;2.263,1.0924,2.0719;.0425,5.7578,-.4287;2.8908,3.6082,5.6669;.4584,3.5925,-7.1012;2.3205,3.5466,-3.8021;-1.7857,4.7363,3.7529;-1.0147,.951,.3255;1.5046,4.1635,-.4483;.4403,2.2489,-2.0444;-1.2079,.5697,-2.3363;-.6764,2.5968,-4.6488;3.4893,2.5368,.4453;-.443,3.8765,3.0399;.9792,4.3706,-3.9041;1.9495,-1.6577,-.0085;-3.1419,3.4538,-3.4226;-1.9819,1.1004,-2.6656;-.5132,4.7292,-3.1941;-1.4088,3.4172,-1.0626;-3.4958,5.9006,-1.2522;-3.4251,4.0298,.851;3.2609,.9592,5.8008;3.0115,-.9769,1.0156;2.5712,-1.0826,-1.1618;1.7904,-2.6154,-.1135;1.9298,3.7789,5.7122;1.7722,4.0489,-4.4482;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">4</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">4</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89189320</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.04116038</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00634127</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.04116038</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00634127</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.09831620</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01844804</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="2.014305"
                                 y3="1.069968"
                                 z3="-2.384092"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.008496"
                                 y3="-0.535275"
                                 z3="0.04443"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.627808"
                                 y3="5.273605"
                                 z3="-2.31462"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.6887"
                                 y3="4.243352"
                                 z3="1.155988"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-1.002215"
                                 y3="-1.9157"
                                 z3="0.433657"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.879496"
                                 y3="1.564409"
                                 z3="5.719159"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.268199"
                                 y3="2.306576"
                                 z3="-2.509821"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.683695"
                                 y3="1.296299"
                                 z3="6.51008"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.671037"
                                 y3="2.12057"
                                 z3="-6.164985"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.150079"
                                 y3="2.453351"
                                 z3="4.363534"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.565508"
                                 y3="2.428535"
                                 z3="1.412477"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.624767"
                                 y3="1.274738"
                                 z3="-0.221446"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.723385"
                                 y3="6.108307"
                                 z3="-0.853335"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.163945"
                                 y3="-0.507553"
                                 z3="-1.763006"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.903442"
                                 y3="2.296237"
                                 z3="-5.955139"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.349225"
                                 y3="2.89617"
                                 z3="-0.150124"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.908081"
                                 y3="-0.176919"
                                 z3="1.906937"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.961534"
                                 y3="4.872848"
                                 z3="3.466558"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.505074"
                                 y3="0.853244"
                                 z3="-4.073802"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.400312"
                                 y3="-0.095206"
                                 z3="5.442585"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.210438"
                                 y3="2.295948"
                                 z3="2.390229"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.515194"
                                 y3="2.980452"
                                 z3="-3.000953"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.465914"
                                 y3="1.302172"
                                 z3="3.811744"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.473921"
                                 y3="5.389577"
                                 z3="0.103462"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.612351"
                                 y3="6.695481"
                                 z3="1.292906"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.832528"
                                 y3="2.477291"
                                 z3="1.751545"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.662996"
                                 y3="4.257887"
                                 z3="4.810001"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.205309"
                                 y3="0.865431"
                                 z3="-6.768262"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.718515"
                                 y3="2.951349"
                                 z3="1.789055"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.784836"
                                 y3="1.690215"
                                 z3="1.722428"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.991593"
                                 y3="-0.505782"
                                 z3="-1.954447"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.528798"
                                 y3="-0.293348"
                                 z3="1.546905"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.0504"
                                 y3="2.008203"
                                 z3="7.191048"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.26237"
                                 y3="1.084454"
                                 z3="2.068319"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.06065"
                                 y3="5.768628"
                                 z3="-0.37567"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.875631"
                                 y3="3.636292"
                                 z3="5.606578"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.487352"
                                 y3="3.632734"
                                 z3="-7.066957"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.325963"
                                 y3="3.523438"
                                 z3="-3.759328"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.780818"
                                 y3="4.731325"
                                 z3="3.754951"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.016735"
                                 y3="0.945303"
                                 z3="0.325057"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.504571"
                                 y3="4.156689"
                                 z3="-0.450329"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.439925"
                                 y3="2.243754"
                                 z3="-2.047068"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.188725"
                                 y3="0.570458"
                                 z3="-2.332674"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.675043"
                                 y3="2.604435"
                                 z3="-4.649486"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.488551"
                                 y3="2.527213"
                                 z3="0.43971"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.440886"
                                 y3="3.869048"
                                 z3="3.039831"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.959538"
                                 y3="4.313929"
                                 z3="-3.832513"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.945493"
                                 y3="-1.664908"
                                 z3="-0.01167"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.141946"
                                 y3="3.442543"
                                 z3="-3.427093"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-1.966791"
                                 y3="1.091759"
                                 z3="-2.666605"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.542797"
                                 y3="4.747334"
                                 z3="-3.177517"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.405699"
                                 y3="3.411157"
                                 z3="-1.064332"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.477985"
                                 y3="5.900416"
                                 z3="-1.260365"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.417488"
                                 y3="4.028343"
                                 z3="0.848012"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.276934"
                                 y3="0.989911"
                                 z3="5.792354"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.008627"
                                 y3="-0.988403"
                                 z3="1.016352"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.565315"
                                 y3="-1.089209"
                                 z3="-1.167398"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.785603"
                                 y3="-2.622591"
                                 z3="-0.115685"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.913711"
                                 y3="3.797003"
                                 z3="5.665522"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.761169"
                                 y3="4.03056"
                                 z3="-4.388497"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:2.0143,1.07,-2.3841;.0085,-.5353,.0444;-.6278,5.2736,-2.3146;-.6887,4.2434,1.156;-1.0022,-1.9157,.4337;.8795,1.5644,5.7192;3.2682,2.3066,-2.5098;2.6837,1.2963,6.5101;2.671,2.1206,-6.165;-.1501,2.4534,4.3635;3.5655,2.4285,1.4125;1.6248,1.2747,-.2214;-.7234,6.1083,-.8533;.1639,-.5076,-1.763;.9034,2.2962,-5.9551;.3492,2.8962,-.1501;.9081,-.1769,1.9069;.9615,4.8728,3.4666;1.5051,.8532,-4.0738;.4003,-.0952,5.4426;-2.2104,2.2959,2.3902;-1.5152,2.9805,-3.001;2.4659,1.3022,3.8117;-2.4739,5.3896,.1035;-2.6124,6.6955,1.2929;.8325,2.4773,1.7515;1.663,4.2579,4.81;.2053,.8654,-6.7683;-2.7185,2.9513,1.7891;-1.7848,1.6902,1.7224;2.9916,-.5058,-1.9544;3.5288,-.2933,1.5469;.0504,2.0082,7.191;2.2624,1.0845,2.0683;.0607,5.7686,-.3757;2.8756,3.6363,5.6066;.4874,3.6327,-7.067;2.326,3.5234,-3.7593;-1.7808,4.7313,3.755;-1.0167,.9453,.3251;1.5046,4.1567,-.4503;.4399,2.2438,-2.0471;-1.1887,.5705,-2.3327;-.675,2.6044,-4.6495;3.4886,2.5272,.4397;-.4409,3.869,3.0398;.9595,4.3139,-3.8325;1.9455,-1.6649,-.0117;-3.1419,3.4425,-3.4271;-1.9668,1.0918,-2.6666;-.5428,4.7473,-3.1775;-1.4057,3.4112,-1.0643;-3.478,5.9004,-1.2604;-3.4175,4.0283,.848;3.2769,.9899,5.7924;3.0086,-.9884,1.0164;2.5653,-1.0892,-1.1674;1.7856,-2.6226,-.1157;1.9137,3.797,5.6655;1.7612,4.0306,-4.3885;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">5</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">5</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89314161</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.03648713</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00502698</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.03648713</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00502698</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.05778996</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01500275</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="2.00497"
                                 y3="1.058179"
                                 z3="-2.388636"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.002488"
                                 y3="-0.535955"
                                 z3="0.051374"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.587265"
                                 y3="5.258206"
                                 z3="-2.304367"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.691562"
                                 y3="4.247783"
                                 z3="1.147623"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-1.008189"
                                 y3="-1.914223"
                                 z3="0.448156"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.884287"
                                 y3="1.572266"
                                 z3="5.716967"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.25993"
                                 y3="2.291006"
                                 z3="-2.518025"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.684164"
                                 y3="1.27845"
                                 z3="6.51014"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.697515"
                                 y3="2.118331"
                                 z3="-6.17958"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.138104"
                                 y3="2.471521"
                                 z3="4.361823"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.564301"
                                 y3="2.429615"
                                 z3="1.402294"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.619648"
                                 y3="1.270911"
                                 z3="-0.223103"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.767846"
                                 y3="6.130744"
                                 z3="-0.868986"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.153854"
                                 y3="-0.515181"
                                 z3="-1.756981"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.925325"
                                 y3="2.311327"
                                 z3="-5.964442"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.346139"
                                 y3="2.894601"
                                 z3="-0.15847"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.904859"
                                 y3="-0.171917"
                                 z3="1.911958"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.965389"
                                 y3="4.891787"
                                 z3="3.443133"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.489511"
                                 y3="0.841078"
                                 z3="-4.079083"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.386845"
                                 y3="-0.07966"
                                 z3="5.425302"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.205834"
                                 y3="2.301262"
                                 z3="2.396085"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.510386"
                                 y3="2.978127"
                                 z3="-3.018199"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.467906"
                                 y3="1.311282"
                                 z3="3.808332"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.493022"
                                 y3="5.37283"
                                 z3="0.098307"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.648381"
                                 y3="6.674338"
                                 z3="1.290531"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.830709"
                                 y3="2.482615"
                                 z3="1.74663"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.720786"
                                 y3="4.265693"
                                 z3="4.847869"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.233341"
                                 y3="0.883142"
                                 z3="-6.774247"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.714133"
                                 y3="2.95056"
                                 z3="1.787429"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.779637"
                                 y3="1.689312"
                                 z3="1.734748"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.98002"
                                 y3="-0.517451"
                                 z3="-1.957411"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.52469"
                                 y3="-0.290739"
                                 z3="1.546987"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.055684"
                                 y3="2.013804"
                                 z3="7.189995"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.259352"
                                 y3="1.089842"
                                 z3="2.065533"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.027789"
                                 y3="5.795604"
                                 z3="-0.408343"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.912715"
                                 y3="3.613655"
                                 z3="5.653147"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.513049"
                                 y3="3.658356"
                                 z3="-7.052962"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.322091"
                                 y3="3.537046"
                                 z3="-3.732649"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.775076"
                                 y3="4.745152"
                                 z3="3.74712"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.021442"
                                 y3="0.946025"
                                 z3="0.32824"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.502698"
                                 y3="4.15353"
                                 z3="-0.461425"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.436356"
                                 y3="2.23426"
                                 z3="-2.052855"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.200695"
                                 y3="0.569256"
                                 z3="-2.337654"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.671241"
                                 y3="2.610448"
                                 z3="-4.650567"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.483597"
                                 y3="2.525246"
                                 z3="0.429612"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.43697"
                                 y3="3.881399"
                                 z3="3.030397"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.942461"
                                 y3="4.317711"
                                 z3="-3.816063"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.938553"
                                 y3="-1.667415"
                                 z3="-0.002046"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.135303"
                                 y3="3.447052"
                                 z3="-3.444468"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-1.977039"
                                 y3="1.091814"
                                 z3="-2.672288"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.527561"
                                 y3="4.746206"
                                 z3="-3.178063"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.40092"
                                 y3="3.409771"
                                 z3="-1.071828"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.513904"
                                 y3="5.86653"
                                 z3="-1.259488"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.410569"
                                 y3="3.995434"
                                 z3="0.845994"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.275499"
                                 y3="0.973575"
                                 z3="5.790283"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.003206"
                                 y3="-0.987121"
                                 z3="1.019466"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.556238"
                                 y3="-1.095007"
                                 z3="-1.165872"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.776631"
                                 y3="-2.625352"
                                 z3="-0.100377"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.952946"
                                 y3="3.789227"
                                 z3="5.701753"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.753244"
                                 y3="4.038161"
                                 z3="-4.364555"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:2.005,1.0582,-2.3886;.0025,-.536,.0514;-.5873,5.2582,-2.3044;-.6916,4.2478,1.1476;-1.0082,-1.9142,.4482;.8843,1.5723,5.717;3.2599,2.291,-2.518;2.6842,1.2785,6.5101;2.6975,2.1183,-6.1796;-.1381,2.4715,4.3618;3.5643,2.4296,1.4023;1.6196,1.2709,-.2231;-.7678,6.1307,-.869;.1539,-.5152,-1.757;.9253,2.3113,-5.9644;.3461,2.8946,-.1585;.9049,-.1719,1.912;.9654,4.8918,3.4431;1.4895,.8411,-4.0791;.3868,-.0797,5.4253;-2.2058,2.3013,2.3961;-1.5104,2.9781,-3.0182;2.4679,1.3113,3.8083;-2.493,5.3728,.0983;-2.6484,6.6743,1.2905;.8307,2.4826,1.7466;1.7208,4.2657,4.8479;.2333,.8831,-6.7742;-2.7141,2.9506,1.7874;-1.7796,1.6893,1.7347;2.98,-.5175,-1.9574;3.5247,-.2907,1.547;.0557,2.0138,7.19;2.2594,1.0898,2.0655;.0278,5.7956,-.4083;2.9127,3.6137,5.6531;.513,3.6584,-7.053;2.3221,3.537,-3.7326;-1.7751,4.7452,3.7471;-1.0214,.946,.3282;1.5027,4.1535,-.4614;.4364,2.2343,-2.0529;-1.2007,.5693,-2.3377;-.6712,2.6104,-4.6506;3.4836,2.5252,.4296;-.437,3.8814,3.0304;.9425,4.3177,-3.8161;1.9386,-1.6674,-.002;-3.1353,3.4471,-3.4445;-1.977,1.0918,-2.6723;-.5276,4.7462,-3.1781;-1.4009,3.4098,-1.0718;-3.5139,5.8665,-1.2595;-3.4106,3.9954,.846;3.2755,.9736,5.7903;3.0032,-.9871,1.0195;2.5562,-1.095,-1.1659;1.7766,-2.6254,-.1004;1.9529,3.7892,5.7018;1.7532,4.0382,-4.3646;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">6</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">6</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89475238</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.02764420</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00396302</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.02764420</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00396302</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.07559345</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01911852</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.991495"
                                 y3="1.046564"
                                 z3="-2.391661"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="-0.005231"
                                 y3="-0.545559"
                                 z3="0.057525"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.559942"
                                 y3="5.251516"
                                 z3="-2.292564"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.703102"
                                 y3="4.240642"
                                 z3="1.152021"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-1.013173"
                                 y3="-1.924858"
                                 z3="0.458893"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.897175"
                                 y3="1.583077"
                                 z3="5.72216"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.247677"
                                 y3="2.277157"
                                 z3="-2.519739"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.707107"
                                 y3="1.31357"
                                 z3="6.503891"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.716904"
                                 y3="2.135235"
                                 z3="-6.195366"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.139401"
                                 y3="2.464626"
                                 z3="4.369307"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.556064"
                                 y3="2.424623"
                                 z3="1.395364"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.609208"
                                 y3="1.260726"
                                 z3="-0.220878"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.732511"
                                 y3="6.113378"
                                 z3="-0.861154"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.142185"
                                 y3="-0.527546"
                                 z3="-1.7516"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.957275"
                                 y3="2.337115"
                                 z3="-5.974562"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.336024"
                                 y3="2.885443"
                                 z3="-0.160205"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.899295"
                                 y3="-0.178798"
                                 z3="1.91783"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.954639"
                                 y3="4.881708"
                                 z3="3.449352"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.469476"
                                 y3="0.83095"
                                 z3="-4.080849"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.410973"
                                 y3="-0.076907"
                                 z3="5.456681"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.187662"
                                 y3="2.247699"
                                 z3="2.430282"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.505836"
                                 y3="2.978165"
                                 z3="-3.036084"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.467231"
                                 y3="1.312841"
                                 z3="3.806627"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.480869"
                                 y3="5.384109"
                                 z3="0.079161"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.633595"
                                 y3="6.691398"
                                 z3="1.265282"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.820957"
                                 y3="2.475476"
                                 z3="1.74905"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.687731"
                                 y3="4.272509"
                                 z3="4.807161"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.258212"
                                 y3="0.914747"
                                 z3="-6.776472"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.712545"
                                 y3="2.874967"
                                 z3="1.808738"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.750359"
                                 y3="1.632467"
                                 z3="1.780019"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.966472"
                                 y3="-0.529975"
                                 z3="-1.962883"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.518966"
                                 y3="-0.293782"
                                 z3="1.546701"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.080807"
                                 y3="2.035064"
                                 z3="7.199261"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.251311"
                                 y3="1.086059"
                                 z3="2.065135"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.049961"
                                 y3="5.752878"
                                 z3="-0.397179"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.900933"
                                 y3="3.644782"
                                 z3="5.599542"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.532295"
                                 y3="3.691347"
                                 z3="-7.038745"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.306539"
                                 y3="3.571444"
                                 z3="-3.698076"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.78839"
                                 y3="4.726882"
                                 z3="3.752685"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.030637"
                                 y3="0.935002"
                                 z3="0.333656"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.492658"
                                 y3="4.145429"
                                 z3="-0.459567"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.428423"
                                 y3="2.222889"
                                 z3="-2.053988"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.227371"
                                 y3="0.573786"
                                 z3="-2.328515"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.667474"
                                 y3="2.622307"
                                 z3="-4.643491"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.468794"
                                 y3="2.518735"
                                 z3="0.423158"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.446787"
                                 y3="3.870819"
                                 z3="3.03231"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.924289"
                                 y3="4.359916"
                                 z3="-3.81724"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.931657"
                                 y3="-1.676137"
                                 z3="0.004561"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.128278"
                                 y3="3.456932"
                                 z3="-3.463327"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-1.999453"
                                 y3="1.098115"
                                 z3="-2.668569"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.510616"
                                 y3="4.749165"
                                 z3="-3.171081"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.395668"
                                 y3="3.408743"
                                 z3="-1.073076"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.47574"
                                 y3="5.890996"
                                 z3="-1.292967"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.438637"
                                 y3="4.027182"
                                 z3="0.814048"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.294863"
                                 y3="1.009561"
                                 z3="5.780738"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="2.997212"
                                 y3="-0.991872"
                                 z3="1.021563"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.546856"
                                 y3="-1.102458"
                                 z3="-1.168377"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.76859"
                                 y3="-2.634274"
                                 z3="-0.089556"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.940518"
                                 y3="3.811748"
                                 z3="5.663561"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.746211"
                                 y3="4.065723"
                                 z3="-4.344298"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9915,1.0466,-2.3917;-.0052,-.5456,.0575;-.5599,5.2515,-2.2926;-.7031,4.2406,1.152;-1.0132,-1.9249,.4589;.8972,1.5831,5.7222;3.2477,2.2772,-2.5197;2.7071,1.3136,6.5039;2.7169,2.1352,-6.1954;-.1394,2.4646,4.3693;3.5561,2.4246,1.3954;1.6092,1.2607,-.2209;-.7325,6.1134,-.8612;.1422,-.5275,-1.7516;.9573,2.3371,-5.9746;.336,2.8854,-.1602;.8993,-.1788,1.9178;.9546,4.8817,3.4494;1.4695,.8309,-4.0808;.411,-.0769,5.4567;-2.1877,2.2477,2.4303;-1.5058,2.9782,-3.0361;2.4672,1.3128,3.8066;-2.4809,5.3841,.0792;-2.6336,6.6914,1.2653;.821,2.4755,1.749;1.6877,4.2725,4.8072;.2582,.9147,-6.7765;-2.7125,2.875,1.8087;-1.7504,1.6325,1.78;2.9665,-.53,-1.9629;3.519,-.2938,1.5467;.0808,2.0351,7.1993;2.2513,1.0861,2.0651;.05,5.7529,-.3972;2.9009,3.6448,5.5995;.5323,3.6913,-7.0387;2.3065,3.5714,-3.6981;-1.7884,4.7269,3.7527;-1.0306,.935,.3337;1.4927,4.1454,-.4596;.4284,2.2229,-2.054;-1.2274,.5738,-2.3285;-.6675,2.6223,-4.6435;3.4688,2.5187,.4232;-.4468,3.8708,3.0323;.9243,4.3599,-3.8172;1.9317,-1.6761,.0046;-3.1283,3.4569,-3.4633;-1.9995,1.0981,-2.6686;-.5106,4.7492,-3.1711;-1.3957,3.4087,-1.0731;-3.4757,5.891,-1.293;-3.4386,4.0272,.814;3.2949,1.0096,5.7807;2.9972,-.9919,1.0216;2.5469,-1.1025,-1.1684;1.7686,-2.6343,-.0896;1.9405,3.8117,5.6636;1.7462,4.0657,-4.3443;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">7</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">7</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89590292</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01478877</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00281590</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01478877</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00281590</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.06820732</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01219211</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.989153"
                                 y3="1.04162"
                                 z3="-2.394629"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="-0.003224"
                                 y3="-0.547691"
                                 z3="0.060808"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.568056"
                                 y3="5.260294"
                                 z3="-2.297437"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.695053"
                                 y3="4.24243"
                                 z3="1.155961"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-1.010208"
                                 y3="-1.926952"
                                 z3="0.465496"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.89927"
                                 y3="1.578179"
                                 z3="5.717136"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.247455"
                                 y3="2.270921"
                                 z3="-2.524777"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.710356"
                                 y3="1.314727"
                                 z3="6.499527"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.717059"
                                 y3="2.138263"
                                 z3="-6.200665"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.138312"
                                 y3="2.460222"
                                 z3="4.366949"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.559694"
                                 y3="2.423494"
                                 z3="1.390923"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.610682"
                                 y3="1.257477"
                                 z3="-0.221259"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.752773"
                                 y3="6.114127"
                                 z3="-0.84872"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.140561"
                                 y3="-0.531356"
                                 z3="-1.748255"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.969813"
                                 y3="2.338516"
                                 z3="-5.9776"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.338604"
                                 y3="2.883609"
                                 z3="-0.161343"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.903367"
                                 y3="-0.179914"
                                 z3="1.920287"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.967175"
                                 y3="4.877986"
                                 z3="3.452449"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.463421"
                                 y3="0.81974"
                                 z3="-4.080279"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.419281"
                                 y3="-0.083902"
                                 z3="5.452347"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.207491"
                                 y3="2.293929"
                                 z3="2.399531"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.502748"
                                 y3="2.977833"
                                 z3="-3.04094"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.472775"
                                 y3="1.313858"
                                 z3="3.804808"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.490623"
                                 y3="5.364379"
                                 z3="0.093843"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.653132"
                                 y3="6.668655"
                                 z3="1.282811"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.824667"
                                 y3="2.474792"
                                 z3="1.749473"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.669402"
                                 y3="4.270802"
                                 z3="4.799345"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.257128"
                                 y3="0.924509"
                                 z3="-6.782193"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.715491"
                                 y3="2.943174"
                                 z3="1.789976"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.780292"
                                 y3="1.684419"
                                 z3="1.736402"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.964803"
                                 y3="-0.535553"
                                 z3="-1.965533"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.521934"
                                 y3="-0.294976"
                                 z3="1.54526"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.081658"
                                 y3="2.027353"
                                 z3="7.194596"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.254737"
                                 y3="1.085864"
                                 z3="2.063722"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.034447"
                                 y3="5.761119"
                                 z3="-0.386483"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.890744"
                                 y3="3.650631"
                                 z3="5.58542"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.53863"
                                 y3="3.697369"
                                 z3="-7.034283"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.319529"
                                 y3="3.553263"
                                 z3="-3.688611"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.775482"
                                 y3="4.732505"
                                 z3="3.757256"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.027808"
                                 y3="0.932896"
                                 z3="0.338639"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.495625"
                                 y3="4.143227"
                                 z3="-0.461614"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.428742"
                                 y3="2.219104"
                                 z3="-2.055096"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.232105"
                                 y3="0.579725"
                                 z3="-2.314157"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.666592"
                                 y3="2.622911"
                                 z3="-4.641319"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.469424"
                                 y3="2.517087"
                                 z3="0.418904"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.437922"
                                 y3="3.872879"
                                 z3="3.033094"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.944739"
                                 y3="4.353972"
                                 z3="-3.807243"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.932994"
                                 y3="-1.679498"
                                 z3="0.006418"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.125741"
                                 y3="3.45788"
                                 z3="-3.465978"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.003913"
                                 y3="1.102009"
                                 z3="-2.657487"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.509864"
                                 y3="4.752985"
                                 z3="-3.171882"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.387792"
                                 y3="3.407325"
                                 z3="-1.069492"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.500233"
                                 y3="5.859134"
                                 z3="-1.272403"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.418453"
                                 y3="3.992208"
                                 z3="0.84015"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.299292"
                                 y3="1.01479"
                                 z3="5.775599"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="2.99885"
                                 y3="-0.993868"
                                 z3="1.022397"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.547322"
                                 y3="-1.10586"
                                 z3="-1.170454"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.768676"
                                 y3="-2.637578"
                                 z3="-0.085849"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.929864"
                                 y3="3.812825"
                                 z3="5.654819"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.765136"
                                 y3="4.054177"
                                 z3="-4.334167"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9892,1.0416,-2.3946;-.0032,-.5477,.0608;-.5681,5.2603,-2.2974;-.6951,4.2424,1.156;-1.0102,-1.927,.4655;.8993,1.5782,5.7171;3.2475,2.2709,-2.5248;2.7104,1.3147,6.4995;2.7171,2.1383,-6.2007;-.1383,2.4602,4.3669;3.5597,2.4235,1.3909;1.6107,1.2575,-.2213;-.7528,6.1141,-.8487;.1406,-.5314,-1.7483;.9698,2.3385,-5.9776;.3386,2.8836,-.1613;.9034,-.1799,1.9203;.9672,4.878,3.4524;1.4634,.8197,-4.0803;.4193,-.0839,5.4523;-2.2075,2.2939,2.3995;-1.5027,2.9778,-3.0409;2.4728,1.3139,3.8048;-2.4906,5.3644,.0938;-2.6531,6.6687,1.2828;.8247,2.4748,1.7495;1.6694,4.2708,4.7993;.2571,.9245,-6.7822;-2.7155,2.9432,1.79;-1.7803,1.6844,1.7364;2.9648,-.5356,-1.9655;3.5219,-.295,1.5453;.0817,2.0274,7.1946;2.2547,1.0859,2.0637;.0344,5.7611,-.3865;2.8907,3.6506,5.5854;.5386,3.6974,-7.0343;2.3195,3.5533,-3.6886;-1.7755,4.7325,3.7573;-1.0278,.9329,.3386;1.4956,4.1432,-.4616;.4287,2.2191,-2.0551;-1.2321,.5797,-2.3142;-.6666,2.6229,-4.6413;3.4694,2.5171,.4189;-.4379,3.8729,3.0331;.9447,4.354,-3.8072;1.933,-1.6795,.0064;-3.1257,3.4579,-3.466;-2.0039,1.102,-2.6575;-.5099,4.753,-3.1719;-1.3878,3.4073,-1.0695;-3.5002,5.8591,-1.2724;-3.4185,3.9922,.8401;3.2993,1.0148,5.7756;2.9989,-.9939,1.0224;2.5473,-1.1059,-1.1705;1.7687,-2.6376,-.0858;1.9299,3.8128,5.6548;1.7651,4.0542,-4.3342;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">8</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">8</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89662268</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01214695</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00219418</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01214695</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00219418</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.06397077</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01401478</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.982105"
                                 y3="1.03874"
                                 z3="-2.400581"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="-0.000348"
                                 y3="-0.547075"
                                 z3="0.066373"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.59278"
                                 y3="5.262198"
                                 z3="-2.315143"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.70125"
                                 y3="4.249093"
                                 z3="1.151884"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-1.001262"
                                 y3="-1.928799"
                                 z3="0.478724"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.899506"
                                 y3="1.573025"
                                 z3="5.708648"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.239491"
                                 y3="2.269482"
                                 z3="-2.535005"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.704404"
                                 y3="1.282685"
                                 z3="6.49761"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.73824"
                                 y3="2.157392"
                                 z3="-6.199595"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.12896"
                                 y3="2.471294"
                                 z3="4.362211"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.556375"
                                 y3="2.439793"
                                 z3="1.379374"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.606828"
                                 y3="1.260756"
                                 z3="-0.22492"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.739268"
                                 y3="6.110908"
                                 z3="-0.845043"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.138601"
                                 y3="-0.536278"
                                 z3="-1.742986"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.98398"
                                 y3="2.339745"
                                 z3="-5.982137"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.330842"
                                 y3="2.8851"
                                 z3="-0.1698"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.908695"
                                 y3="-0.171035"
                                 z3="1.923518"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.964156"
                                 y3="4.897849"
                                 z3="3.43464"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.45415"
                                 y3="0.801651"
                                 z3="-4.083115"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.408015"
                                 y3="-0.081262"
                                 z3="5.415523"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.204733"
                                 y3="2.296972"
                                 z3="2.403969"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.509765"
                                 y3="2.969098"
                                 z3="-3.056329"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.477963"
                                 y3="1.330229"
                                 z3="3.799395"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.490285"
                                 y3="5.368934"
                                 z3="0.077413"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.657184"
                                 y3="6.678898"
                                 z3="1.259803"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.821517"
                                 y3="2.484305"
                                 z3="1.74441"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.718168"
                                 y3="4.273326"
                                 z3="4.852335"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.272144"
                                 y3="0.932013"
                                 z3="-6.797504"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.718615"
                                 y3="2.941255"
                                 z3="1.793926"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.777415"
                                 y3="1.687124"
                                 z3="1.740725"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.96373"
                                 y3="-0.53407"
                                 z3="-1.965828"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.52586"
                                 y3="-0.278139"
                                 z3="1.540828"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.074664"
                                 y3="2.006851"
                                 z3="7.186943"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.25507"
                                 y3="1.10064"
                                 z3="2.058572"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.040615"
                                 y3="5.754487"
                                 z3="-0.372652"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.917009"
                                 y3="3.622382"
                                 z3="5.64939"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.553541"
                                 y3="3.702206"
                                 z3="-7.034576"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.302571"
                                 y3="3.537941"
                                 z3="-3.660314"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.775991"
                                 y3="4.739555"
                                 z3="3.754687"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.029076"
                                 y3="0.930688"
                                 z3="0.343187"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.484923"
                                 y3="4.146868"
                                 z3="-0.474536"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.420541"
                                 y3="2.212177"
                                 z3="-2.062744"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.242279"
                                 y3="0.585089"
                                 z3="-2.293052"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.679569"
                                 y3="2.610619"
                                 z3="-4.651015"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.46187"
                                 y3="2.531308"
                                 z3="0.407538"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.438206"
                                 y3="3.883552"
                                 z3="3.026133"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.92389"
                                 y3="4.328817"
                                 z3="-3.78525"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.938255"
                                 y3="-1.67481"
                                 z3="0.013918"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.134044"
                                 y3="3.446979"
                                 z3="-3.478455"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.015978"
                                 y3="1.101021"
                                 z3="-2.641356"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.520879"
                                 y3="4.749324"
                                 z3="-3.185603"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.385455"
                                 y3="3.407921"
                                 z3="-1.073322"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.488779"
                                 y3="5.860966"
                                 z3="-1.297912"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.425973"
                                 y3="4.00258"
                                 z3="0.825336"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.294634"
                                 y3="0.990958"
                                 z3="5.771422"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.003261"
                                 y3="-0.979573"
                                 z3="1.020954"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.550756"
                                 y3="-1.101792"
                                 z3="-1.169487"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.775058"
                                 y3="-2.63351"
                                 z3="-0.073453"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.957325"
                                 y3="3.796007"
                                 z3="5.704887"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.753048"
                                 y3="4.03959"
                                 z3="-4.30837"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9821,1.0387,-2.4006;-.0003,-.5471,.0664;-.5928,5.2622,-2.3151;-.7013,4.2491,1.1519;-1.0013,-1.9288,.4787;.8995,1.573,5.7086;3.2395,2.2695,-2.535;2.7044,1.2827,6.4976;2.7382,2.1574,-6.1996;-.129,2.4713,4.3622;3.5564,2.4398,1.3794;1.6068,1.2608,-.2249;-.7393,6.1109,-.845;.1386,-.5363,-1.743;.984,2.3397,-5.9821;.3308,2.8851,-.1698;.9087,-.171,1.9235;.9642,4.8978,3.4346;1.4542,.8017,-4.0831;.408,-.0813,5.4155;-2.2047,2.297,2.404;-1.5098,2.9691,-3.0563;2.478,1.3302,3.7994;-2.4903,5.3689,.0774;-2.6572,6.6789,1.2598;.8215,2.4843,1.7444;1.7182,4.2733,4.8523;.2721,.932,-6.7975;-2.7186,2.9413,1.7939;-1.7774,1.6871,1.7407;2.9637,-.5341,-1.9658;3.5259,-.2781,1.5408;.0747,2.0069,7.1869;2.2551,1.1006,2.0586;.0406,5.7545,-.3727;2.917,3.6224,5.6494;.5535,3.7022,-7.0346;2.3026,3.5379,-3.6603;-1.776,4.7396,3.7547;-1.0291,.9307,.3432;1.4849,4.1469,-.4745;.4205,2.2122,-2.0627;-1.2423,.5851,-2.2931;-.6796,2.6106,-4.651;3.4619,2.5313,.4075;-.4382,3.8836,3.0261;.9239,4.3288,-3.7853;1.9383,-1.6748,.0139;-3.134,3.447,-3.4785;-2.016,1.101,-2.6414;-.5209,4.7493,-3.1856;-1.3855,3.4079,-1.0733;-3.4888,5.861,-1.2979;-3.426,4.0026,.8253;3.2946,.991,5.7714;3.0033,-.9796,1.021;2.5508,-1.1018,-1.1695;1.7751,-2.6335,-.0735;1.9573,3.796,5.7049;1.753,4.0396,-4.3084;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">9</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">9</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89689284</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00913639</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00173254</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00913639</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00173254</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.02952669</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00815505</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.976854"
                                 y3="1.033948"
                                 z3="-2.402168"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="-0.0045"
                                 y3="-0.549822"
                                 z3="0.068411"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.563283"
                                 y3="5.246293"
                                 z3="-2.295672"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.700461"
                                 y3="4.250505"
                                 z3="1.155785"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-1.005125"
                                 y3="-1.931469"
                                 z3="0.482375"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.904635"
                                 y3="1.575573"
                                 z3="5.708497"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.236844"
                                 y3="2.262419"
                                 z3="-2.535372"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.713912"
                                 y3="1.298405"
                                 z3="6.493523"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.757644"
                                 y3="2.169613"
                                 z3="-6.194867"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.129919"
                                 y3="2.46687"
                                 z3="4.364125"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.554714"
                                 y3="2.436144"
                                 z3="1.376298"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.602753"
                                 y3="1.256019"
                                 z3="-0.225074"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.749749"
                                 y3="6.117749"
                                 z3="-0.856676"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.132067"
                                 y3="-0.53881"
                                 z3="-1.741364"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.995314"
                                 y3="2.34992"
                                 z3="-5.981818"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.328282"
                                 y3="2.882422"
                                 z3="-0.170072"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.906296"
                                 y3="-0.173868"
                                 z3="1.925195"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.965699"
                                 y3="4.891277"
                                 z3="3.442472"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.449107"
                                 y3="0.794983"
                                 z3="-4.085299"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.420206"
                                 y3="-0.083093"
                                 z3="5.428357"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.200276"
                                 y3="2.288025"
                                 z3="2.409225"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.509485"
                                 y3="2.972975"
                                 z3="-3.061704"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.478955"
                                 y3="1.329568"
                                 z3="3.797919"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.489948"
                                 y3="5.36829"
                                 z3="0.078582"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.65962"
                                 y3="6.679712"
                                 z3="1.259039"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.819557"
                                 y3="2.48163"
                                 z3="1.745738"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.700047"
                                 y3="4.272687"
                                 z3="4.826634"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.287537"
                                 y3="0.945223"
                                 z3="-6.804765"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.714688"
                                 y3="2.926898"
                                 z3="1.793309"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.769792"
                                 y3="1.674539"
                                 z3="1.751345"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.957741"
                                 y3="-0.539411"
                                 z3="-1.9667"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.522934"
                                 y3="-0.281247"
                                 z3="1.539178"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.084376"
                                 y3="2.013868"
                                 z3="7.188266"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.252429"
                                 y3="1.098254"
                                 z3="2.057627"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.035381"
                                 y3="5.755372"
                                 z3="-0.39818"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.908458"
                                 y3="3.636961"
                                 z3="5.619864"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.573654"
                                 y3="3.716607"
                                 z3="-7.031377"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.296046"
                                 y3="3.54354"
                                 z3="-3.642293"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.775921"
                                 y3="4.735471"
                                 z3="3.758825"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.032771"
                                 y3="0.928085"
                                 z3="0.346558"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.484645"
                                 y3="4.142492"
                                 z3="-0.474409"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.417248"
                                 y3="2.207364"
                                 z3="-2.064497"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.251173"
                                 y3="0.592913"
                                 z3="-2.290371"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.685055"
                                 y3="2.612891"
                                 z3="-4.656433"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.458314"
                                 y3="2.527817"
                                 z3="0.404682"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.437883"
                                 y3="3.880882"
                                 z3="3.028124"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.914506"
                                 y3="4.329614"
                                 z3="-3.77582"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.932569"
                                 y3="-1.679865"
                                 z3="0.015418"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.131962"
                                 y3="3.458281"
                                 z3="-3.480644"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.024759"
                                 y3="1.110241"
                                 z3="-2.636697"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.508631"
                                 y3="4.748396"
                                 z3="-3.176452"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.379445"
                                 y3="3.410408"
                                 z3="-1.069561"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.493111"
                                 y3="5.853451"
                                 z3="-1.295811"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.420352"
                                 y3="3.999735"
                                 z3="0.829318"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.30324"
                                 y3="1.007431"
                                 z3="5.766327"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="2.999373"
                                 y3="-0.983438"
                                 z3="1.021401"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.545922"
                                 y3="-1.106604"
                                 z3="-1.170956"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.76766"
                                 y3="-2.638388"
                                 z3="-0.070465"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.948244"
                                 y3="3.805622"
                                 z3="5.681643"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.748451"
                                 y3="4.042678"
                                 z3="-4.294347"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9769,1.0339,-2.4022;-.0045,-.5498,.0684;-.5633,5.2463,-2.2957;-.7005,4.2505,1.1558;-1.0051,-1.9315,.4824;.9046,1.5756,5.7085;3.2368,2.2624,-2.5354;2.7139,1.2984,6.4935;2.7576,2.1696,-6.1949;-.1299,2.4669,4.3641;3.5547,2.4361,1.3763;1.6028,1.256,-.2251;-.7497,6.1177,-.8567;.1321,-.5388,-1.7414;.9953,2.3499,-5.9818;.3283,2.8824,-.1701;.9063,-.1739,1.9252;.9657,4.8913,3.4425;1.4491,.795,-4.0853;.4202,-.0831,5.4284;-2.2003,2.288,2.4092;-1.5095,2.973,-3.0617;2.479,1.3296,3.7979;-2.4899,5.3683,.0786;-2.6596,6.6797,1.259;.8196,2.4816,1.7457;1.7,4.2727,4.8266;.2875,.9452,-6.8048;-2.7147,2.9269,1.7933;-1.7698,1.6745,1.7513;2.9577,-.5394,-1.9667;3.5229,-.2812,1.5392;.0844,2.0139,7.1883;2.2524,1.0983,2.0576;.0354,5.7554,-.3982;2.9085,3.637,5.6199;.5737,3.7166,-7.0314;2.296,3.5435,-3.6423;-1.7759,4.7355,3.7588;-1.0328,.9281,.3466;1.4846,4.1425,-.4744;.4172,2.2074,-2.0645;-1.2512,.5929,-2.2904;-.6851,2.6129,-4.6564;3.4583,2.5278,.4047;-.4379,3.8809,3.0281;.9145,4.3296,-3.7758;1.9326,-1.6799,.0154;-3.132,3.4583,-3.4806;-2.0248,1.1102,-2.6367;-.5086,4.7484,-3.1765;-1.3794,3.4104,-1.0696;-3.4931,5.8535,-1.2958;-3.4204,3.9997,.8293;3.3032,1.0074,5.7663;2.9994,-.9834,1.0214;2.5459,-1.1066,-1.171;1.7677,-2.6384,-.0705;1.9482,3.8056,5.6816;1.7485,4.0427,-4.2943;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">10</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">10</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89732951</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00794046</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00154470</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00794046</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00154470</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.02436917</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00558862</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.975928"
                                 y3="1.034793"
                                 z3="-2.402113"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="-0.003936"
                                 y3="-0.551252"
                                 z3="0.070062"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.562912"
                                 y3="5.24346"
                                 z3="-2.289637"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.698857"
                                 y3="4.254626"
                                 z3="1.164436"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-1.002496"
                                 y3="-1.934733"
                                 z3="0.483793"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.904871"
                                 y3="1.569919"
                                 z3="5.70843"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.236791"
                                 y3="2.263195"
                                 z3="-2.532765"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.716182"
                                 y3="1.301108"
                                 z3="6.493251"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.752822"
                                 y3="2.1622"
                                 z3="-6.207895"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.133093"
                                 y3="2.4594"
                                 z3="4.367198"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.552468"
                                 y3="2.438123"
                                 z3="1.377265"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.600573"
                                 y3="1.254706"
                                 z3="-0.223685"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.747669"
                                 y3="6.120945"
                                 z3="-0.856651"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.131029"
                                 y3="-0.538025"
                                 z3="-1.739842"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.99685"
                                 y3="2.347751"
                                 z3="-5.990891"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.325713"
                                 y3="2.881793"
                                 z3="-0.168133"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.90664"
                                 y3="-0.175214"
                                 z3="1.927452"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.966263"
                                 y3="4.883757"
                                 z3="3.456612"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.453065"
                                 y3="0.792143"
                                 z3="-4.086672"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.427278"
                                 y3="-0.09119"
                                 z3="5.430281"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.204108"
                                 y3="2.289354"
                                 z3="2.412522"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.509193"
                                 y3="2.975498"
                                 z3="-3.066038"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.479402"
                                 y3="1.330643"
                                 z3="3.799269"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.486059"
                                 y3="5.370189"
                                 z3="0.081151"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.660593"
                                 y3="6.683839"
                                 z3="1.258492"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.81677"
                                 y3="2.480546"
                                 z3="1.749662"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.686492"
                                 y3="4.268993"
                                 z3="4.821844"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.296056"
                                 y3="0.9365"
                                 z3="-6.809892"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.71494"
                                 y3="2.929394"
                                 z3="1.794228"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.774202"
                                 y3="1.672154"
                                 z3="1.757559"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.958623"
                                 y3="-0.537857"
                                 z3="-1.964526"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.522766"
                                 y3="-0.279169"
                                 z3="1.539631"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.084704"
                                 y3="2.005165"
                                 z3="7.189498"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.250464"
                                 y3="1.09936"
                                 z3="2.058878"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.038429"
                                 y3="5.755477"
                                 z3="-0.402267"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.898713"
                                 y3="3.640873"
                                 z3="5.614986"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.566418"
                                 y3="3.712933"
                                 z3="-7.039879"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.309544"
                                 y3="3.556011"
                                 z3="-3.666508"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.776502"
                                 y3="4.731135"
                                 z3="3.767643"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.034315"
                                 y3="0.925015"
                                 z3="0.350209"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.483647"
                                 y3="4.141187"
                                 z3="-0.471559"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.415943"
                                 y3="2.204871"
                                 z3="-2.065353"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.253313"
                                 y3="0.603579"
                                 z3="-2.280191"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.693638"
                                 y3="2.607278"
                                 z3="-4.664356"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.454918"
                                 y3="2.530594"
                                 z3="0.405861"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.438646"
                                 y3="3.878279"
                                 z3="3.033722"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.924624"
                                 y3="4.339607"
                                 z3="-3.79615"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.932514"
                                 y3="-1.681438"
                                 z3="0.017731"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.130852"
                                 y3="3.463964"
                                 z3="-3.481396"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.02843"
                                 y3="1.120369"
                                 z3="-2.623869"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.506534"
                                 y3="4.748452"
                                 z3="-3.172312"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.371304"
                                 y3="3.414549"
                                 z3="-1.062782"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.488144"
                                 y3="5.849591"
                                 z3="-1.296006"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.415392"
                                 y3="4.000728"
                                 z3="0.83176"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.306534"
                                 y3="1.014862"
                                 z3="5.765062"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="2.999157"
                                 y3="-0.983719"
                                 z3="1.025372"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.548047"
                                 y3="-1.106264"
                                 z3="-1.170892"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.766999"
                                 y3="-2.63995"
                                 z3="-0.066768"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.937909"
                                 y3="3.805743"
                                 z3="5.678078"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.75369"
                                 y3="4.048206"
                                 z3="-4.318717"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9759,1.0348,-2.4021;-.0039,-.5513,.0701;-.5629,5.2435,-2.2896;-.6989,4.2546,1.1644;-1.0025,-1.9347,.4838;.9049,1.5699,5.7084;3.2368,2.2632,-2.5328;2.7162,1.3011,6.4933;2.7528,2.1622,-6.2079;-.1331,2.4594,4.3672;3.5525,2.4381,1.3773;1.6006,1.2547,-.2237;-.7477,6.1209,-.8567;.131,-.538,-1.7398;.9969,2.3478,-5.9909;.3257,2.8818,-.1681;.9066,-.1752,1.9275;.9663,4.8838,3.4566;1.4531,.7921,-4.0867;.4273,-.0912,5.4303;-2.2041,2.2894,2.4125;-1.5092,2.9755,-3.066;2.4794,1.3306,3.7993;-2.4861,5.3702,.0812;-2.6606,6.6838,1.2585;.8168,2.4805,1.7497;1.6865,4.269,4.8218;.2961,.9365,-6.8099;-2.7149,2.9294,1.7942;-1.7742,1.6722,1.7576;2.9586,-.5379,-1.9645;3.5228,-.2792,1.5396;.0847,2.0052,7.1895;2.2505,1.0994,2.0589;.0384,5.7555,-.4023;2.8987,3.6409,5.615;.5664,3.7129,-7.0399;2.3095,3.556,-3.6665;-1.7765,4.7311,3.7676;-1.0343,.925,.3502;1.4836,4.1412,-.4716;.4159,2.2049,-2.0654;-1.2533,.6036,-2.2802;-.6936,2.6073,-4.6644;3.4549,2.5306,.4059;-.4386,3.8783,3.0337;.9246,4.3396,-3.7961;1.9325,-1.6814,.0177;-3.1309,3.464,-3.4814;-2.0284,1.1204,-2.6239;-.5065,4.7485,-3.1723;-1.3713,3.4145,-1.0628;-3.4881,5.8496,-1.296;-3.4154,4.0007,.8318;3.3065,1.0149,5.7651;2.9992,-.9837,1.0254;2.548,-1.1063,-1.1709;1.767,-2.6399,-.0668;1.9379,3.8057,5.6781;1.7537,4.0482,-4.3187;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">11</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">11</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89764167</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00530496</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00104183</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00530496</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00104183</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.02738620</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00707518</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.971816"
                                 y3="1.03553"
                                 z3="-2.405181"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="-0.00242"
                                 y3="-0.551559"
                                 z3="0.073029"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.567089"
                                 y3="5.24234"
                                 z3="-2.297388"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.697423"
                                 y3="4.264735"
                                 z3="1.173742"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.996528"
                                 y3="-1.937933"
                                 z3="0.489149"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.907632"
                                 y3="1.560755"
                                 z3="5.703057"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.231275"
                                 y3="2.265546"
                                 z3="-2.537599"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.720535"
                                 y3="1.296372"
                                 z3="6.488248"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.757079"
                                 y3="2.162651"
                                 z3="-6.207761"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.133461"
                                 y3="2.452775"
                                 z3="4.367575"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.548632"
                                 y3="2.447653"
                                 z3="1.371159"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.595964"
                                 y3="1.255399"
                                 z3="-0.225483"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.744293"
                                 y3="6.11815"
                                 z3="-0.859962"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.128027"
                                 y3="-0.537405"
                                 z3="-1.737249"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="1.003066"
                                 y3="2.350869"
                                 z3="-5.99395"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.319262"
                                 y3="2.882571"
                                 z3="-0.169477"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.909879"
                                 y3="-0.172169"
                                 z3="1.929574"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.967616"
                                 y3="4.880723"
                                 z3="3.468658"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.456578"
                                 y3="0.781499"
                                 z3="-4.090451"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.437796"
                                 y3="-0.101664"
                                 z3="5.418038"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.20553"
                                 y3="2.295246"
                                 z3="2.408573"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.514569"
                                 y3="2.975886"
                                 z3="-3.074856"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.483624"
                                 y3="1.33931"
                                 z3="3.796316"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.483687"
                                 y3="5.373108"
                                 z3="0.082012"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.66343"
                                 y3="6.692176"
                                 z3="1.252679"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.812818"
                                 y3="2.483497"
                                 z3="1.751026"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.677241"
                                 y3="4.267152"
                                 z3="4.829641"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.305986"
                                 y3="0.944073"
                                 z3="-6.824978"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.710936"
                                 y3="2.938779"
                                 z3="1.78883"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.775226"
                                 y3="1.676508"
                                 z3="1.75567"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.95907"
                                 y3="-0.534091"
                                 z3="-1.961585"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.525063"
                                 y3="-0.268373"
                                 z3="1.53428"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.085815"
                                 y3="1.98526"
                                 z3="7.186778"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.249213"
                                 y3="1.10733"
                                 z3="2.056266"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.041948"
                                 y3="5.748572"
                                 z3="-0.408568"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.89153"
                                 y3="3.641744"
                                 z3="5.622599"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.57344"
                                 y3="3.722186"
                                 z3="-7.036321"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.317413"
                                 y3="3.528624"
                                 z3="-3.66312"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.776045"
                                 y3="4.728786"
                                 z3="3.777291"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.036924"
                                 y3="0.921538"
                                 z3="0.355784"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.478195"
                                 y3="4.141158"
                                 z3="-0.475024"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.410511"
                                 y3="2.200112"
                                 z3="-2.070832"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.262203"
                                 y3="0.616726"
                                 z3="-2.263312"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.710647"
                                 y3="2.597423"
                                 z3="-4.678977"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.448273"
                                 y3="2.540245"
                                 z3="0.400032"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.438409"
                                 y3="3.879338"
                                 z3="3.03805"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.939749"
                                 y3="4.322228"
                                 z3="-3.781152"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.932996"
                                 y3="-1.681418"
                                 z3="0.022218"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.135859"
                                 y3="3.467029"
                                 z3="-3.482846"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.038379"
                                 y3="1.133521"
                                 z3="-2.60555"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.514482"
                                 y3="4.744529"
                                 z3="-3.179992"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.363474"
                                 y3="3.420109"
                                 z3="-1.054978"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.483421"
                                 y3="5.843533"
                                 z3="-1.299815"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.41352"
                                 y3="4.005055"
                                 z3="0.834491"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.312538"
                                 y3="1.019257"
                                 z3="5.757873"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.002016"
                                 y3="-0.975019"
                                 z3="1.022924"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.551134"
                                 y3="-1.103971"
                                 z3="-1.170502"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.766513"
                                 y3="-2.640021"
                                 z3="-0.058988"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.930069"
                                 y3="3.803032"
                                 z3="5.685371"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.76135"
                                 y3="4.027033"
                                 z3="-4.310843"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9718,1.0355,-2.4052;-.0024,-.5516,.073;-.5671,5.2423,-2.2974;-.6974,4.2647,1.1737;-.9965,-1.9379,.4891;.9076,1.5608,5.7031;3.2313,2.2655,-2.5376;2.7205,1.2964,6.4882;2.7571,2.1627,-6.2078;-.1335,2.4528,4.3676;3.5486,2.4477,1.3712;1.596,1.2554,-.2255;-.7443,6.1181,-.86;.128,-.5374,-1.7372;1.0031,2.3509,-5.9939;.3193,2.8826,-.1695;.9099,-.1722,1.9296;.9676,4.8807,3.4687;1.4566,.7815,-4.0905;.4378,-.1017,5.418;-2.2055,2.2952,2.4086;-1.5146,2.9759,-3.0749;2.4836,1.3393,3.7963;-2.4837,5.3731,.082;-2.6634,6.6922,1.2527;.8128,2.4835,1.751;1.6772,4.2672,4.8296;.306,.9441,-6.825;-2.7109,2.9388,1.7888;-1.7752,1.6765,1.7557;2.9591,-.5341,-1.9616;3.5251,-.2684,1.5343;.0858,1.9853,7.1868;2.2492,1.1073,2.0563;.0419,5.7486,-.4086;2.8915,3.6417,5.6226;.5734,3.7222,-7.0363;2.3174,3.5286,-3.6631;-1.776,4.7288,3.7773;-1.0369,.9215,.3558;1.4782,4.1412,-.475;.4105,2.2001,-2.0708;-1.2622,.6167,-2.2633;-.7106,2.5974,-4.679;3.4483,2.5402,.4;-.4384,3.8793,3.0381;.9397,4.3222,-3.7812;1.933,-1.6814,.0222;-3.1359,3.467,-3.4828;-2.0384,1.1335,-2.6056;-.5145,4.7445,-3.18;-1.3635,3.4201,-1.055;-3.4834,5.8435,-1.2998;-3.4135,4.0051,.8345;3.3125,1.0193,5.7579;3.002,-.975,1.0229;2.5511,-1.104,-1.1705;1.7665,-2.64,-.059;1.9301,3.803,5.6854;1.7613,4.027,-4.3108;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">12</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">12</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89780723</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00483781</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00086735</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00483781</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00086735</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01859487</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00484666</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.973437"
                                 y3="1.036506"
                                 z3="-2.405356"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.000302"
                                 y3="-0.551743"
                                 z3="0.074008"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.576007"
                                 y3="5.240874"
                                 z3="-2.296892"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.69524"
                                 y3="4.271888"
                                 z3="1.178203"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.991651"
                                 y3="-1.939767"
                                 z3="0.490228"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.906729"
                                 y3="1.553683"
                                 z3="5.700911"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.231349"
                                 y3="2.268376"
                                 z3="-2.537855"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.718949"
                                 y3="1.285985"
                                 z3="6.487926"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.758176"
                                 y3="2.162877"
                                 z3="-6.211776"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.133451"
                                 y3="2.45047"
                                 z3="4.368109"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.54661"
                                 y3="2.453222"
                                 z3="1.370291"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.595131"
                                 y3="1.256006"
                                 z3="-0.22552"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.737579"
                                 y3="6.116317"
                                 z3="-0.864765"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.129555"
                                 y3="-0.53686"
                                 z3="-1.736466"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="1.003308"
                                 y3="2.34787"
                                 z3="-5.997565"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.317113"
                                 y3="2.882927"
                                 z3="-0.169989"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.911757"
                                 y3="-0.17024"
                                 z3="1.930926"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.968343"
                                 y3="4.881061"
                                 z3="3.473708"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.464013"
                                 y3="0.778081"
                                 z3="-4.091637"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.438444"
                                 y3="-0.107716"
                                 z3="5.407112"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.207438"
                                 y3="2.300528"
                                 z3="2.407834"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.514759"
                                 y3="2.974236"
                                 z3="-3.080023"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.484628"
                                 y3="1.343902"
                                 z3="3.796401"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.479139"
                                 y3="5.376687"
                                 z3="0.079257"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.660475"
                                 y3="6.699421"
                                 z3="1.24567"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.810624"
                                 y3="2.485269"
                                 z3="1.751974"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.678993"
                                 y3="4.264718"
                                 z3="4.844807"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.305786"
                                 y3="0.939063"
                                 z3="-6.824433"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.71284"
                                 y3="2.946459"
                                 z3="1.790745"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.778902"
                                 y3="1.682329"
                                 z3="1.753409"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.962923"
                                 y3="-0.531189"
                                 z3="-1.958321"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.526418"
                                 y3="-0.26234"
                                 z3="1.533892"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.082635"
                                 y3="1.970166"
                                 z3="7.185834"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.248418"
                                 y3="1.111958"
                                 z3="2.056411"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.048306"
                                 y3="5.745821"
                                 z3="-0.413245"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.890358"
                                 y3="3.635333"
                                 z3="5.639844"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.572904"
                                 y3="3.715929"
                                 z3="-7.043364"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.304054"
                                 y3="3.528881"
                                 z3="-3.666376"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.775345"
                                 y3="4.729475"
                                 z3="3.781618"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.037063"
                                 y3="0.91933"
                                 z3="0.357527"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.476731"
                                 y3="4.140931"
                                 z3="-0.476574"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.41066"
                                 y3="2.197284"
                                 z3="-2.073614"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.26273"
                                 y3="0.622266"
                                 z3="-2.2509"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.718466"
                                 y3="2.588585"
                                 z3="-4.685857"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.44564"
                                 y3="2.545781"
                                 z3="0.399235"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.438051"
                                 y3="3.881106"
                                 z3="3.040206"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.931877"
                                 y3="4.329998"
                                 z3="-3.799747"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.935062"
                                 y3="-1.681042"
                                 z3="0.025194"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.136338"
                                 y3="3.465834"
                                 z3="-3.4839"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.038332"
                                 y3="1.137888"
                                 z3="-2.596702"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.518311"
                                 y3="4.740468"
                                 z3="-3.178551"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.358425"
                                 y3="3.422332"
                                 z3="-1.051668"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.476233"
                                 y3="5.843161"
                                 z3="-1.305724"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.410691"
                                 y3="4.010744"
                                 z3="0.83308"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.312112"
                                 y3="1.014054"
                                 z3="5.756538"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.003757"
                                 y3="-0.970703"
                                 z3="1.024972"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.555654"
                                 y3="-1.102003"
                                 z3="-1.169003"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.76822"
                                 y3="-2.639705"
                                 z3="-0.054253"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.928813"
                                 y3="3.797057"
                                 z3="5.699796"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.753381"
                                 y3="4.024217"
                                 z3="-4.3214"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9734,1.0365,-2.4054;.0003,-.5517,.074;-.576,5.2409,-2.2969;-.6952,4.2719,1.1782;-.9917,-1.9398,.4902;.9067,1.5537,5.7009;3.2313,2.2684,-2.5379;2.7189,1.286,6.4879;2.7582,2.1629,-6.2118;-.1335,2.4505,4.3681;3.5466,2.4532,1.3703;1.5951,1.256,-.2255;-.7376,6.1163,-.8648;.1296,-.5369,-1.7365;1.0033,2.3479,-5.9976;.3171,2.8829,-.17;.9118,-.1702,1.9309;.9683,4.8811,3.4737;1.464,.7781,-4.0916;.4384,-.1077,5.4071;-2.2074,2.3005,2.4078;-1.5148,2.9742,-3.08;2.4846,1.3439,3.7964;-2.4791,5.3767,.0793;-2.6605,6.6994,1.2457;.8106,2.4853,1.752;1.679,4.2647,4.8448;.3058,.9391,-6.8244;-2.7128,2.9465,1.7907;-1.7789,1.6823,1.7534;2.9629,-.5312,-1.9583;3.5264,-.2623,1.5339;.0826,1.9702,7.1858;2.2484,1.112,2.0564;.0483,5.7458,-.4132;2.8904,3.6353,5.6398;.5729,3.7159,-7.0434;2.3041,3.5289,-3.6664;-1.7753,4.7295,3.7816;-1.0371,.9193,.3575;1.4767,4.1409,-.4766;.4107,2.1973,-2.0736;-1.2627,.6223,-2.2509;-.7185,2.5886,-4.6859;3.4456,2.5458,.3992;-.4381,3.8811,3.0402;.9319,4.33,-3.7997;1.9351,-1.681,.0252;-3.1363,3.4658,-3.4839;-2.0383,1.1379,-2.5967;-.5183,4.7405,-3.1786;-1.3584,3.4223,-1.0517;-3.4762,5.8432,-1.3057;-3.4107,4.0107,.8331;3.3121,1.0141,5.7565;3.0038,-.9707,1.025;2.5557,-1.102,-1.169;1.7682,-2.6397,-.0543;1.9288,3.7971,5.6998;1.7534,4.0242,-4.3214;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">13</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">13</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89786902</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00437258</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00081175</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00437258</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00081175</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01253770</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00351691</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.975218"
                                 y3="1.038245"
                                 z3="-2.405619"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.00215"
                                 y3="-0.551708"
                                 z3="0.073235"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.580061"
                                 y3="5.241448"
                                 z3="-2.298068"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.693882"
                                 y3="4.27915"
                                 z3="1.181541"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.988389"
                                 y3="-1.941105"
                                 z3="0.488538"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.9067"
                                 y3="1.549739"
                                 z3="5.700298"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.230282"
                                 y3="2.273251"
                                 z3="-2.538184"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.719031"
                                 y3="1.280493"
                                 z3="6.487456"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.755871"
                                 y3="2.165563"
                                 z3="-6.217835"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.133987"
                                 y3="2.449034"
                                 z3="4.3693"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.54352"
                                 y3="2.457779"
                                 z3="1.369659"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.593827"
                                 y3="1.256814"
                                 z3="-0.226035"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.733252"
                                 y3="6.115463"
                                 z3="-0.872705"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.130829"
                                 y3="-0.536013"
                                 z3="-1.737353"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="1.002159"
                                 y3="2.348914"
                                 z3="-5.99892"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.314725"
                                 y3="2.883283"
                                 z3="-0.170593"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.9121"
                                 y3="-0.168559"
                                 z3="1.93096"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.967261"
                                 y3="4.880983"
                                 z3="3.478392"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.471872"
                                 y3="0.778678"
                                 z3="-4.093504"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.439546"
                                 y3="-0.11104"
                                 z3="5.401332"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.206914"
                                 y3="2.299723"
                                 z3="2.408931"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.514457"
                                 y3="2.973181"
                                 z3="-3.084161"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.484056"
                                 y3="1.347696"
                                 z3="3.796319"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.475674"
                                 y3="5.381251"
                                 z3="0.07631"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.655282"
                                 y3="6.707089"
                                 z3="1.239481"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.80736"
                                 y3="2.486355"
                                 z3="1.752082"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.680826"
                                 y3="4.263223"
                                 z3="4.85458"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.301948"
                                 y3="0.941038"
                                 z3="-6.824111"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.713994"
                                 y3="2.944687"
                                 z3="1.792672"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.778523"
                                 y3="1.681435"
                                 z3="1.754524"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.966347"
                                 y3="-0.527926"
                                 z3="-1.956279"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.526396"
                                 y3="-0.257543"
                                 z3="1.533595"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.082078"
                                 y3="1.960969"
                                 z3="7.186478"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.246604"
                                 y3="1.115632"
                                 z3="2.056394"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.053147"
                                 y3="5.744478"
                                 z3="-0.42238"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.889881"
                                 y3="3.631831"
                                 z3="5.652095"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.56717"
                                 y3="3.717681"
                                 z3="-7.040716"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.303873"
                                 y3="3.518479"
                                 z3="-3.670504"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.776728"
                                 y3="4.729269"
                                 z3="3.784468"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.037978"
                                 y3="0.917465"
                                 z3="0.357016"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.474954"
                                 y3="4.140757"
                                 z3="-0.477866"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.411311"
                                 y3="2.19595"
                                 z3="-2.076122"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.262031"
                                 y3="0.623947"
                                 z3="-2.245196"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.722635"
                                 y3="2.584107"
                                 z3="-4.688609"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.442283"
                                 y3="2.550253"
                                 z3="0.398641"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.439183"
                                 y3="3.882141"
                                 z3="3.041931"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.930599"
                                 y3="4.317461"
                                 z3="-3.797868"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.936103"
                                 y3="-1.680169"
                                 z3="0.026435"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.137173"
                                 y3="3.464356"
                                 z3="-3.484249"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.036172"
                                 y3="1.139435"
                                 z3="-2.594519"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.523884"
                                 y3="4.737176"
                                 z3="-3.178883"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.357195"
                                 y3="3.423537"
                                 z3="-1.049246"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.470956"
                                 y3="5.846504"
                                 z3="-1.31028"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.410444"
                                 y3="4.018752"
                                 z3="0.831633"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.31248"
                                 y3="1.011774"
                                 z3="5.755124"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.004038"
                                 y3="-0.967766"
                                 z3="1.027466"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.559126"
                                 y3="-1.099419"
                                 z3="-1.168396"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.769048"
                                 y3="-2.638889"
                                 z3="-0.051507"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.928345"
                                 y3="3.794179"
                                 z3="5.709717"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.749435"
                                 y3="4.013533"
                                 z3="-4.322701"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9752,1.0382,-2.4056;.0022,-.5517,.0732;-.5801,5.2414,-2.2981;-.6939,4.2791,1.1815;-.9884,-1.9411,.4885;.9067,1.5497,5.7003;3.2303,2.2733,-2.5382;2.719,1.2805,6.4875;2.7559,2.1656,-6.2178;-.134,2.449,4.3693;3.5435,2.4578,1.3697;1.5938,1.2568,-.226;-.7333,6.1155,-.8727;.1308,-.536,-1.7374;1.0022,2.3489,-5.9989;.3147,2.8833,-.1706;.9121,-.1686,1.931;.9673,4.881,3.4784;1.4719,.7787,-4.0935;.4395,-.111,5.4013;-2.2069,2.2997,2.4089;-1.5145,2.9732,-3.0842;2.4841,1.3477,3.7963;-2.4757,5.3813,.0763;-2.6553,6.7071,1.2395;.8074,2.4864,1.7521;1.6808,4.2632,4.8546;.3019,.941,-6.8241;-2.714,2.9447,1.7927;-1.7785,1.6814,1.7545;2.9663,-.5279,-1.9563;3.5264,-.2575,1.5336;.0821,1.961,7.1865;2.2466,1.1156,2.0564;.0531,5.7445,-.4224;2.8899,3.6318,5.6521;.5672,3.7177,-7.0407;2.3039,3.5185,-3.6705;-1.7767,4.7293,3.7845;-1.038,.9175,.357;1.475,4.1408,-.4779;.4113,2.1959,-2.0761;-1.262,.6239,-2.2452;-.7226,2.5841,-4.6886;3.4423,2.5503,.3986;-.4392,3.8821,3.0419;.9306,4.3175,-3.7979;1.9361,-1.6802,.0264;-3.1372,3.4644,-3.4842;-2.0362,1.1394,-2.5945;-.5239,4.7372,-3.1789;-1.3572,3.4235,-1.0492;-3.471,5.8465,-1.3103;-3.4104,4.0188,.8316;3.3125,1.0118,5.7551;3.004,-.9678,1.0275;2.5591,-1.0994,-1.1684;1.769,-2.6389,-.0515;1.9283,3.7942,5.7097;1.7494,4.0135,-4.3227;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">14</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">14</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89794936</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00263166</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00067973</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00263166</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00067973</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01180448</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00421461</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.979523"
                                 y3="1.04055"
                                 z3="-2.404287"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.004829"
                                 y3="-0.552404"
                                 z3="0.071549"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.575919"
                                 y3="5.241676"
                                 z3="-2.301973"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.689938"
                                 y3="4.287983"
                                 z3="1.185997"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.984902"
                                 y3="-1.94309"
                                 z3="0.484523"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.905316"
                                 y3="1.545519"
                                 z3="5.701711"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.230797"
                                 y3="2.27992"
                                 z3="-2.535377"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.718079"
                                 y3="1.277102"
                                 z3="6.488685"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.750673"
                                 y3="2.166981"
                                 z3="-6.228964"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.136359"
                                 y3="2.446285"
                                 z3="4.371847"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.539773"
                                 y3="2.460958"
                                 z3="1.371835"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.593458"
                                 y3="1.256847"
                                 z3="-0.22557"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.725683"
                                 y3="6.114423"
                                 z3="-0.878054"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.133862"
                                 y3="-0.535469"
                                 z3="-1.73912"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.996404"
                                 y3="2.34899"
                                 z3="-5.999766"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.313372"
                                 y3="2.882753"
                                 z3="-0.169867"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.911875"
                                 y3="-0.168075"
                                 z3="1.930966"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.966719"
                                 y3="4.878279"
                                 z3="3.486221"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.482881"
                                 y3="0.784385"
                                 z3="-4.094818"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.440273"
                                 y3="-0.115231"
                                 z3="5.39938"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.205401"
                                 y3="2.300256"
                                 z3="2.403444"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.513063"
                                 y3="2.971323"
                                 z3="-3.085991"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.481483"
                                 y3="1.349858"
                                 z3="3.798088"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.470468"
                                 y3="5.38607"
                                 z3="0.075296"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.644424"
                                 y3="6.714212"
                                 z3="1.236565"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.803555"
                                 y3="2.485772"
                                 z3="1.752608"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.677281"
                                 y3="4.261128"
                                 z3="4.862825"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.290144"
                                 y3="0.939696"
                                 z3="-6.816193"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.709963"
                                 y3="2.945562"
                                 z3="1.786431"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.775763"
                                 y3="1.681665"
                                 z3="1.750059"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.971487"
                                 y3="-0.524542"
                                 z3="-1.953681"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.526443"
                                 y3="-0.253808"
                                 z3="1.535015"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.080303"
                                 y3="1.952151"
                                 z3="7.188985"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.244336"
                                 y3="1.117642"
                                 z3="2.058097"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.060885"
                                 y3="5.744934"
                                 z3="-0.426598"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.885348"
                                 y3="3.630266"
                                 z3="5.662817"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.557197"
                                 y3="3.714878"
                                 z3="-7.042063"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.299189"
                                 y3="3.517473"
                                 z3="-3.681262"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.778336"
                                 y3="4.728436"
                                 z3="3.787377"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.03837"
                                 y3="0.914854"
                                 z3="0.355485"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.474411"
                                 y3="4.139446"
                                 z3="-0.477846"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.413957"
                                 y3="2.195276"
                                 z3="-2.07726"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.261253"
                                 y3="0.620243"
                                 z3="-2.242729"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.724403"
                                 y3="2.579875"
                                 z3="-4.687749"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.438997"
                                 y3="2.553544"
                                 z3="0.400788"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.440222"
                                 y3="3.88213"
                                 z3="3.044926"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.923504"
                                 y3="4.313049"
                                 z3="-3.806894"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.937615"
                                 y3="-1.679456"
                                 z3="0.027455"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.137908"
                                 y3="3.461592"
                                 z3="-3.481524"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.032771"
                                 y3="1.13769"
                                 z3="-2.594643"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.526281"
                                 y3="4.729405"
                                 z3="-3.180816"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.358263"
                                 y3="3.422398"
                                 z3="-1.045353"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.46404"
                                 y3="5.853905"
                                 z3="-1.311627"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.410385"
                                 y3="4.028364"
                                 z3="0.831927"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.311789"
                                 y3="1.010735"
                                 z3="5.755725"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.005348"
                                 y3="-0.964438"
                                 z3="1.028786"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.563565"
                                 y3="-1.096534"
                                 z3="-1.167062"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.770353"
                                 y3="-2.638236"
                                 z3="-0.049164"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.923713"
                                 y3="3.792498"
                                 z3="5.718628"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.739079"
                                 y3="4.006355"
                                 z3="-4.333596"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9795,1.0406,-2.4043;.0048,-.5524,.0715;-.5759,5.2417,-2.302;-.6899,4.288,1.186;-.9849,-1.9431,.4845;.9053,1.5455,5.7017;3.2308,2.2799,-2.5354;2.7181,1.2771,6.4887;2.7507,2.167,-6.229;-.1364,2.4463,4.3718;3.5398,2.461,1.3718;1.5935,1.2568,-.2256;-.7257,6.1144,-.8781;.1339,-.5355,-1.7391;.9964,2.349,-5.9998;.3134,2.8828,-.1699;.9119,-.1681,1.931;.9667,4.8783,3.4862;1.4829,.7844,-4.0948;.4403,-.1152,5.3994;-2.2054,2.3003,2.4034;-1.5131,2.9713,-3.086;2.4815,1.3499,3.7981;-2.4705,5.3861,.0753;-2.6444,6.7142,1.2366;.8036,2.4858,1.7526;1.6773,4.2611,4.8628;.2901,.9397,-6.8162;-2.71,2.9456,1.7864;-1.7758,1.6817,1.7501;2.9715,-.5245,-1.9537;3.5264,-.2538,1.535;.0803,1.9522,7.189;2.2443,1.1176,2.0581;.0609,5.7449,-.4266;2.8853,3.6303,5.6628;.5572,3.7149,-7.0421;2.2992,3.5175,-3.6813;-1.7783,4.7284,3.7874;-1.0384,.9149,.3555;1.4744,4.1394,-.4778;.414,2.1953,-2.0773;-1.2613,.6202,-2.2427;-.7244,2.5799,-4.6877;3.439,2.5535,.4008;-.4402,3.8821,3.0449;.9235,4.313,-3.8069;1.9376,-1.6795,.0275;-3.1379,3.4616,-3.4815;-2.0328,1.1377,-2.5946;-.5263,4.7294,-3.1808;-1.3583,3.4224,-1.0454;-3.464,5.8539,-1.3116;-3.4104,4.0284,.8319;3.3118,1.0107,5.7557;3.0053,-.9644,1.0288;2.5636,-1.0965,-1.1671;1.7704,-2.6382,-.0492;1.9237,3.7925,5.7186;1.7391,4.0064,-4.3336;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">15</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">15</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89799712</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00245008</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00057652</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00245008</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00057652</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01092840</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00265778</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.980844"
                                 y3="1.041414"
                                 z3="-2.404542"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.006671"
                                 y3="-0.553694"
                                 z3="0.070296"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.576694"
                                 y3="5.238969"
                                 z3="-2.294474"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.687333"
                                 y3="4.292133"
                                 z3="1.187183"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.982273"
                                 y3="-1.94518"
                                 z3="0.482588"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.904816"
                                 y3="1.544504"
                                 z3="5.702087"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.230241"
                                 y3="2.283051"
                                 z3="-2.534559"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.717843"
                                 y3="1.277008"
                                 z3="6.488762"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.748485"
                                 y3="2.168387"
                                 z3="-6.233046"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.137267"
                                 y3="2.445761"
                                 z3="4.372696"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.537672"
                                 y3="2.462384"
                                 z3="1.37228"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.593471"
                                 y3="1.256243"
                                 z3="-0.225945"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.723144"
                                 y3="6.109986"
                                 z3="-0.888133"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.13538"
                                 y3="-0.536467"
                                 z3="-1.740375"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.994996"
                                 y3="2.35237"
                                 z3="-5.998869"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.312623"
                                 y3="2.881571"
                                 z3="-0.169879"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.91233"
                                 y3="-0.168561"
                                 z3="1.930589"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.967931"
                                 y3="4.87677"
                                 z3="3.488638"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.485797"
                                 y3="0.788211"
                                 z3="-4.095948"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.44059"
                                 y3="-0.116384"
                                 z3="5.39903"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.206657"
                                 y3="2.303695"
                                 z3="2.401413"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.513255"
                                 y3="2.970214"
                                 z3="-3.085873"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.480188"
                                 y3="1.350744"
                                 z3="3.798517"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.46722"
                                 y3="5.387662"
                                 z3="0.073526"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.634786"
                                 y3="6.718388"
                                 z3="1.232732"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.801598"
                                 y3="2.484638"
                                 z3="1.752017"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.67468"
                                 y3="4.260965"
                                 z3="4.865095"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.284675"
                                 y3="0.944389"
                                 z3="-6.814524"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.711011"
                                 y3="2.950484"
                                 z3="1.786116"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.778724"
                                 y3="1.684768"
                                 z3="1.747019"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.973485"
                                 y3="-0.523428"
                                 z3="-1.954539"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.527063"
                                 y3="-0.252347"
                                 z3="1.535499"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.07965"
                                 y3="1.949703"
                                 z3="7.189696"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.243609"
                                 y3="1.118019"
                                 z3="2.058475"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.064049"
                                 y3="5.740853"
                                 z3="-0.437526"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.882726"
                                 y3="3.630883"
                                 z3="5.66595"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.555246"
                                 y3="3.719716"
                                 z3="-7.039319"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.296947"
                                 y3="3.512122"
                                 z3="-3.680213"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.777593"
                                 y3="4.729311"
                                 z3="3.788239"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.038124"
                                 y3="0.912549"
                                 z3="0.354428"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.473576"
                                 y3="4.138138"
                                 z3="-0.478621"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.414406"
                                 y3="2.194791"
                                 z3="-2.077555"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.259117"
                                 y3="0.616741"
                                 z3="-2.244925"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.723613"
                                 y3="2.581021"
                                 z3="-4.686061"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.436882"
                                 y3="2.554974"
                                 z3="0.401218"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.439876"
                                 y3="3.88252"
                                 z3="3.04564"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.919685"
                                 y3="4.305695"
                                 z3="-3.803274"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.939459"
                                 y3="-1.678892"
                                 z3="0.026895"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.139393"
                                 y3="3.459783"
                                 z3="-3.479145"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.03037"
                                 y3="1.134387"
                                 z3="-2.596795"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.527676"
                                 y3="4.726483"
                                 z3="-3.174013"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.360727"
                                 y3="3.418852"
                                 z3="-1.042996"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.461973"
                                 y3="5.856338"
                                 z3="-1.312391"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.409399"
                                 y3="4.033734"
                                 z3="0.833852"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.31157"
                                 y3="1.011176"
                                 z3="5.755626"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.006767"
                                 y3="-0.963031"
                                 z3="1.028724"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.565767"
                                 y3="-1.095169"
                                 z3="-1.167857"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.772599"
                                 y3="-2.637811"
                                 z3="-0.048831"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.921035"
                                 y3="3.792961"
                                 z3="5.721322"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.734577"
                                 y3="3.999554"
                                 z3="-4.331726"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9808,1.0414,-2.4045;.0067,-.5537,.0703;-.5767,5.239,-2.2945;-.6873,4.2921,1.1872;-.9823,-1.9452,.4826;.9048,1.5445,5.7021;3.2302,2.2831,-2.5346;2.7178,1.277,6.4888;2.7485,2.1684,-6.233;-.1373,2.4458,4.3727;3.5377,2.4624,1.3723;1.5935,1.2562,-.2259;-.7231,6.11,-.8881;.1354,-.5365,-1.7404;.995,2.3524,-5.9989;.3126,2.8816,-.1699;.9123,-.1686,1.9306;.9679,4.8768,3.4886;1.4858,.7882,-4.0959;.4406,-.1164,5.399;-2.2067,2.3037,2.4014;-1.5133,2.9702,-3.0859;2.4802,1.3507,3.7985;-2.4672,5.3877,.0735;-2.6348,6.7184,1.2327;.8016,2.4846,1.752;1.6747,4.261,4.8651;.2847,.9444,-6.8145;-2.711,2.9505,1.7861;-1.7787,1.6848,1.747;2.9735,-.5234,-1.9545;3.5271,-.2523,1.5355;.0796,1.9497,7.1897;2.2436,1.118,2.0585;.064,5.7409,-.4375;2.8827,3.6309,5.6659;.5552,3.7197,-7.0393;2.2969,3.5121,-3.6802;-1.7776,4.7293,3.7882;-1.0381,.9125,.3544;1.4736,4.1381,-.4786;.4144,2.1948,-2.0776;-1.2591,.6167,-2.2449;-.7236,2.581,-4.6861;3.4369,2.555,.4012;-.4399,3.8825,3.0456;.9197,4.3057,-3.8033;1.9395,-1.6789,.0269;-3.1394,3.4598,-3.4791;-2.0304,1.1344,-2.5968;-.5277,4.7265,-3.174;-1.3607,3.4189,-1.043;-3.462,5.8563,-1.3124;-3.4094,4.0337,.8339;3.3116,1.0112,5.7556;3.0068,-.963,1.0287;2.5658,-1.0952,-1.1679;1.7726,-2.6378,-.0488;1.921,3.793,5.7213;1.7346,3.9996,-4.3317;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">16</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">16</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89803594</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00249212</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00054604</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00249212</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00054604</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00767095</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00216003</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.981545"
                                 y3="1.041842"
                                 z3="-2.405259"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.008634"
                                 y3="-0.555399"
                                 z3="0.069237"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.571592"
                                 y3="5.236824"
                                 z3="-2.292296"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.683699"
                                 y3="4.295956"
                                 z3="1.188019"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.979251"
                                 y3="-1.947662"
                                 z3="0.481603"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.903055"
                                 y3="1.543975"
                                 z3="5.702272"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.230186"
                                 y3="2.284593"
                                 z3="-2.532983"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.716032"
                                 y3="1.27804"
                                 z3="6.489346"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.745838"
                                 y3="2.167859"
                                 z3="-6.240239"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.138492"
                                 y3="2.445786"
                                 z3="4.37316"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.535623"
                                 y3="2.463459"
                                 z3="1.373196"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.594005"
                                 y3="1.254938"
                                 z3="-0.226192"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.719798"
                                 y3="6.112557"
                                 z3="-0.890083"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.136802"
                                 y3="-0.53849"
                                 z3="-1.741432"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.99375"
                                 y3="2.354633"
                                 z3="-6.000013"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.312566"
                                 y3="2.879865"
                                 z3="-0.169987"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.912925"
                                 y3="-0.16958"
                                 z3="1.93065"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.970154"
                                 y3="4.874976"
                                 z3="3.490962"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.485433"
                                 y3="0.792322"
                                 z3="-4.097004"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.439851"
                                 y3="-0.117268"
                                 z3="5.399281"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.206526"
                                 y3="2.306031"
                                 z3="2.401086"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.513833"
                                 y3="2.968825"
                                 z3="-3.085029"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.478358"
                                 y3="1.351283"
                                 z3="3.799341"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.463568"
                                 y3="5.388035"
                                 z3="0.072835"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.627115"
                                 y3="6.718003"
                                 z3="1.233331"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.799789"
                                 y3="2.482982"
                                 z3="1.751076"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.670373"
                                 y3="4.260873"
                                 z3="4.86585"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.279494"
                                 y3="0.94647"
                                 z3="-6.812934"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.712475"
                                 y3="2.953356"
                                 z3="1.787547"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.780634"
                                 y3="1.686001"
                                 z3="1.746274"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.974611"
                                 y3="-0.52342"
                                 z3="-1.957321"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.527981"
                                 y3="-0.251749"
                                 z3="1.537149"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.076938"
                                 y3="1.948542"
                                 z3="7.189571"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.243162"
                                 y3="1.117619"
                                 z3="2.059193"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.067447"
                                 y3="5.746091"
                                 z3="-0.437401"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.878047"
                                 y3="3.632498"
                                 z3="5.668328"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.552084"
                                 y3="3.722331"
                                 z3="-7.040053"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.296419"
                                 y3="3.512464"
                                 z3="-3.6835"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.77601"
                                 y3="4.730548"
                                 z3="3.788679"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.037312"
                                 y3="0.91008"
                                 z3="0.3537"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.47347"
                                 y3="4.136369"
                                 z3="-0.479436"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.414292"
                                 y3="2.194486"
                                 z3="-2.07702"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.258874"
                                 y3="0.613295"
                                 z3="-2.247368"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.722518"
                                 y3="2.581785"
                                 z3="-4.683914"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.434594"
                                 y3="2.556244"
                                 z3="0.402165"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.438763"
                                 y3="3.883198"
                                 z3="3.045872"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.915857"
                                 y3="4.301859"
                                 z3="-3.803902"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.942108"
                                 y3="-1.677689"
                                 z3="0.026004"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.140844"
                                 y3="3.457974"
                                 z3="-3.476617"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.03113"
                                 y3="1.13101"
                                 z3="-2.596627"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.525156"
                                 y3="4.72253"
                                 z3="-3.172092"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.362939"
                                 y3="3.414285"
                                 z3="-1.040337"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.459244"
                                 y3="5.859673"
                                 z3="-1.311532"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.406671"
                                 y3="4.034868"
                                 z3="0.833199"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.310079"
                                 y3="1.012247"
                                 z3="5.756454"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.008415"
                                 y3="-0.962634"
                                 z3="1.029853"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.567707"
                                 y3="-1.094008"
                                 z3="-1.169747"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.776218"
                                 y3="-2.636878"
                                 z3="-0.048386"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.916232"
                                 y3="3.794235"
                                 z3="5.722925"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.730072"
                                 y3="3.995109"
                                 z3="-4.335258"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9815,1.0418,-2.4053;.0086,-.5554,.0692;-.5716,5.2368,-2.2923;-.6837,4.296,1.188;-.9793,-1.9477,.4816;.9031,1.544,5.7023;3.2302,2.2846,-2.533;2.716,1.278,6.4893;2.7458,2.1679,-6.2402;-.1385,2.4458,4.3732;3.5356,2.4635,1.3732;1.594,1.2549,-.2262;-.7198,6.1126,-.8901;.1368,-.5385,-1.7414;.9938,2.3546,-6;.3126,2.8799,-.17;.9129,-.1696,1.9306;.9702,4.875,3.491;1.4854,.7923,-4.097;.4399,-.1173,5.3993;-2.2065,2.306,2.4011;-1.5138,2.9688,-3.085;2.4784,1.3513,3.7993;-2.4636,5.388,.0728;-2.6271,6.718,1.2333;.7998,2.483,1.7511;1.6704,4.2609,4.8659;.2795,.9465,-6.8129;-2.7125,2.9534,1.7875;-1.7806,1.686,1.7463;2.9746,-.5234,-1.9573;3.528,-.2517,1.5371;.0769,1.9485,7.1896;2.2432,1.1176,2.0592;.0674,5.7461,-.4374;2.878,3.6325,5.6683;.5521,3.7223,-7.0401;2.2964,3.5125,-3.6835;-1.776,4.7305,3.7887;-1.0373,.9101,.3537;1.4735,4.1364,-.4794;.4143,2.1945,-2.077;-1.2589,.6133,-2.2474;-.7225,2.5818,-4.6839;3.4346,2.5562,.4022;-.4388,3.8832,3.0459;.9159,4.3019,-3.8039;1.9421,-1.6777,.026;-3.1408,3.458,-3.4766;-2.0311,1.131,-2.5966;-.5252,4.7225,-3.1721;-1.3629,3.4143,-1.0403;-3.4592,5.8597,-1.3115;-3.4067,4.0349,.8332;3.3101,1.0122,5.7565;3.0084,-.9626,1.0299;2.5677,-1.094,-1.1697;1.7762,-2.6369,-.0484;1.9162,3.7942,5.7229;1.7301,3.9951,-4.3353;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">17</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">17</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89805664</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00244298</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00048284</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00244298</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00048284</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.01297394</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00330756</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.980899"
                                 y3="1.042519"
                                 z3="-2.406434"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.011243"
                                 y3="-0.556912"
                                 z3="0.069394"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.569871"
                                 y3="5.235487"
                                 z3="-2.288957"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.679181"
                                 y3="4.30066"
                                 z3="1.188769"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.974555"
                                 y3="-1.950336"
                                 z3="0.483268"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.898994"
                                 y3="1.542486"
                                 z3="5.701157"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.229531"
                                 y3="2.285422"
                                 z3="-2.531805"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.710892"
                                 y3="1.276711"
                                 z3="6.490579"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.741831"
                                 y3="2.168085"
                                 z3="-6.246813"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.140121"
                                 y3="2.446624"
                                 z3="4.37251"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.533803"
                                 y3="2.466085"
                                 z3="1.374345"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.595004"
                                 y3="1.25374"
                                 z3="-0.226212"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.714265"
                                 y3="6.107261"
                                 z3="-0.897077"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.137892"
                                 y3="-0.540942"
                                 z3="-1.741385"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.99136"
                                 y3="2.357208"
                                 z3="-6.001408"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.312677"
                                 y3="2.878227"
                                 z3="-0.169919"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.91474"
                                 y3="-0.17006"
                                 z3="1.931873"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.972743"
                                 y3="4.874613"
                                 z3="3.493315"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.481636"
                                 y3="0.796115"
                                 z3="-4.097661"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.436775"
                                 y3="-0.118588"
                                 z3="5.395263"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.202043"
                                 y3="2.30843"
                                 z3="2.394097"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.51658"
                                 y3="2.967105"
                                 z3="-3.082448"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.476778"
                                 y3="1.353026"
                                 z3="3.800667"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.458293"
                                 y3="5.388919"
                                 z3="0.072103"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.614142"
                                 y3="6.720591"
                                 z3="1.23152"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.798371"
                                 y3="2.481998"
                                 z3="1.750286"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.667295"
                                 y3="4.260805"
                                 z3="4.871068"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.275069"
                                 y3="0.947779"
                                 z3="-6.811614"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.704855"
                                 y3="2.954926"
                                 z3="1.776764"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.773989"
                                 y3="1.686208"
                                 z3="1.743035"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.974984"
                                 y3="-0.523321"
                                 z3="-1.961692"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.530214"
                                 y3="-0.249719"
                                 z3="1.539345"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.069763"
                                 y3="1.944706"
                                 z3="7.187481"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.24354"
                                 y3="1.118051"
                                 z3="2.060348"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.071981"
                                 y3="5.741377"
                                 z3="-0.44214"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.872008"
                                 y3="3.632302"
                                 z3="5.67746"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.546962"
                                 y3="3.725435"
                                 z3="-7.040769"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.294664"
                                 y3="3.514247"
                                 z3="-3.686926"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.77463"
                                 y3="4.732422"
                                 z3="3.788255"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.035726"
                                 y3="0.9076"
                                 z3="0.354873"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.473302"
                                 y3="4.134782"
                                 z3="-0.480642"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.412536"
                                 y3="2.194068"
                                 z3="-2.075652"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.258629"
                                 y3="0.612215"
                                 z3="-2.247359"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.724819"
                                 y3="2.581855"
                                 z3="-4.681625"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.431997"
                                 y3="2.559467"
                                 z3="0.403443"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.437134"
                                 y3="3.885318"
                                 z3="3.045485"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.910243"
                                 y3="4.298454"
                                 z3="-3.80479"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.946353"
                                 y3="-1.674965"
                                 z3="0.025685"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.143908"
                                 y3="3.455872"
                                 z3="-3.472495"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.033862"
                                 y3="1.12793"
                                 z3="-2.59294"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.523536"
                                 y3="4.719738"
                                 z3="-3.168582"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.365351"
                                 y3="3.408852"
                                 z3="-1.035816"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.455272"
                                 y3="5.863005"
                                 z3="-1.310644"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.405173"
                                 y3="4.040486"
                                 z3="0.836376"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.30616"
                                 y3="1.01171"
                                 z3="5.758399"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.011509"
                                 y3="-0.96019"
                                 z3="1.030256"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.569981"
                                 y3="-1.092238"
                                 z3="-1.172356"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.782041"
                                 y3="-2.63459"
                                 z3="-0.046715"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.910016"
                                 y3="3.794128"
                                 z3="5.729041"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.723854"
                                 y3="3.990859"
                                 z3="-4.33939"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9809,1.0425,-2.4064;.0112,-.5569,.0694;-.5699,5.2355,-2.289;-.6792,4.3007,1.1888;-.9746,-1.9503,.4833;.899,1.5425,5.7012;3.2295,2.2854,-2.5318;2.7109,1.2767,6.4906;2.7418,2.1681,-6.2468;-.1401,2.4466,4.3725;3.5338,2.4661,1.3743;1.595,1.2537,-.2262;-.7143,6.1073,-.8971;.1379,-.5409,-1.7414;.9914,2.3572,-6.0014;.3127,2.8782,-.1699;.9147,-.1701,1.9319;.9727,4.8746,3.4933;1.4816,.7961,-4.0977;.4368,-.1186,5.3953;-2.202,2.3084,2.3941;-1.5166,2.9671,-3.0824;2.4768,1.353,3.8007;-2.4583,5.3889,.0721;-2.6141,6.7206,1.2315;.7984,2.482,1.7503;1.6673,4.2608,4.8711;.2751,.9478,-6.8116;-2.7049,2.9549,1.7768;-1.774,1.6862,1.743;2.975,-.5233,-1.9617;3.5302,-.2497,1.5393;.0698,1.9447,7.1875;2.2435,1.1181,2.0603;.072,5.7414,-.4421;2.872,3.6323,5.6775;.547,3.7254,-7.0408;2.2947,3.5142,-3.6869;-1.7746,4.7324,3.7883;-1.0357,.9076,.3549;1.4733,4.1348,-.4806;.4125,2.1941,-2.0757;-1.2586,.6122,-2.2474;-.7248,2.5819,-4.6816;3.432,2.5595,.4034;-.4371,3.8853,3.0455;.9102,4.2985,-3.8048;1.9464,-1.675,.0257;-3.1439,3.4559,-3.4725;-2.0339,1.1279,-2.5929;-.5235,4.7197,-3.1686;-1.3654,3.4089,-1.0358;-3.4553,5.863,-1.3106;-3.4052,4.0405,.8364;3.3062,1.0117,5.7584;3.0115,-.9602,1.0303;2.57,-1.0922,-1.1724;1.782,-2.6346,-.0467;1.91,3.7941,5.729;1.7239,3.9909,-4.3394;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">18</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">18</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89805257</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00203812</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00037343</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00203812</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00037343</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00977055</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00151971</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.980883"
                                 y3="1.042276"
                                 z3="-2.406998"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.011688"
                                 y3="-0.557233"
                                 z3="0.0689"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.569865"
                                 y3="5.235392"
                                 z3="-2.291761"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.679445"
                                 y3="4.300356"
                                 z3="1.188281"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.973636"
                                 y3="-1.950867"
                                 z3="0.483073"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.898961"
                                 y3="1.54249"
                                 z3="5.700474"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.229531"
                                 y3="2.28487"
                                 z3="-2.532959"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.710884"
                                 y3="1.276073"
                                 z3="6.489841"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.743481"
                                 y3="2.169289"
                                 z3="-6.244501"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.139753"
                                 y3="2.447154"
                                 z3="4.372062"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.533968"
                                 y3="2.466246"
                                 z3="1.374075"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.595289"
                                 y3="1.253457"
                                 z3="-0.226688"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.714146"
                                 y3="6.109671"
                                 z3="-0.89406"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.138228"
                                 y3="-0.541313"
                                 z3="-1.741833"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.992154"
                                 y3="2.35687"
                                 z3="-6.001156"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.312932"
                                 y3="2.878047"
                                 z3="-0.170399"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.915155"
                                 y3="-0.170371"
                                 z3="1.931519"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.97375"
                                 y3="4.874598"
                                 z3="3.492596"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.481654"
                                 y3="0.794607"
                                 z3="-4.097879"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.436413"
                                 y3="-0.118435"
                                 z3="5.394299"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.205036"
                                 y3="2.310449"
                                 z3="2.400009"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.516879"
                                 y3="2.966739"
                                 z3="-3.082913"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.477036"
                                 y3="1.35285"
                                 z3="3.800187"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.458514"
                                 y3="5.388495"
                                 z3="0.071917"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.617337"
                                 y3="6.718754"
                                 z3="1.232543"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.798336"
                                 y3="2.481811"
                                 z3="1.750042"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.66819"
                                 y3="4.260674"
                                 z3="4.870531"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.277358"
                                 y3="0.94763"
                                 z3="-6.812495"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.711368"
                                 y3="2.957961"
                                 z3="1.786534"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.780472"
                                 y3="1.688571"
                                 z3="1.746277"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.975344"
                                 y3="-0.523389"
                                 z3="-1.962288"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.530706"
                                 y3="-0.249475"
                                 z3="1.538642"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.069943"
                                 y3="1.944607"
                                 z3="7.186969"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.243797"
                                 y3="1.117872"
                                 z3="2.059922"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.071877"
                                 y3="5.74356"
                                 z3="-0.438866"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.872665"
                                 y3="3.631786"
                                 z3="5.676994"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.548309"
                                 y3="3.724874"
                                 z3="-7.040583"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.294249"
                                 y3="3.512077"
                                 z3="-3.685541"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.773178"
                                 y3="4.733757"
                                 z3="3.7886"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.035283"
                                 y3="0.907088"
                                 z3="0.354292"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.473857"
                                 y3="4.134431"
                                 z3="-0.480891"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.412277"
                                 y3="2.193494"
                                 z3="-2.076177"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.259162"
                                 y3="0.613406"
                                 z3="-2.246938"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.726794"
                                 y3="2.580267"
                                 z3="-4.683172"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.432028"
                                 y3="2.560073"
                                 z3="0.403237"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.436646"
                                 y3="3.885909"
                                 z3="3.044965"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.911339"
                                 y3="4.298424"
                                 z3="-3.804225"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.947247"
                                 y3="-1.674911"
                                 z3="0.025495"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.1437"
                                 y3="3.455983"
                                 z3="-3.473195"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.034624"
                                 y3="1.128683"
                                 z3="-2.592814"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.524081"
                                 y3="4.719878"
                                 z3="-3.1715"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.364216"
                                 y3="3.409759"
                                 z3="-1.036408"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.454237"
                                 y3="5.862823"
                                 z3="-1.311638"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.405038"
                                 y3="4.037832"
                                 z3="0.832688"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.30609"
                                 y3="1.011002"
                                 z3="5.75764"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.012067"
                                 y3="-0.959555"
                                 z3="1.02881"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.570686"
                                 y3="-1.092505"
                                 z3="-1.172892"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.783195"
                                 y3="-2.6346"
                                 z3="-0.046798"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.910709"
                                 y3="3.793863"
                                 z3="5.728472"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.724836"
                                 y3="3.98992"
                                 z3="-4.338127"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9809,1.0423,-2.407;.0117,-.5572,.0689;-.5699,5.2354,-2.2918;-.6794,4.3004,1.1883;-.9736,-1.9509,.4831;.899,1.5425,5.7005;3.2295,2.2849,-2.533;2.7109,1.2761,6.4898;2.7435,2.1693,-6.2445;-.1398,2.4472,4.3721;3.534,2.4662,1.3741;1.5953,1.2535,-.2267;-.7141,6.1097,-.8941;.1382,-.5413,-1.7418;.9922,2.3569,-6.0012;.3129,2.878,-.1704;.9152,-.1704,1.9315;.9738,4.8746,3.4926;1.4817,.7946,-4.0979;.4364,-.1184,5.3943;-2.205,2.3104,2.4;-1.5169,2.9667,-3.0829;2.477,1.3529,3.8002;-2.4585,5.3885,.0719;-2.6173,6.7188,1.2325;.7983,2.4818,1.75;1.6682,4.2607,4.8705;.2774,.9476,-6.8125;-2.7114,2.958,1.7865;-1.7805,1.6886,1.7463;2.9753,-.5234,-1.9623;3.5307,-.2495,1.5386;.0699,1.9446,7.187;2.2438,1.1179,2.0599;.0719,5.7436,-.4389;2.8727,3.6318,5.677;.5483,3.7249,-7.0406;2.2942,3.5121,-3.6855;-1.7732,4.7338,3.7886;-1.0353,.9071,.3543;1.4739,4.1344,-.4809;.4123,2.1935,-2.0762;-1.2592,.6134,-2.2469;-.7268,2.5803,-4.6832;3.432,2.5601,.4032;-.4366,3.8859,3.045;.9113,4.2984,-3.8042;1.9472,-1.6749,.0255;-3.1437,3.456,-3.4732;-2.0346,1.1287,-2.5928;-.5241,4.7199,-3.1715;-1.3642,3.4098,-1.0364;-3.4542,5.8628,-1.3116;-3.405,4.0378,.8327;3.3061,1.011,5.7576;3.0121,-.9596,1.0288;2.5707,-1.0925,-1.1729;1.7832,-2.6346,-.0468;1.9107,3.7939,5.7285;1.7248,3.9899,-4.3381;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">19</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">19</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89804970</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00143335</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00032083</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00143335</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00032083</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00584280</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00175609</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.980462"
                                 y3="1.042146"
                                 z3="-2.407968"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.0131"
                                 y3="-0.557882"
                                 z3="0.068856"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.570009"
                                 y3="5.234564"
                                 z3="-2.292044"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.677044"
                                 y3="4.303441"
                                 z3="1.188038"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.970672"
                                 y3="-1.95228"
                                 z3="0.484385"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.896203"
                                 y3="1.541529"
                                 z3="5.699106"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.229007"
                                 y3="2.284587"
                                 z3="-2.534079"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.707436"
                                 y3="1.274376"
                                 z3="6.490159"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.742271"
                                 y3="2.171513"
                                 z3="-6.245688"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.140573"
                                 y3="2.448083"
                                 z3="4.370976"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.533174"
                                 y3="2.467975"
                                 z3="1.374733"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.596115"
                                 y3="1.252452"
                                 z3="-0.226958"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.711482"
                                 y3="6.11012"
                                 z3="-0.895483"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.138654"
                                 y3="-0.542661"
                                 z3="-1.741925"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.991219"
                                 y3="2.357867"
                                 z3="-6.001248"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.313614"
                                 y3="2.877219"
                                 z3="-0.170773"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.916279"
                                 y3="-0.170473"
                                 z3="1.932283"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.975378"
                                 y3="4.874878"
                                 z3="3.493361"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.479945"
                                 y3="0.794702"
                                 z3="-4.098273"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.434025"
                                 y3="-0.119074"
                                 z3="5.390416"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.202131"
                                 y3="2.311552"
                                 z3="2.397259"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.518595"
                                 y3="2.965443"
                                 z3="-3.081838"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.476425"
                                 y3="1.353847"
                                 z3="3.800714"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.455692"
                                 y3="5.389322"
                                 z3="0.071534"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.613565"
                                 y3="6.719387"
                                 z3="1.232449"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.797611"
                                 y3="2.481412"
                                 z3="1.749587"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.667869"
                                 y3="4.260375"
                                 z3="4.873618"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.276845"
                                 y3="0.948053"
                                 z3="-6.81171"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.708029"
                                 y3="2.957803"
                                 z3="1.781874"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.776241"
                                 y3="1.688789"
                                 z3="1.745504"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.975678"
                                 y3="-0.523697"
                                 z3="-1.964977"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.532213"
                                 y3="-0.248158"
                                 z3="1.539725"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.065526"
                                 y3="1.941748"
                                 z3="7.185288"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.244204"
                                 y3="1.118068"
                                 z3="2.060473"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.074249"
                                 y3="5.744364"
                                 z3="-0.439455"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.8700"
                                 y3="3.630608"
                                 z3="5.682837"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.545248"
                                 y3="3.725411"
                                 z3="-7.040082"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.29147"
                                 y3="3.510579"
                                 z3="-3.685905"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.772108"
                                 y3="4.735688"
                                 z3="3.787867"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.03426"
                                 y3="0.90581"
                                 z3="0.354756"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.475099"
                                 y3="4.133093"
                                 z3="-0.481662"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.411188"
                                 y3="2.192469"
                                 z3="-2.075981"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.259578"
                                 y3="0.614636"
                                 z3="-2.244163"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.731433"
                                 y3="2.578074"
                                 z3="-4.683184"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.4305"
                                 y3="2.562873"
                                 z3="0.404093"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.435698"
                                 y3="3.887883"
                                 z3="3.043924"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.908234"
                                 y3="4.297065"
                                 z3="-3.805111"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.949863"
                                 y3="-1.673319"
                                 z3="0.025484"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.145166"
                                 y3="3.455475"
                                 z3="-3.471057"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.036289"
                                 y3="1.1282"
                                 z3="-2.589839"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.524558"
                                 y3="4.718853"
                                 z3="-3.171877"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.363692"
                                 y3="3.408992"
                                 z3="-1.034497"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.451044"
                                 y3="5.864682"
                                 z3="-1.311983"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.403472"
                                 y3="4.039264"
                                 z3="0.832044"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.303416"
                                 y3="1.009903"
                                 z3="5.758385"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.013835"
                                 y3="-0.958246"
                                 z3="1.029227"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.572333"
                                 y3="-1.0921"
                                 z3="-1.174643"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.786852"
                                 y3="-2.633299"
                                 z3="-0.045367"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.908017"
                                 y3="3.793249"
                                 z3="5.732091"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.721479"
                                 y3="3.986815"
                                 z3="-4.339082"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9805,1.0421,-2.408;.0131,-.5579,.0689;-.57,5.2346,-2.292;-.677,4.3034,1.188;-.9707,-1.9523,.4844;.8962,1.5415,5.6991;3.229,2.2846,-2.5341;2.7074,1.2744,6.4902;2.7423,2.1715,-6.2457;-.1406,2.4481,4.371;3.5332,2.468,1.3747;1.5961,1.2525,-.227;-.7115,6.1101,-.8955;.1387,-.5427,-1.7419;.9912,2.3579,-6.0012;.3136,2.8772,-.1708;.9163,-.1705,1.9323;.9754,4.8749,3.4934;1.4799,.7947,-4.0983;.434,-.1191,5.3904;-2.2021,2.3116,2.3973;-1.5186,2.9654,-3.0818;2.4764,1.3538,3.8007;-2.4557,5.3893,.0715;-2.6136,6.7194,1.2324;.7976,2.4814,1.7496;1.6679,4.2604,4.8736;.2768,.9481,-6.8117;-2.708,2.9578,1.7819;-1.7762,1.6888,1.7455;2.9757,-.5237,-1.965;3.5322,-.2482,1.5397;.0655,1.9417,7.1853;2.2442,1.1181,2.0605;.0742,5.7444,-.4395;2.87,3.6306,5.6828;.5452,3.7254,-7.0401;2.2915,3.5106,-3.6859;-1.7721,4.7357,3.7879;-1.0343,.9058,.3548;1.4751,4.1331,-.4817;.4112,2.1925,-2.076;-1.2596,.6146,-2.2442;-.7314,2.5781,-4.6832;3.4305,2.5629,.4041;-.4357,3.8879,3.0439;.9082,4.2971,-3.8051;1.9499,-1.6733,.0255;-3.1452,3.4555,-3.4711;-2.0363,1.1282,-2.5898;-.5246,4.7189,-3.1719;-1.3637,3.409,-1.0345;-3.451,5.8647,-1.312;-3.4035,4.0393,.832;3.3034,1.0099,5.7584;3.0138,-.9582,1.0292;2.5723,-1.0921,-1.1746;1.7869,-2.6333,-.0454;1.908,3.7932,5.7321;1.7215,3.9868,-4.3391;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">20</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">20</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89804691</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00133171</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00025642</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00133171</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00025642</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00785109</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00267746</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.98021"
                                 y3="1.041966"
                                 z3="-2.409274"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.015532"
                                 y3="-0.559437"
                                 z3="0.067983"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.568672"
                                 y3="5.233774"
                                 z3="-2.293656"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.67341"
                                 y3="4.307921"
                                 z3="1.187484"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.965607"
                                 y3="-1.955204"
                                 z3="0.485384"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.89189"
                                 y3="1.540737"
                                 z3="5.697848"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.228093"
                                 y3="2.284809"
                                 z3="-2.535553"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.702232"
                                 y3="1.272496"
                                 z3="6.491184"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.740522"
                                 y3="2.176553"
                                 z3="-6.247986"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.141893"
                                 y3="2.449831"
                                 z3="4.369907"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.53132"
                                 y3="2.470328"
                                 z3="1.376707"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.597576"
                                 y3="1.250351"
                                 z3="-0.227393"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.706916"
                                 y3="6.106593"
                                 z3="-0.899515"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.139792"
                                 y3="-0.545174"
                                 z3="-1.742801"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.989653"
                                 y3="2.360631"
                                 z3="-6.00069"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.314967"
                                 y3="2.875377"
                                 z3="-0.171131"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.917818"
                                 y3="-0.171433"
                                 z3="1.933159"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.978377"
                                 y3="4.874827"
                                 z3="3.493883"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.47806"
                                 y3="0.796086"
                                 z3="-4.099089"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.429792"
                                 y3="-0.119396"
                                 z3="5.386224"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.199602"
                                 y3="2.314989"
                                 z3="2.394848"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.521328"
                                 y3="2.963324"
                                 z3="-3.079446"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.474896"
                                 y3="1.354353"
                                 z3="3.80191"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.451272"
                                 y3="5.390094"
                                 z3="0.07107"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.606431"
                                 y3="6.7205"
                                 z3="1.231871"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.79591"
                                 y3="2.479851"
                                 z3="1.748877"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.66773"
                                 y3="4.259927"
                                 z3="4.877207"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.276789"
                                 y3="0.949189"
                                 z3="-6.809576"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.704956"
                                 y3="2.960046"
                                 z3="1.777414"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.773261"
                                 y3="1.690333"
                                 z3="1.74547"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.97667"
                                 y3="-0.524104"
                                 z3="-1.969365"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.534555"
                                 y3="-0.246564"
                                 z3="1.54142"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.059344"
                                 y3="1.938871"
                                 z3="7.183673"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.244623"
                                 y3="1.117384"
                                 z3="2.061664"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.078112"
                                 y3="5.740499"
                                 z3="-0.442518"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.86644"
                                 y3="3.628964"
                                 z3="5.690688"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.539467"
                                 y3="3.727293"
                                 z3="-7.038617"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.288397"
                                 y3="3.509871"
                                 z3="-3.68754"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.769739"
                                 y3="4.73941"
                                 z3="3.786947"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.032693"
                                 y3="0.903104"
                                 z3="0.354487"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.477462"
                                 y3="4.130261"
                                 z3="-0.482334"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.409574"
                                 y3="2.190691"
                                 z3="-2.075469"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.261072"
                                 y3="0.614605"
                                 z3="-2.241581"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.73873"
                                 y3="2.575277"
                                 z3="-4.682564"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.427377"
                                 y3="2.567673"
                                 z3="0.406471"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.434221"
                                 y3="3.890876"
                                 z3="3.042292"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.903312"
                                 y3="4.29521"
                                 z3="-3.805881"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.954558"
                                 y3="-1.670901"
                                 z3="0.025139"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.147651"
                                 y3="3.455133"
                                 z3="-3.46677"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.039024"
                                 y3="1.126816"
                                 z3="-2.586445"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.524988"
                                 y3="4.717064"
                                 z3="-3.173017"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.36326"
                                 y3="3.407569"
                                 z3="-1.031632"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.445873"
                                 y3="5.867497"
                                 z3="-1.31236"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.402122"
                                 y3="4.041984"
                                 z3="0.831599"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.299128"
                                 y3="1.008239"
                                 z3="5.760105"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.016863"
                                 y3="-0.955916"
                                 z3="1.028535"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.575425"
                                 y3="-1.091573"
                                 z3="-1.177481"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.79349"
                                 y3="-2.631393"
                                 z3="-0.043465"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.904494"
                                 y3="3.792836"
                                 z3="5.736672"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.715976"
                                 y3="3.983129"
                                 z3="-4.34078"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9802,1.042,-2.4093;.0155,-.5594,.068;-.5687,5.2338,-2.2937;-.6734,4.3079,1.1875;-.9656,-1.9552,.4854;.8919,1.5407,5.6978;3.2281,2.2848,-2.5356;2.7022,1.2725,6.4912;2.7405,2.1766,-6.248;-.1419,2.4498,4.3699;3.5313,2.4703,1.3767;1.5976,1.2504,-.2274;-.7069,6.1066,-.8995;.1398,-.5452,-1.7428;.9897,2.3606,-6.0007;.315,2.8754,-.1711;.9178,-.1714,1.9332;.9784,4.8748,3.4939;1.4781,.7961,-4.0991;.4298,-.1194,5.3862;-2.1996,2.315,2.3948;-1.5213,2.9633,-3.0794;2.4749,1.3544,3.8019;-2.4513,5.3901,.0711;-2.6064,6.7205,1.2319;.7959,2.4799,1.7489;1.6677,4.2599,4.8772;.2768,.9492,-6.8096;-2.705,2.96,1.7774;-1.7733,1.6903,1.7455;2.9767,-.5241,-1.9694;3.5346,-.2466,1.5414;.0593,1.9389,7.1837;2.2446,1.1174,2.0617;.0781,5.7405,-.4425;2.8664,3.629,5.6907;.5395,3.7273,-7.0386;2.2884,3.5099,-3.6875;-1.7697,4.7394,3.7869;-1.0327,.9031,.3545;1.4775,4.1303,-.4823;.4096,2.1907,-2.0755;-1.2611,.6146,-2.2416;-.7387,2.5753,-4.6826;3.4274,2.5677,.4065;-.4342,3.8909,3.0423;.9033,4.2952,-3.8059;1.9546,-1.6709,.0251;-3.1477,3.4551,-3.4668;-2.039,1.1268,-2.5864;-.525,4.7171,-3.173;-1.3633,3.4076,-1.0316;-3.4459,5.8675,-1.3124;-3.4021,4.042,.8316;3.2991,1.0082,5.7601;3.0169,-.9559,1.0285;2.5754,-1.0916,-1.1775;1.7935,-2.6314,-.0435;1.9045,3.7928,5.7367;1.716,3.9831,-4.3408;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">21</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">21</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89801393</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00100541</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">F</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00020303</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00100541</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00020303</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00195702</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00078174</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
                  <module cmlx:templateRef="coordinates">
                     <scalar dataType="xsd:string" dictRef="cc:label">Cartesian</scalar>
                     <molecule id="geometry.cycle">
                        <atomArray>
                           <atom elementType="Mo"
                                 id="a1"
                                 x3="1.980104"
                                 y3="1.041519"
                                 z3="-2.409557"/>
                           <atom elementType="Mo"
                                 id="a2"
                                 x3="0.015626"
                                 y3="-0.559969"
                                 z3="0.067149"/>
                           <atom elementType="H"
                                 id="a3"
                                 x3="-0.568298"
                                 y3="5.232636"
                                 z3="-2.292859"/>
                           <atom elementType="O"
                                 id="a4"
                                 x3="-0.672942"
                                 y3="4.308879"
                                 z3="1.186967"/>
                           <atom elementType="O"
                                 id="a5"
                                 x3="-0.96482"
                                 y3="-1.956097"
                                 z3="0.484999"/>
                           <atom elementType="Mo"
                                 id="a6"
                                 x3="0.891245"
                                 y3="1.54151"
                                 z3="5.698165"/>
                           <atom elementType="O"
                                 id="a7"
                                 x3="3.227508"
                                 y3="2.284836"
                                 z3="-2.536224"/>
                           <atom elementType="O"
                                 id="a8"
                                 x3="2.701745"
                                 y3="1.273356"
                                 z3="6.491502"/>
                           <atom elementType="O"
                                 id="a9"
                                 x3="2.74093"
                                 y3="2.17851"
                                 z3="-6.248581"/>
                           <atom elementType="O"
                                 id="a10"
                                 x3="-0.142139"
                                 y3="2.450376"
                                 z3="4.369973"/>
                           <atom elementType="O"
                                 id="a11"
                                 x3="3.530163"
                                 y3="2.470603"
                                 z3="1.377624"/>
                           <atom elementType="O"
                                 id="a12"
                                 x3="1.597734"
                                 y3="1.249263"
                                 z3="-0.227705"/>
                           <atom elementType="O"
                                 id="a13"
                                 x3="-0.706235"
                                 y3="6.107601"
                                 z3="-0.898895"/>
                           <atom elementType="O"
                                 id="a14"
                                 x3="0.139689"
                                 y3="-0.545956"
                                 z3="-1.743591"/>
                           <atom elementType="Mo"
                                 id="a15"
                                 x3="0.990239"
                                 y3="2.362061"
                                 z3="-5.999942"/>
                           <atom elementType="Mo"
                                 id="a16"
                                 x3="0.315552"
                                 y3="2.874585"
                                 z3="-0.171276"/>
                           <atom elementType="O"
                                 id="a17"
                                 x3="0.917617"
                                 y3="-0.172103"
                                 z3="1.933132"/>
                           <atom elementType="O"
                                 id="a18"
                                 x3="0.978918"
                                 y3="4.874515"
                                 z3="3.493061"/>
                           <atom elementType="O"
                                 id="a19"
                                 x3="1.478016"
                                 y3="0.796369"
                                 z3="-4.099538"/>
                           <atom elementType="O"
                                 id="a20"
                                 x3="0.428876"
                                 y3="-0.118661"
                                 z3="5.387084"/>
                           <atom elementType="O"
                                 id="a21"
                                 x3="-2.198757"
                                 y3="2.315254"
                                 z3="2.393767"/>
                           <atom elementType="Mo"
                                 id="a22"
                                 x3="-1.521905"
                                 y3="2.962898"
                                 z3="-3.07877"/>
                           <atom elementType="O"
                                 id="a23"
                                 x3="2.474274"
                                 y3="1.353613"
                                 z3="3.802228"/>
                           <atom elementType="Mo"
                                 id="a24"
                                 x3="-2.450551"
                                 y3="5.390036"
                                 z3="0.070873"/>
                           <atom elementType="O"
                                 id="a25"
                                 x3="-2.606587"
                                 y3="6.719955"
                                 z3="1.232174"/>
                           <atom elementType="O"
                                 id="a26"
                                 x3="0.794939"
                                 y3="2.478799"
                                 z3="1.748532"/>
                           <atom elementType="H"
                                 id="a27"
                                 x3="1.668188"
                                 y3="4.260103"
                                 z3="4.876075"/>
                           <atom elementType="O"
                                 id="a28"
                                 x3="0.277385"
                                 y3="0.950635"
                                 z3="-6.808892"/>
                           <atom elementType="H"
                                 id="a29"
                                 x3="-2.704423"
                                 y3="2.959904"
                                 z3="1.775996"/>
                           <atom elementType="H"
                                 id="a30"
                                 x3="-1.772039"
                                 y3="1.690589"
                                 z3="1.744722"/>
                           <atom elementType="O"
                                 id="a31"
                                 x3="2.976737"
                                 y3="-0.524577"
                                 z3="-1.970418"/>
                           <atom elementType="O"
                                 id="a32"
                                 x3="3.534704"
                                 y3="-0.246788"
                                 z3="1.541715"/>
                           <atom elementType="O"
                                 id="a33"
                                 x3="0.05913"
                                 y3="1.940127"
                                 z3="7.18411"/>
                           <atom elementType="Mo"
                                 id="a34"
                                 x3="2.24438"
                                 y3="1.116387"
                                 z3="2.062032"/>
                           <atom elementType="H"
                                 id="a35"
                                 x3="0.078807"
                                 y3="5.741878"
                                 z3="-0.441683"/>
                           <atom elementType="H"
                                 id="a36"
                                 x3="2.866552"
                                 y3="3.62916"
                                 z3="5.690348"/>
                           <atom elementType="O"
                                 id="a37"
                                 x3="0.538353"
                                 y3="3.72894"
                                 z3="-7.036797"/>
                           <atom elementType="H"
                                 id="a38"
                                 x3="2.287636"
                                 y3="3.50803"
                                 z3="-3.68673"/>
                           <atom elementType="O"
                                 id="a39"
                                 x3="-1.769316"
                                 y3="4.740261"
                                 z3="3.786518"/>
                           <atom elementType="O"
                                 id="a40"
                                 x3="-1.032908"
                                 y3="0.902234"
                                 z3="0.353641"/>
                           <atom elementType="O"
                                 id="a41"
                                 x3="1.478719"
                                 y3="4.128869"
                                 z3="-0.482208"/>
                           <atom elementType="O"
                                 id="a42"
                                 x3="0.409163"
                                 y3="2.189936"
                                 z3="-2.075534"/>
                           <atom elementType="H"
                                 id="a43"
                                 x3="-1.261551"
                                 y3="0.613584"
                                 z3="-2.24136"/>
                           <atom elementType="O"
                                 id="a44"
                                 x3="-0.740665"
                                 y3="2.575045"
                                 z3="-4.682327"/>
                           <atom elementType="H"
                                 id="a45"
                                 x3="3.425465"
                                 y3="2.569546"
                                 z3="0.407642"/>
                           <atom elementType="Mo"
                                 id="a46"
                                 x3="-0.43425"
                                 y3="3.891358"
                                 z3="3.041556"/>
                           <atom elementType="H"
                                 id="a47"
                                 x3="0.9021"
                                 y3="4.294064"
                                 z3="-3.805028"/>
                           <atom elementType="O"
                                 id="a48"
                                 x3="1.955324"
                                 y3="-1.670652"
                                 z3="0.024799"/>
                           <atom elementType="O"
                                 id="a49"
                                 x3="-3.148262"
                                 y3="3.455869"
                                 z3="-3.464889"/>
                           <atom elementType="O"
                                 id="a50"
                                 x3="-2.0391"
                                 y3="1.12636"
                                 z3="-2.586123"/>
                           <atom elementType="O"
                                 id="a51"
                                 x3="-0.524942"
                                 y3="4.716666"
                                 z3="-3.172525"/>
                           <atom elementType="O"
                                 id="a52"
                                 x3="-1.362694"
                                 y3="3.408068"
                                 z3="-1.031615"/>
                           <atom elementType="O"
                                 id="a53"
                                 x3="-3.444327"
                                 y3="5.86796"
                                 z3="-1.312984"/>
                           <atom elementType="O"
                                 id="a54"
                                 x3="-3.401616"
                                 y3="4.041384"
                                 z3="0.830382"/>
                           <atom elementType="H"
                                 id="a55"
                                 x3="3.298479"
                                 y3="1.008557"
                                 z3="5.760486"/>
                           <atom elementType="H"
                                 id="a56"
                                 x3="3.017152"
                                 y3="-0.955849"
                                 z3="1.028012"/>
                           <atom elementType="H"
                                 id="a57"
                                 x3="2.575948"
                                 y3="-1.091973"
                                 z3="-1.17821"/>
                           <atom elementType="H"
                                 id="a58"
                                 x3="1.794832"
                                 y3="-2.631296"
                                 z3="-0.043097"/>
                           <atom elementType="O"
                                 id="a59"
                                 x3="1.904688"
                                 y3="3.793621"
                                 z3="5.735933"/>
                           <atom elementType="O"
                                 id="a60"
                                 x3="1.71511"
                                 y3="3.981661"
                                 z3="-4.339644"/>
                        </atomArray>
                        <bondArray>
                           <bond atomRefs2="a1 a31" order="S"/>
                           <bond atomRefs2="a1 a19" order="S"/>
                           <bond atomRefs2="a1 a12" order="S"/>
                           <bond atomRefs2="a1 a7" order="S"/>
                           <bond atomRefs2="a1 a42" order="S"/>
                           <bond atomRefs2="a2 a5" order="S"/>
                           <bond atomRefs2="a2 a40" order="S"/>
                           <bond atomRefs2="a2 a14" order="S"/>
                           <bond atomRefs2="a2 a48" order="S"/>
                           <bond atomRefs2="a2 a17" order="S"/>
                           <bond atomRefs2="a3 a51" order="S"/>
                           <bond atomRefs2="a4 a46" order="S"/>
                           <bond atomRefs2="a4 a16" order="S"/>
                           <bond atomRefs2="a6 a8" order="S"/>
                           <bond atomRefs2="a6 a33" order="S"/>
                           <bond atomRefs2="a6 a20" order="S"/>
                           <bond atomRefs2="a6 a10" order="S"/>
                           <bond atomRefs2="a8 a55" order="S"/>
                           <bond atomRefs2="a9 a15" order="S"/>
                           <bond atomRefs2="a10 a46" order="S"/>
                           <bond atomRefs2="a11 a45" order="S"/>
                           <bond atomRefs2="a11 a34" order="S"/>
                           <bond atomRefs2="a12 a16" order="S"/>
                           <bond atomRefs2="a13 a35" order="S"/>
                           <bond atomRefs2="a13 a24" order="S"/>
                           <bond atomRefs2="a15 a37" order="S"/>
                           <bond atomRefs2="a15 a28" order="S"/>
                           <bond atomRefs2="a15 a44" order="S"/>
                           <bond atomRefs2="a16 a42" order="S"/>
                           <bond atomRefs2="a16 a52" order="S"/>
                           <bond atomRefs2="a16 a41" order="S"/>
                           <bond atomRefs2="a16 a26" order="S"/>
                           <bond atomRefs2="a17 a34" order="S"/>
                           <bond atomRefs2="a18 a46" order="S"/>
                           <bond atomRefs2="a21 a29" order="S"/>
                           <bond atomRefs2="a21 a30" order="S"/>
                           <bond atomRefs2="a22 a52" order="S"/>
                           <bond atomRefs2="a22 a49" order="S"/>
                           <bond atomRefs2="a22 a51" order="S"/>
                           <bond atomRefs2="a22 a50" order="S"/>
                           <bond atomRefs2="a22 a44" order="S"/>
                           <bond atomRefs2="a22 a42" order="S"/>
                           <bond atomRefs2="a23 a34" order="S"/>
                           <bond atomRefs2="a24 a25" order="S"/>
                           <bond atomRefs2="a24 a54" order="S"/>
                           <bond atomRefs2="a24 a53" order="S"/>
                           <bond atomRefs2="a26 a34" order="S"/>
                           <bond atomRefs2="a26 a46" order="S"/>
                           <bond atomRefs2="a27 a59" order="S"/>
                           <bond atomRefs2="a31 a57" order="S"/>
                           <bond atomRefs2="a32 a56" order="S"/>
                           <bond atomRefs2="a32 a34" order="S"/>
                           <bond atomRefs2="a36 a59" order="S"/>
                           <bond atomRefs2="a38 a60" order="S"/>
                           <bond atomRefs2="a39 a46" order="S"/>
                           <bond atomRefs2="a43 a50" order="S"/>
                           <bond atomRefs2="a47 a60" order="S"/>
                           <bond atomRefs2="a48 a58" order="S"/>
                        </bondArray>
                        <formula concise="H14Mo9O37"/>
                        <property dictRef="cml:molmass">
                           <scalar units="unit:dalton">1455.4377999999992</scalar>
                        </property>
                        <formula convention="iupac:inchi"
                                 inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                           <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9801,1.0415,-2.4096;.0156,-.56,.0671;-.5683,5.2326,-2.2929;-.6729,4.3089,1.187;-.9648,-1.9561,.485;.8912,1.5415,5.6982;3.2275,2.2848,-2.5362;2.7017,1.2734,6.4915;2.7409,2.1785,-6.2486;-.1421,2.4504,4.37;3.5302,2.4706,1.3776;1.5977,1.2493,-.2277;-.7062,6.1076,-.8989;.1397,-.546,-1.7436;.9902,2.3621,-5.9999;.3156,2.8746,-.1713;.9176,-.1721,1.9331;.9789,4.8745,3.4931;1.478,.7964,-4.0995;.4289,-.1187,5.3871;-2.1988,2.3153,2.3938;-1.5219,2.9629,-3.0788;2.4743,1.3536,3.8022;-2.4506,5.39,.0709;-2.6066,6.72,1.2322;.7949,2.4788,1.7485;1.6682,4.2601,4.8761;.2774,.9506,-6.8089;-2.7044,2.9599,1.776;-1.772,1.6906,1.7447;2.9767,-.5246,-1.9704;3.5347,-.2468,1.5417;.0591,1.9401,7.1841;2.2444,1.1164,2.062;.0788,5.7419,-.4417;2.8666,3.6292,5.6903;.5384,3.7289,-7.0368;2.2876,3.508,-3.6867;-1.7693,4.7403,3.7865;-1.0329,.9022,.3536;1.4787,4.1289,-.4822;.4092,2.1899,-2.0755;-1.2616,.6136,-2.2414;-.7407,2.575,-4.6823;3.4255,2.5695,.4076;-.4343,3.8914,3.0416;.9021,4.2941,-3.805;1.9553,-1.6707,.0248;-3.1483,3.4559,-3.4649;-2.0391,1.1264,-2.5861;-.5249,4.7167,-3.1725;-1.3627,3.4081,-1.0316;-3.4443,5.868,-1.313;-3.4016,4.0414,.8304;3.2985,1.0086,5.7605;3.0172,-.9558,1.028;2.5759,-1.092,-1.1782;1.7948,-2.6313,-.0431;1.9047,3.7936,5.7359;1.7151,3.9817,-4.3396;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
                        </formula>
                     </molecule>
                  </module>
               </module>
               <module cmlx:templateRef="geometry.cycle">
                  <scalar dataType="xsd:integer" dictRef="cc:cycleNumber">22</scalar>
                  <module cmlx:templateRef="convergence">
                     <list cmlx:templateRef="step">
                        <scalar dataType="xsd:integer" dictRef="a:nstep">22</scalar>
                        <scalar dataType="xsd:string" dictRef="x:converged">CONVERGED</scalar>
                     </list>
                     <list cmlx:templateRef="energy">
                        <scalar dataType="xsd:double" dictRef="cc:energy">-15.89801542</scalar>
                     </list>
                     <list cmlx:templateRef="cgradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00070530</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00100000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="cgradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00015777</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00066667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="gradmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00070530</scalar>
                     </list>
                     <list cmlx:templateRef="gradrms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00015777</scalar>
                     </list>
                     <list cmlx:templateRef="cstepmax">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00485653</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.01000000</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                     <list cmlx:templateRef="csteprms">
                        <scalar dataType="xsd:double" dictRef="cc:current">0.00140544</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:threshold">0.00666667</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:valid">T</scalar>
                     </list>
                  </module>
               </module>
               <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">-6</scalar>
                     </module>
                  </module>
                  <module cmlx:templateRef="adf.frequencyanalysis">
                     <module cmlx:templateRef="masses">
                        <array dataType="xsd:string" dictRef="cc:elementType" size="60">Mo Mo H O O Mo O O O O O O O O Mo Mo O O O O O Mo O Mo O O H O H H O O O Mo H H O H O O O O H O H Mo H O O O O O O O H H H H O O</array>
                        <array dataType="xsd:double" dictRef="cc:atomicmass" size="60">97.90540600 97.90540600 1.00782500 15.99491400 15.99491400 97.90540600 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 97.90540600 97.90540600 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 97.90540600 15.99491400 97.90540600 15.99491400 15.99491400 1.00782500 15.99491400 1.00782500 1.00782500 15.99491400 15.99491400 15.99491400 97.90540600 1.00782500 1.00782500 15.99491400 1.00782500 15.99491400 15.99491400 15.99491400 15.99491400 1.00782500 15.99491400 1.00782500 97.90540600 1.00782500 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 15.99491400 1.00782500 1.00782500 1.00782500 1.00782500 15.99491400 15.99491400</array>
                     </module>
                     <module cmlx:templateRef="thermochemistry">
                        <scalar dataType="xsd:double" dictRef="cc:press" units="nonsi:atm">1.000000</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:temp" units="si:k">298.150000</scalar>
                        <array dataType="xsd:double" dictRef="cc:moi" size="3">33036.0512 69470.4902 87514.5106</array>
                        <scalar dataType="xsd:integer" dictRef="cc:symmnumber">1</scalar>
                        <scalar dataType="xsd:string" dictRef="cc:pointgroup">NOSYM</scalar>
                        <module cmlx:templateRef="energies">
                           <scalar dataType="xsd:double" dictRef="cc:temp" units="si:k">298.15</scalar>
                           <list cmlx:templateRef="entropy">
                              <scalar dataType="xsd:double"
                                      dictRef="cc:transl"
                                      units="nonsi2:cal.mol-1.K-1">47.764</scalar>
                              <scalar dataType="xsd:double"
                                      dictRef="cc:rotat"
                                      units="nonsi2:cal.mol-1.K-1">40.526</scalar>
                              <scalar dataType="xsd:double"
                                      dictRef="cc:vibrat"
                                      units="nonsi2:cal.mol-1.K-1">211.575</scalar>
                              <scalar dataType="xsd:double"
                                      dictRef="cc:total"
                                      units="nonsi2:cal.mol-1.K-1">299.865</scalar>
                           </list>
                           <list cmlx:templateRef="internalEnergy">
                              <scalar dataType="xsd:double" dictRef="cc:transl" units="nonsi2:kcal.mol-1">0.889</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:rotat" units="nonsi2:kcal.mol-1">0.889</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:vibrat" units="nonsi2:kcal.mol-1">196.094</scalar>
                              <scalar dataType="xsd:double" dictRef="cc:total" units="nonsi2:kcal.mol-1">197.872</scalar>
                           </list>
                           <list cmlx:templateRef="heat">
                              <scalar dataType="xsd:double"
                                      dictRef="cc:transl"
                                      units="nonsi2:cal.mol-1.K-1">2.981</scalar>
                              <scalar dataType="xsd:double"
                                      dictRef="cc:rotat"
                                      units="nonsi2:cal.mol-1.K-1">2.981</scalar>
                              <scalar dataType="xsd:double"
                                      dictRef="cc:vibrat"
                                      units="nonsi2:cal.mol-1.K-1">202.131</scalar>
                              <scalar dataType="xsd:double"
                                      dictRef="cc:total"
                                      units="nonsi2:cal.mol-1.K-1">208.092</scalar>
                           </list>
                        </module>
                     </module>
                  </module>
               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:zeropoint">
                  <scalar dataType="xsd:double"
                          dictRef="cc:zeropoint"
                          units="nonsi:electronvolt">7.036915</scalar>
               </property>
               <property dictRef="cc:frequencies">
                  <module cmlx:templateRef="vibrations" dictRef="cc:vibrations">
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                        x3="-2.198757"
                        y3="2.315254"
                        z3="2.393767"/>
                  <atom elementType="Mo"
                        id="a22"
                        x3="-1.521905"
                        y3="2.962898"
                        z3="-3.07877"/>
                  <atom elementType="O"
                        id="a23"
                        x3="2.474274"
                        y3="1.353613"
                        z3="3.802228"/>
                  <atom elementType="Mo"
                        id="a24"
                        x3="-2.450551"
                        y3="5.390036"
                        z3="0.070873"/>
                  <atom elementType="O"
                        id="a25"
                        x3="-2.606587"
                        y3="6.719955"
                        z3="1.232174"/>
                  <atom elementType="O"
                        id="a26"
                        x3="0.794939"
                        y3="2.478799"
                        z3="1.748532"/>
                  <atom elementType="H"
                        id="a27"
                        x3="1.668188"
                        y3="4.260103"
                        z3="4.876075"/>
                  <atom elementType="O"
                        id="a28"
                        x3="0.277385"
                        y3="0.950635"
                        z3="-6.808892"/>
                  <atom elementType="H"
                        id="a29"
                        x3="-2.704423"
                        y3="2.959904"
                        z3="1.775996"/>
                  <atom elementType="H"
                        id="a30"
                        x3="-1.772039"
                        y3="1.690589"
                        z3="1.744722"/>
                  <atom elementType="O"
                        id="a31"
                        x3="2.976737"
                        y3="-0.524577"
                        z3="-1.970418"/>
                  <atom elementType="O"
                        id="a32"
                        x3="3.534704"
                        y3="-0.246788"
                        z3="1.541715"/>
                  <atom elementType="O"
                        id="a33"
                        x3="0.05913"
                        y3="1.940127"
                        z3="7.18411"/>
                  <atom elementType="Mo"
                        id="a34"
                        x3="2.24438"
                        y3="1.116387"
                        z3="2.062032"/>
                  <atom elementType="H"
                        id="a35"
                        x3="0.078807"
                        y3="5.741878"
                        z3="-0.441683"/>
                  <atom elementType="H"
                        id="a36"
                        x3="2.866552"
                        y3="3.62916"
                        z3="5.690348"/>
                  <atom elementType="O"
                        id="a37"
                        x3="0.538353"
                        y3="3.72894"
                        z3="-7.036797"/>
                  <atom elementType="H"
                        id="a38"
                        x3="2.287636"
                        y3="3.50803"
                        z3="-3.68673"/>
                  <atom elementType="O"
                        id="a39"
                        x3="-1.769316"
                        y3="4.740261"
                        z3="3.786518"/>
                  <atom elementType="O"
                        id="a40"
                        x3="-1.032908"
                        y3="0.902234"
                        z3="0.353641"/>
                  <atom elementType="O"
                        id="a41"
                        x3="1.478719"
                        y3="4.128869"
                        z3="-0.482208"/>
                  <atom elementType="O"
                        id="a42"
                        x3="0.409163"
                        y3="2.189936"
                        z3="-2.075534"/>
                  <atom elementType="H"
                        id="a43"
                        x3="-1.261551"
                        y3="0.613584"
                        z3="-2.24136"/>
                  <atom elementType="O"
                        id="a44"
                        x3="-0.740665"
                        y3="2.575045"
                        z3="-4.682327"/>
                  <atom elementType="H"
                        id="a45"
                        x3="3.425465"
                        y3="2.569546"
                        z3="0.407642"/>
                  <atom elementType="Mo"
                        id="a46"
                        x3="-0.43425"
                        y3="3.891358"
                        z3="3.041556"/>
                  <atom elementType="H"
                        id="a47"
                        x3="0.9021"
                        y3="4.294064"
                        z3="-3.805028"/>
                  <atom elementType="O"
                        id="a48"
                        x3="1.955324"
                        y3="-1.670652"
                        z3="0.024799"/>
                  <atom elementType="O"
                        id="a49"
                        x3="-3.148262"
                        y3="3.455869"
                        z3="-3.464889"/>
                  <atom elementType="O"
                        id="a50"
                        x3="-2.0391"
                        y3="1.12636"
                        z3="-2.586123"/>
                  <atom elementType="O"
                        id="a51"
                        x3="-0.524942"
                        y3="4.716666"
                        z3="-3.172525"/>
                  <atom elementType="O"
                        id="a52"
                        x3="-1.362694"
                        y3="3.408068"
                        z3="-1.031615"/>
                  <atom elementType="O"
                        id="a53"
                        x3="-3.444327"
                        y3="5.86796"
                        z3="-1.312984"/>
                  <atom elementType="O"
                        id="a54"
                        x3="-3.401616"
                        y3="4.041384"
                        z3="0.830382"/>
                  <atom elementType="H"
                        id="a55"
                        x3="3.298479"
                        y3="1.008557"
                        z3="5.760486"/>
                  <atom elementType="H"
                        id="a56"
                        x3="3.017152"
                        y3="-0.955849"
                        z3="1.028012"/>
                  <atom elementType="H"
                        id="a57"
                        x3="2.575948"
                        y3="-1.091973"
                        z3="-1.17821"/>
                  <atom elementType="H"
                        id="a58"
                        x3="1.794832"
                        y3="-2.631296"
                        z3="-0.043097"/>
                  <atom elementType="O"
                        id="a59"
                        x3="1.904688"
                        y3="3.793621"
                        z3="5.735933"/>
                  <atom elementType="O"
                        id="a60"
                        x3="1.71511"
                        y3="3.981661"
                        z3="-4.339644"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a31" order="S"/>
                  <bond atomRefs2="a1 a19" order="S"/>
                  <bond atomRefs2="a1 a12" order="S"/>
                  <bond atomRefs2="a1 a7" order="S"/>
                  <bond atomRefs2="a1 a42" order="S"/>
                  <bond atomRefs2="a2 a5" order="S"/>
                  <bond atomRefs2="a2 a40" order="S"/>
                  <bond atomRefs2="a2 a14" order="S"/>
                  <bond atomRefs2="a2 a48" order="S"/>
                  <bond atomRefs2="a2 a17" order="S"/>
                  <bond atomRefs2="a3 a51" order="S"/>
                  <bond atomRefs2="a4 a46" order="S"/>
                  <bond atomRefs2="a4 a16" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a6 a33" order="S"/>
                  <bond atomRefs2="a6 a20" order="S"/>
                  <bond atomRefs2="a6 a10" order="S"/>
                  <bond atomRefs2="a8 a55" order="S"/>
                  <bond atomRefs2="a9 a15" order="S"/>
                  <bond atomRefs2="a10 a46" order="S"/>
                  <bond atomRefs2="a11 a45" order="S"/>
                  <bond atomRefs2="a11 a34" order="S"/>
                  <bond atomRefs2="a12 a16" order="S"/>
                  <bond atomRefs2="a13 a35" order="S"/>
                  <bond atomRefs2="a13 a24" order="S"/>
                  <bond atomRefs2="a15 a37" order="S"/>
                  <bond atomRefs2="a15 a28" order="S"/>
                  <bond atomRefs2="a15 a44" order="S"/>
                  <bond atomRefs2="a16 a42" order="S"/>
                  <bond atomRefs2="a16 a52" order="S"/>
                  <bond atomRefs2="a16 a41" order="S"/>
                  <bond atomRefs2="a16 a26" order="S"/>
                  <bond atomRefs2="a17 a34" order="S"/>
                  <bond atomRefs2="a18 a46" order="S"/>
                  <bond atomRefs2="a21 a29" order="S"/>
                  <bond atomRefs2="a21 a30" order="S"/>
                  <bond atomRefs2="a22 a52" order="S"/>
                  <bond atomRefs2="a22 a49" order="S"/>
                  <bond atomRefs2="a22 a51" order="S"/>
                  <bond atomRefs2="a22 a50" order="S"/>
                  <bond atomRefs2="a22 a44" order="S"/>
                  <bond atomRefs2="a22 a42" order="S"/>
                  <bond atomRefs2="a23 a34" order="S"/>
                  <bond atomRefs2="a24 a25" order="S"/>
                  <bond atomRefs2="a24 a54" order="S"/>
                  <bond atomRefs2="a24 a53" order="S"/>
                  <bond atomRefs2="a26 a34" order="S"/>
                  <bond atomRefs2="a26 a46" order="S"/>
                  <bond atomRefs2="a27 a59" order="S"/>
                  <bond atomRefs2="a31 a57" order="S"/>
                  <bond atomRefs2="a32 a56" order="S"/>
                  <bond atomRefs2="a32 a34" order="S"/>
                  <bond atomRefs2="a36 a59" order="S"/>
                  <bond atomRefs2="a38 a60" order="S"/>
                  <bond atomRefs2="a39 a46" order="S"/>
                  <bond atomRefs2="a43 a50" order="S"/>
                  <bond atomRefs2="a47 a60" order="S"/>
                  <bond atomRefs2="a48 a58" order="S"/>
               </bondArray>
               <formula concise="H14Mo9O37"/>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">1455.4377999999992</scalar>
               </property>
               <formula convention="iupac:inchi"
                        inline="InChI=1/9Mo.11H2O.26O/h;;;;;;;;;11*1H2;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;4*+1;2*+2;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/p-8/rH7Mo8O30.HMoO4.3H2O/c9-1(10,11)31-6(25,26)35-8(30,37(6)4(19,20,21)33-3(15,16,17)18)34-5(22,23,24)38(8)7(27,28,29,36-8)32-2(12,13)14;2-1(3,4)5;;;/h9,15,19-20,22,27-28H;2H;3*1H2">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/1/N:15;16;46;1;2;6;24;22;34;21;59;60;51;8;11;13;31;32;50;48;4;5;7;9;10;12;14;17;18;19;20;23;25;26;28;33;37;39;40;41;42;44;49;52;53;54/rA:60nMoMoHOO1MoO1OO1OOOOO1MoMoOO1O1O1OMoO1MoO1O3HO1HHOOO1MoHHO1HO1O1O1O3HOHMoHOO1OOOO1O1HHHHOO/rB:;;;s2;;s1;s6;;s6;;s1;;s2;s9;s4s12;s2;;s1;s6;;;;s13;s24;s16;;s15;s21;s21;s1;;s6;s11s17s23s26s32;s13;;s15;;;s2;s16;s1s16s22;;s15s22;s11;s4s10s18s26s39;;s2;s22;s22s43;s3s22;s16s22;s24;s24;s8;s32;s31;s48;s27s36;s38s47;/rC:1.9801,1.0415,-2.4096;.0156,-.56,.0671;-.5683,5.2326,-2.2929;-.6729,4.3089,1.187;-.9648,-1.9561,.485;.8912,1.5415,5.6982;3.2275,2.2848,-2.5362;2.7017,1.2734,6.4915;2.7409,2.1785,-6.2486;-.1421,2.4504,4.37;3.5302,2.4706,1.3776;1.5977,1.2493,-.2277;-.7062,6.1076,-.8989;.1397,-.546,-1.7436;.9902,2.3621,-5.9999;.3156,2.8746,-.1713;.9176,-.1721,1.9331;.9789,4.8745,3.4931;1.478,.7964,-4.0995;.4289,-.1187,5.3871;-2.1988,2.3153,2.3938;-1.5219,2.9629,-3.0788;2.4743,1.3536,3.8022;-2.4506,5.39,.0709;-2.6066,6.72,1.2322;.7949,2.4788,1.7485;1.6682,4.2601,4.8761;.2774,.9506,-6.8089;-2.7044,2.9599,1.776;-1.772,1.6906,1.7447;2.9767,-.5246,-1.9704;3.5347,-.2468,1.5417;.0591,1.9401,7.1841;2.2444,1.1164,2.062;.0788,5.7419,-.4417;2.8666,3.6292,5.6903;.5384,3.7289,-7.0368;2.2876,3.508,-3.6867;-1.7693,4.7403,3.7865;-1.0329,.9022,.3536;1.4787,4.1289,-.4822;.4092,2.1899,-2.0755;-1.2616,.6136,-2.2414;-.7407,2.575,-4.6823;3.4255,2.5695,.4076;-.4343,3.8914,3.0416;.9021,4.2941,-3.805;1.9553,-1.6707,.0248;-3.1483,3.4559,-3.4649;-2.0391,1.1264,-2.5861;-.5249,4.7167,-3.1725;-1.3627,3.4081,-1.0316;-3.4443,5.868,-1.313;-3.4016,4.0414,.8304;3.2985,1.0086,5.7605;3.0172,-.9558,1.028;2.5759,-1.092,-1.1782;1.7948,-2.6313,-.0431;1.9047,3.7936,5.7359;1.7151,3.9817,-4.3396;/R:/0/N:6,15,2,34,1,46,22,16,8,20,33,9,28,37,48,5,14,40,11,32,23,31,7,19,18,39,50,51,49,41,10,44,17,12,4,52,26,42;24,13,25,53,54;21;59;60/E:(10,11)(12,13,14)(16,17,18)(19,20)(23,24)(25,26)(27,28);(3,4,5);;;/CRV:10.1,11.1,12.1,13.1,14.1,16.1,17.1,18.1,21.1,23.1,24.1,25.1,26.1,29.1,30.1,37.3,38.3;3.1,4.1,5.1;;;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="orbital.energies.zora" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="energies" dictRef="energies">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="20">139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158</array>
                     <array dataType="xsd:double" dictRef="cc:occup" size="20">2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 2.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000 0.000</array>
                     <array dataType="xsd:double"
                            dictRef="cc:energy"
                            size="20"
                            units="nonsi:electronvolt">-6.067 -6.063 -5.989 -5.978 -5.960 -5.936 -5.774 -5.748 -5.683 -5.517 -3.412 -3.264 -3.117 -3.055 -2.946 -2.883 -2.805 -2.765 -2.668 -2.584</array>
                     <array dataType="xsd:string" dictRef="cc:irrep" size="20">A A A A A A A A A A A A A A A A A A A A</array>
                  </list>
               </module>
               <module cmlx:templateRef="fit.test" dictRef="cc:userDefinedModule">
                  <scalar dataType="xsd:double" dictRef="cc:sumfragments">0.00000000040948</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:ortho">0.00031242985757</scalar>
                  <scalar dataType="xsd:double" dictRef="cc:fitscf">0.00018823975301</scalar>
               </module>
               <module cmlx:templateRef="qtaim" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="atoms">
                     <array dataType="xsd:integer" dictRef="a:id" size="60">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</array>
                     <array dataType="xsd:integer" dictRef="cc:atomicNumber" size="60">42 42 42 42 42 42 42 42 42 1 1 1 1 1 1 1 1 1 1 1 1 1 1 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8 8</array>
                     <array dataType="xsd:double" dictRef="x:coords" size="180">1.980104 1.041519 -2.409557 0.015626 -0.559969 0.067149 0.891245 1.541510 5.698164 0.990239 2.362061 -5.999942 0.315552 2.874585 -0.171276 -1.521905 2.962898 -3.078770 -2.450550 5.390035 0.070873 2.244380 1.116387 2.062032 -0.434250 3.891358 3.041555 -0.568298 5.232636 -2.292859 1.668188 4.260103 4.876075 -2.704423 2.959904 1.775996 -1.772039 1.690589 1.744722 0.078807 5.741878 -0.441682 2.866552 3.629160 5.690348 2.287636 3.508030 -3.686730 -1.261551 0.613584 -2.241360 3.425465 2.569546 0.407642 0.902100 4.294064 -3.805028 3.298479 1.008557 5.760486 3.017152 -0.955849 1.028012 2.575947 -1.091973 -1.178210 1.794832 -2.631295 -0.043097 -0.672941 4.308879 1.186967 -0.964820 -1.956097 0.484999 3.227508 2.284836 -2.536224 2.701745 1.273356 6.491502 2.740930 2.178510 -6.248581 -0.142138 2.450376 4.369973 3.530163 2.470602 1.377624 1.597734 1.249263 -0.227705 -0.706235 6.107601 -0.898895 0.139689 -0.545956 -1.743590 0.917617 -0.172103 1.933132 0.978918 4.874515 3.493061 1.478016 0.796369 -4.099538 0.428876 -0.118661 5.387084 -2.198757 2.315254 2.393766 2.474274 1.353613 3.802228 -2.606587 6.719954 1.232174 0.794939 2.478799 1.748532 0.277385 0.950635 -6.808892 2.976737 -0.524577 -1.970418 3.534704 -0.246788 1.541715 0.059130 1.940127 7.184110 0.538353 3.728939 -7.036797 -1.769316 4.740261 3.786517 -1.032908 0.902234 0.353641 1.478719 4.128869 -0.482208 0.409163 2.189936 -2.075534 -0.740665 2.575045 -4.682327 1.955324 -1.670652 0.024799 -3.148262 3.455868 -3.464889 -2.039100 1.126360 -2.586123 -0.524942 4.716666 -3.172524 -1.362694 3.408068 -1.031615 -3.444327 5.867960 -1.312984 -3.401616 4.041384 0.830382 1.904688 3.793620 5.735932 1.715110 3.981661 -4.339643</array>
                  </list>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">1</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.980104</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.041519</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.409557</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242822E+06</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">2</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.015626</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.559969</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.067149</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242819E+06</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.891245</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.541510</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">5.698164</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242823E+06</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">4</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.990239</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.362061</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-5.999942</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242821E+06</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">5</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.315552</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.874585</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.171276</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242811E+06</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">6</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.521905</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.962898</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.078770</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242819E+06</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">7</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.450550</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.390035</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.070873</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242821E+06</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">8</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.244380</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.116387</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">2.062032</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242819E+06</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">9</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.434250</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.891358</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">3.041555</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242821E+06</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">10</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.568298</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.232636</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.292859</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4195054E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">11</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.668188</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.260103</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">4.876075</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4338327E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">12</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.704423</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.959904</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.775996</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4168845E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">13</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.772039</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.690589</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.744722</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4471568E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">14</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.078807</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.741878</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.441682</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4747826E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">15</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.866552</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.629160</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">5.690348</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4716293E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">16</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.287636</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.508030</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.686730</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4562738E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">17</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.261551</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.613584</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.241360</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4486339E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">18</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">3.425465</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.569546</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.407642</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4669534E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">19</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.902100</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.294064</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.805028</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4171156E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">20</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">3.298479</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.008557</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">5.760486</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4686278E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">21</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">3.017152</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.955849</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.028012</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4231451E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">22</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.575947</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-1.091973</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.178210</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3921239E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">23</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.794832</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-2.631295</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.043097</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4743741E+00</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">24</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.672941</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.308879</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.186967</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3191165E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">25</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.964820</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-1.956097</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.484999</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3194139E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">26</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">3.227508</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.284836</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.536224</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3194019E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">27</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.701745</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.273356</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">6.491502</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3188140E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">28</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.740930</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.178510</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-6.248581</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3193341E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">29</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.142138</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.450376</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">4.369973</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3189979E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">30</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">3.530163</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.470602</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.377624</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3188430E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">31</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.597734</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.249263</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.227705</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3190354E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">32</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.706235</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">6.107601</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.898895</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3187677E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">33</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.139689</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.545956</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.743590</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3192823E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">34</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.917617</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.172103</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.933132</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3192370E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">35</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.978918</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.874515</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">3.493061</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3193323E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">36</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.478016</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.796369</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-4.099538</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3193479E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">37</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.428876</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.118661</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">5.387084</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3194423E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">38</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.198757</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.315254</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">2.393766</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3185892E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">39</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.474274</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.353613</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">3.802228</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3193303E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">40</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.606587</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">6.719954</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.232174</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3193372E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">41</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.794939</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.478799</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.748532</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3190364E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">42</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.277385</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.950635</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-6.808892</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3193354E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">43</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.976737</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.524577</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.970418</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3188690E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">44</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">3.534704</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.246788</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.541715</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3188633E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">45</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.059130</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.940127</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">7.184110</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3194460E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">46</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.538353</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.728939</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-7.036797</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3193426E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">47</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.769316</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.740261</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">3.786517</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3194642E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">48</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.032908</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.902234</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.353641</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3192654E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">49</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.478719</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.128869</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.482208</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3195370E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">50</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.409163</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.189936</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.075534</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3190540E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">51</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.740665</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.575045</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-4.682327</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3191553E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">52</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.955324</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-1.670652</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.024799</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3186754E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">53</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-3.148262</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.455868</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.464889</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3194694E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">54</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.039100</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.126360</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.586123</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3188258E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">55</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.524942</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.716666</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.172524</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3187648E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">56</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.362694</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.408068</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.031615</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3191562E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">57</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-3.444327</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.867960</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.312984</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3193553E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">58</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-3.401616</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.041384</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.830382</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3192066E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">59</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.904688</scalar>
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                        <scalar dataType="xsd:double" dictRef="cc:z3">5.735932</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3185726E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">60</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.715110</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.981661</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-4.339643</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3185490E+03</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">61</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.678207</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.414724</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.994016</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4315645E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4250692E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2198220E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3637780E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5263971E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1568228E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3920569E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2096505E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5026668E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1517601E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2942170E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1963770E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9783998E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5189347E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1175821E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6559340E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3113807E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1692590E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4413380E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2106534E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">62</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.980203</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.645214</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.671948</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2076502E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3629512E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1387779E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1387779E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3053113E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8225773E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2056443E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2401439E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6099912E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7962545E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3461649E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4866855E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1405206E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9081580E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1223160E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9545019E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1844954E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2518133E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7424688E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5173582E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">63</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.614355</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.508940</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.843998</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5423406E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1962240E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4561675E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1049631E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1593918E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1238337E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3095843E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1189480E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4324087E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2185662E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4295011E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5494180E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1199168E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1516170E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2650220E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1229320E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7059660E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7723382E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5720921E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1741330E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">64</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.532896</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">6.102192</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.693450</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2065993E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1307461E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8326673E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8049117E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1026956E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8021444E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2005361E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2340202E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6202621E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2455141E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3409990E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4814619E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1404629E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9020351E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1216086E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9303980E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1816389E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2483863E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7417530E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5122238E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">65</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.991112</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.463766</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">2.269478</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4560996E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6095840E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5819116E-18</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3760826E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4762019E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1731670E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4329176E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3527139E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4991688E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3488375E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3246282E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2163389E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1082894E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5586391E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1280699E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8415389E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5374238E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2842350E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4361987E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1565876E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">66</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.062871</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.555117</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">2.362179</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4571711E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1377263E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7141801E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7718588E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8894015E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1717580E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4293950E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4234245E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5052358E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2314532E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3224210E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2154469E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1069741E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5603896E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1285286E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9108994E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6684445E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3481757E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4360039E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1362715E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">67</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.766272</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.992415</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.805336</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1276538E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1052335E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6245005E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6938894E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4857226E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5093079E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1273270E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8554295E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4378804E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1352330E+00</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1778080E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2282889E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5048098E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4747117E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7028779E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5265458E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1355221E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1762316E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6753828E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3885313E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">68</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.518909</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.434251</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.266795</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3811067E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8443615E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6375330E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5126554E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2090036E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1169295E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2923238E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6290544E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2543509E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3010350E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3188039E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3452840E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2648010E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9472120E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1769072E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1035223E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5914113E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5821357E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5354288E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1750427E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">69</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.733445</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.071159</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.568567</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8902056E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7165589E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6488272E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2483501E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1755052E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3496668E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8741669E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1089279E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7535453E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1592169E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6925653E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5109638E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1816016E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1362612E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3185151E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1658119E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5753501E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3900563E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4278013E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2881931E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">70</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.784031</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.210310</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.055303</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2875775E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4519467E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4330964E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1279867E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1739806E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9359916E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2339979E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3306508E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1987312E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2537515E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2335031E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2330082E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4948378E-04</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6507161E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1279710E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7685918E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4519407E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4090035E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5084871E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1700647E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">71</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.343534</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.889807</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.060734</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1195428E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7831952E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6970742E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3570392E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2301283E-18</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4780773E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1195193E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1907988E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9008531E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1490618E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9762444E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7572956E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2189488E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2018752E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4574587E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2348272E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6217505E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4656812E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4412970E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3776871E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">72</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.995836</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.882575</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.099874</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1145507E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5159862E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3053113E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3747003E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1806281E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4395923E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1098981E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6454315E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4235380E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9731415E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1508421E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1917861E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4094400E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4108802E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6214613E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4424996E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1192615E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1520739E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6611518E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3710330E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">73</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.568127</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.154178</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.633651</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1340035E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2611004E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2213507E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6109696E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1242756E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4790348E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1197587E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8519674E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5047849E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1164126E+00</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1805931E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2414275E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6083439E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5064539E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7427511E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5009631E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1258058E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1648598E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6818621E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3982035E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">74</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.325167</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.072530</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">2.692437</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4144174E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6676432E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3816392E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5030698E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2168404E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1576432E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3941081E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6445955E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2169374E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4321094E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4052334E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4163587E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1112530E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1059178E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1947575E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1252193E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4955215E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4975257E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5438448E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2527021E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">75</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.019609</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.050065</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">3.330490</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8066909E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1044241E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8904010E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5454892E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8131516E-19</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3322423E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8306057E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7966327E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6729821E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1343216E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6469009E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4631961E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1837048E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1194890E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2811916E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1484531E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4515165E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3048874E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4249380E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3287877E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">76</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.919920</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.697069</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.527953</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1383731E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3791039E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9064947E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3616111E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6884684E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5710818E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1427705E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3006723E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9623522E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1640392E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1180795E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9338864E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2469091E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2453506E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5450361E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2968761E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8368668E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6428577E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4501547E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3547472E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">77</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.046653</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.430719</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.273322</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2124229E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2113944E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6071532E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1387779E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1474515E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7025614E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1756403E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5254032E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1598078E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1921602E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1638747E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1521091E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1176563E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4344971E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9014470E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3902455E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6885889E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6007912E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4819996E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5667322E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">78</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.450915</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.426355</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.596669</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5702496E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3436353E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1282958E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3029922E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9910180E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1318839E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3297096E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1393566E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4414313E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3130073E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4623800E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5950504E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1326704E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1621082E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2806716E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1337198E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7762833E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8624066E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5775726E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1722565E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">79</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.558549</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.115574</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.487927</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2966702E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5647956E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4766009E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3029261E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9026830E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1433400E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3583501E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4795965E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6344082E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6689700E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1400003E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6383508E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4983504E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1461337E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1844456E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1376596E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5161524E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1182112E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7922861E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2667034E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">80</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.876023</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.378756</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.496364</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3395050E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1732489E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6591949E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1179612E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1084202E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1329186E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3322966E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4148573E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1845458E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9059793E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3237376E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3151787E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8558943E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8119200E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1549121E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1005983E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4187183E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3979932E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5241165E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2402530E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">81</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.085563</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.806193</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.068696</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1137188E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2877428E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5810646E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2011195E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1974095E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4566582E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1141645E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1494168E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8677785E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1336349E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9262128E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7107803E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2154326E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1888693E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4306509E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2149287E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4787487E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3632834E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4385670E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4489385E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">82</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.322567</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.413380</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">3.286272</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2028767E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2073557E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1110223E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9714451E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1457168E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8057469E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2014367E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2290479E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5990570E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2415251E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3354113E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4693858E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1339746E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8804295E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1191076E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9295908E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1822658E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2485362E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7391886E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5100193E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">83</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.096546</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.476549</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-5.296747</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7077975E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1435645E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2928213E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7963248E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1158101E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3137783E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7844456E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2605585E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2659737E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8001710E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8707003E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9569549E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8625465E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2162372E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3592193E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2836787E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9586763E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1105643E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6019643E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2959067E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">84</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.370462</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.504204</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.167005</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1146187E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8096254E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2602085E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4163336E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6938894E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4118639E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1029660E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6165264E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4525002E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1001904E+00</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1462975E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1896291E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4333156E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4112058E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6218811E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4162681E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1146194E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1466123E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6612289E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3631744E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">85</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.569765</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.657363</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.835381</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1160497E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3168044E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7285839E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1006140E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2914335E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4223931E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1055983E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6365111E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4504392E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9962266E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1496749E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1937515E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4407659E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4180648E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6307146E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4274186E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1158940E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1483824E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6628431E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3688013E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">86</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.057046</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.362710</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.411139</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3722022E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8153486E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6450325E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4968356E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4336809E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1533944E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3834860E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3840342E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1863955E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6249852E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3747907E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3660955E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8695247E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9178190E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1721706E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1085913E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3022605E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2935287E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5330870E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3592639E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">87</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.203261</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.147558</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">2.376756</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5893884E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6029256E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5898060E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1040834E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6938894E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2525025E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6312563E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1627812E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2436035E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8865981E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6771312E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7230062E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4587495E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1694028E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2914631E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2176199E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7681441E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8457781E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5812151E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2833061E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">88</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.203544</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.608749</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.542069</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7330209E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1510704E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4857226E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5551115E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1318390E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2662827E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6657068E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2237538E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3322493E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4752724E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8124389E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9591710E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1467321E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2265723E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3738564E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2408086E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7757236E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8998899E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6060411E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3104309E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">89</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.070995</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.333620</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.271337</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3714595E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5958194E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4602438E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3241764E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1951564E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1499838E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3749596E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3244986E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1900004E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5575863E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3687105E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3624614E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6249077E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9153778E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1717762E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1029195E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2383953E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2308170E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5328898E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4317178E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">90</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.364879</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.912939</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.690132</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7750089E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9843900E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5129737E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8353015E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9029371E-18</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3344853E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8362131E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7787409E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6252888E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1308454E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6446212E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4530293E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1915919E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1132732E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2671147E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1489497E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4724203E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3141977E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4240622E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3152906E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">91</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.988580</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.654952</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.446472</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1229075E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2201055E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8237395E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1680700E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1158165E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5217292E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1304323E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2395570E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8645674E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1570822E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1057494E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8106660E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2468285E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2094867E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4730077E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2646623E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7947425E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5905043E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4428821E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3330164E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">92</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.887896</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.582715</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">4.554462</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1115687E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3188002E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5223415E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2635530E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1715953E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4902847E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1225712E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2091117E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7829527E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1554415E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9770870E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7284621E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2486249E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1841231E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4207885E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2463977E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8144834E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5857092E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4375669E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3025202E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">93</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.247280</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.569104</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-5.002749</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3275572E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4848700E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1301043E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1214306E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4510281E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1341317E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3353292E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4142467E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1722769E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3734343E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3198353E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3043414E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1549393E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7740482E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1486607E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1018164E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4435705E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4174204E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5206811E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2295383E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">94</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.013378</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-1.145896</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.048388</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6855263E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8195835E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4329176E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2893172E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6329258E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2624170E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6560424E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2050499E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3015284E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7577244E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7670539E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8780654E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1110115E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2072131E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3463522E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2342904E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7837971E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8957348E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5982728E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2989172E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">95</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.830311</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.368496</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.081474</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4498937E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1619629E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1127570E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1152550E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1530026E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1755731E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4389328E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7562116E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2233598E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2892868E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4560218E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4731108E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1708899E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1181766E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2139836E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1400071E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5104370E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5232292E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5522695E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2742887E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">96</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.107352</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.408689</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.702823</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2523670E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7555992E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5204170E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5065393E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2086005E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8843736E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2210934E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9715557E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1691863E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2513159E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2097389E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1983844E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1135453E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5467161E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1100639E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5299466E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1117344E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9972095E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4967260E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4742916E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">97</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.305066</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.944803</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.151512</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7513484E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1507021E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1414382E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4990447E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1469280E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2988781E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7471951E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1164728E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6645404E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7724677E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5808870E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4145788E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1663082E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1086860E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2566318E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1589116E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9014511E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5544661E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4235094E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1762842E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">98</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.177354</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.612709</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.309693</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4017373E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7562001E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4719315E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3080652E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5041974E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1629504E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4073760E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3354208E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1992789E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2736539E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4068864E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4063968E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4895688E-04</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1016189E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1879387E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1109498E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1998131E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1954396E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5407027E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5552678E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">99</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.775577</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.144806</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.277921</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7057499E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1329103E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4163336E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1821460E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1249001E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2721659E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6804146E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2144533E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3051623E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2660842E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7996713E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9189279E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1192566E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2154035E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3580341E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2429726E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7797372E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8953984E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6016286E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3116084E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">100</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.150858</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.639674</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.219072</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1266274E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1112389E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8326673E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5551115E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4857226E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4829706E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1207426E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8085663E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4555874E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7761682E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1721765E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2236103E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5143384E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4696292E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6964577E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4990007E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1299198E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1689242E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6743111E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3840836E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">101</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.231103</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.282479</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.020871</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2493793E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3470949E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2155529E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2710505E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2331035E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8425236E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2106309E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9157954E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1740998E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2754186E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2015386E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1924463E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9092296E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5381031E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1085589E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5037844E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1074904E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9565522E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4956783E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4686783E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">102</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.351297</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.176050</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-5.122693</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4229903E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5893594E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3035766E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4857226E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1387779E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1686393E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4215982E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7261768E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2098320E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2453162E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4285068E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4354154E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6908592E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1088493E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1993837E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1355542E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5465277E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5520361E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5459287E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2480281E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">103</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+3</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.862203</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.540837</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.720986</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5467526E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1150162E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7560506E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5598261E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6617064E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2184015E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5460038E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1982951E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5353966E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1459148E+00</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4127240E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2794441E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1332798E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7113875E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1670875E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7949199E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1343089E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9705503E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4257574E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5918594E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+3</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">104</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.704931</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.447101</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">4.709749</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3526987E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2491307E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1734723E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4336809E-18</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1734723E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1477283E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3693207E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5005974E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1769386E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4844449E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3551256E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3409306E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1419506E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8542604E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1618502E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1138730E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4836635E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4646730E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5278094E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2354385E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">105</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.432046</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.285585</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.027537</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2171053E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4485098E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2168404E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8673617E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4395085E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8315554E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2078889E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5661294E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1400144E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1473604E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1871050E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1663211E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2078389E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4473138E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9245649E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4549426E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6397423E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5703666E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4838101E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7111341E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">106</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.979722</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.016746</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.199667</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1062283E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2485682E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1510250E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1974254E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8968520E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3480155E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8700386E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4688462E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4717895E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7695454E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1264151E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1658263E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3941123E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3715683E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5703860E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3444965E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9667825E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1216414E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6514331E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3563330E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">107</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.444654</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.674556</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.958063</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3265594E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4802367E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7806256E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1149254E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4597017E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1274147E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3185368E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1828825E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1804391E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2089283E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3081520E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2977672E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1038478E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7709058E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1481400E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8075150E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1375552E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1295221E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5203901E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5870479E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">108</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.854664</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.402066</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">6.087137</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1215195E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1304938E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4163336E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1302777E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6245005E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4581494E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1145374E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7325270E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4484177E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1051767E+00</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1619592E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2093810E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4742184E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4445423E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6646144E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4690646E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1250368E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1615219E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6688725E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3751411E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">109</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.796411</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.399083</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.874560</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8042827E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6960338E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3096109E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3591555E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5095208E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3082867E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7707167E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9942704E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7216716E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1989474E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6065118E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4423070E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1642048E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1190136E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2801200E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1503600E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6459763E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4163895E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4248666E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2327639E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">110</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.338077</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.974511</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.279387</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7070681E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1038849E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8836248E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3294958E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4357137E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2840362E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7100906E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8839747E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6319385E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2648800E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5481827E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3862747E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1619079E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1002305E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2370828E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1411873E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7147770E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4374616E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4227659E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1975263E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">111</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.423620</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.103139</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.274590</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7094080E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2611408E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2536118E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3101269E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5397970E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2834130E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7085324E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1141407E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6368252E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1391102E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5475568E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3865812E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1609756E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1006730E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2381136E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1558556E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9788226E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5869445E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4227942E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1592276E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">112</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.425377</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.693464</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">5.692301</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3867729E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5647915E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8673617E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4857226E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2748453E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1542537E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3856343E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5883014E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1976079E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1889711E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3840969E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3825594E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1537467E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9660357E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1799291E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1213249E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5002830E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4930675E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5368980E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2425125E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">113</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.178900</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.017491</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.170349</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7521191E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2697949E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7042368E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2382670E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1051600E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3024241E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7560601E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1286399E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6578716E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8216963E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5869385E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4178169E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1691216E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1088347E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2569728E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1665539E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1014320E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6200606E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4235259E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1642025E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">114</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.723456</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.156776</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">5.064962</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3123305E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3922506E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1016113E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3741256E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5971371E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1611309E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4028273E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5558152E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6148817E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2045883E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1442671E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6913614E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5470944E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1565084E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1958264E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1586045E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5681170E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1333080E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7992199E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2791757E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">115</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.386961</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-1.269482</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.822438</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8384788E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6016320E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5213468E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5246592E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2897856E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1196436E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2991089E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3028665E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9251466E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2693753E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6606053E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1022102E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3614964E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2710449E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4357491E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1514650E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1051743E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1322237E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6220204E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1440133E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">116</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.581296</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.053102</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.289545</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2668179E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2887473E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2521109E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2730834E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1380918E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8706240E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2176560E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2775818E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1885707E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8343412E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2135099E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2093638E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4146093E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5888505E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1173757E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7033835E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4198064E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3714736E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5016801E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1675495E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">117</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.910570</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.390527</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.770977</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1367434E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1851528E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1249001E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1249001E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5551115E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5165923E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1291481E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9433120E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4841457E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1058332E+00</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1903095E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2514710E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6116144E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5203078E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7600382E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5431111E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1353989E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1780754E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6845812E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4011192E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">118</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.518109</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.556294</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.562791</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5396078E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1256529E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9698145E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7969493E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5653464E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2333292E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5833231E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1351848E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2275662E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7039242E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6101231E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6369231E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2680000E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1505992E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2634953E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1973443E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7225479E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7781125E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5715442E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2731228E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">119</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.919552</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.308806</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.472933</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5880809E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1309906E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5425934E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1086375E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7298612E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1340995E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3352487E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1470310E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4569982E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1108755E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4788459E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6224431E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1435972E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1689019E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2907243E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1366302E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7850570E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8800031E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5809691E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1740386E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">120</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.533500</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.829697</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.653789</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4777664E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1119670E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9367507E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4336809E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4336809E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1986510E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4966275E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9912918E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2182136E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5587679E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5117031E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5267787E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1507561E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1280381E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2292348E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1637008E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6286163E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6559097E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5585456E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2604145E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">121</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.522893</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.741036</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.419402</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8961863E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1908196E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1526557E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.0000000E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1144917E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3486810E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8717025E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3797605E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3546898E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7378571E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1096442E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1321181E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2247391E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2961984E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4700601E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3312712E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9952022E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1208712E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6301289E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3328683E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">122</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.365030</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.845737</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.097654</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4071613E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1221650E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7166143E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9346690E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3244800E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1616768E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4041919E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6301867E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2053887E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2794813E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4078220E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4114521E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3630085E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1034524E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1908519E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1270049E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4928496E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4922857E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5420556E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2576949E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">123</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.553319</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.780976</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.289055</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1247229E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4619991E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4240362E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1088200E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1830794E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5312941E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1328235E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2430197E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8700048E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1540525E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1078085E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8279354E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2501499E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2136222E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4814150E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2689234E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7805339E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5839723E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4437382E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3445377E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">124</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.534715</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.224351</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.227125</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1830233E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1892678E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1804112E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5551115E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1387779E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7253897E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1813474E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1836941E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5604703E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4356739E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2902980E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3992486E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1089506E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7674682E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1059004E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8162904E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1708233E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2316953E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7247077E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4778567E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">125</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.091795</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.548117</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.898379</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1874911E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3109223E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5204170E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1301043E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2775558E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7222852E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1805713E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1887802E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5859657E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4403443E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2967285E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4128857E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1161572E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7925486E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1088531E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8181517E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1696474E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2308213E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7280902E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4822660E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">126</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.501500</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.351622</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.035089</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8949316E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2368983E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9998946E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5389786E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2078893E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3659182E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9147956E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3971752E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3371933E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5183848E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1123969E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1333142E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2091730E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2956457E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4693110E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3474003E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1042289E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1265281E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6299569E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3333052E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">127</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.644709</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.651151</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">5.530592</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2179851E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1206892E-10</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3231845E-11</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1144379E-10</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2062468E-11</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8545741E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2136435E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2641851E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6366606E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1091457E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3691264E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5246092E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1554829E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9689188E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1293058E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1003982E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1887053E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2581062E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7493238E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5320367E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">128</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.608210</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.605568</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-6.430336</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2047009E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1316563E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1387779E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1110223E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6938894E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8039576E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2009894E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2309144E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6094146E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6757243E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3381361E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4752827E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1371466E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8910006E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1203322E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9296007E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1812915E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2473110E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7404509E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5127656E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">129</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.914745</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.192934</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.883523</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4817854E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2468890E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1054382E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1574554E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1582554E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1875638E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4689095E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8874120E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2343618E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2139119E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4957638E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5226182E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2685432E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1294762E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2314440E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1522017E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5455796E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5693987E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5594276E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2789725E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">130</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.361343</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.035254</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">4.988289</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1397010E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7547782E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3053113E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5967449E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3469447E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6025074E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1506269E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1098295E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4301796E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1852000E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2084122E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2661976E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5778538E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5353662E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7787523E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6333879E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1511292E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1981949E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6874666E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4191036E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">131</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.482387</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.829036</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.881512</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1144520E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5116694E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3663736E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3316791E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1325329E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4535766E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1133942E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6663605E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4098909E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6205391E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1530615E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1927288E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3966733E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4104085E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6208528E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4566384E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1233570E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1573138E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6610398E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3701763E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">132</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.748494</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.094837</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-6.554072</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2057304E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1965370E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4096029E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1538769E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1151995E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8011341E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2002835E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2318815E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6166973E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1047237E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3393795E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4784755E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1390960E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8969805E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1210241E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9277857E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1808512E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2469562E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7411585E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5130107E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">133</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.531721</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.076497</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.505961</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1712146E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5759096E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5174397E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2527885E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5099138E-18</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6414978E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1603744E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1044995E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1221760E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8312420E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1395728E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1187712E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2080162E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3259163E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7008715E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4593642E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2843251E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2203215E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4650158E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1615630E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">134</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.428524</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.449554</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">4.422420</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4855428E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1017077E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3391286E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5746920E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7675724E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1333912E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3334781E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1032583E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3338349E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1668974E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4078631E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4822481E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7438502E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1308243E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2335117E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1261485E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7038836E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7445129E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5602473E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1792178E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">135</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.704879</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.918104</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.311941</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2016545E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8341709E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7854828E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2400510E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1457168E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8205765E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2051441E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2303040E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5823364E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2010713E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3358676E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4665910E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1307235E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8733647E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1182881E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9443773E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1844099E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2508076E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7383368E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5121078E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">136</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.537476</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.434942</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.970631</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1679436E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1312262E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1227490E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3928802E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2468685E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6861773E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1715443E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1566788E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5133923E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7201905E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2611454E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3507465E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8960111E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6843366E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9601891E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7555857E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1652429E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2221303E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7127102E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4572577E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">137</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.036667</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.234082</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.037650</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3426859E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7742218E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1219511E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7608497E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7520026E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1329789E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3324472E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4078838E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1873516E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1802551E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3254390E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3184308E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7008210E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8220785E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1565815E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9998279E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4030284E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3840443E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5250163E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2480788E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">138</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.486494</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.206504</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.155266</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1481473E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3826471E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3747003E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1387779E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7632783E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5830425E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1457606E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1166665E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4902328E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1020079E+00</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2162682E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2867757E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7050753E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5789529E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8325018E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6244912E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1488645E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1979310E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6954374E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4195032E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">139</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.909368</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.822711</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.670295</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1226162E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7712252E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1479372E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7568945E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3677614E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4837277E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1209319E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7745188E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4311136E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1095550E+00</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1675136E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2140953E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4658169E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4498993E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6714361E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4953597E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1300427E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1679713E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6700553E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3809207E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">140</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-3.195362</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.611671</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.326263</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5123525E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3644513E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3014340E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1895689E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7762641E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1894041E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4735102E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6386206E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5539942E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3265956E+00</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3593938E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2452774E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1141164E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6523443E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1522324E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1109916E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8888068E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4744579E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4285186E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1248770E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">141</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.946065</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.662683</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.478116</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1852130E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3602883E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2636780E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1665335E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1804112E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7259232E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1814808E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1858459E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5712700E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2500990E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2937781E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4060754E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1122973E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7797347E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1073461E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8188846E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1695607E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2299693E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7263748E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4829447E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">142</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.393633</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.225719</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.283683</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2215357E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1773984E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1221245E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1276756E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1595946E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8938276E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2234569E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2803384E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6253154E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1154033E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3818563E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5402557E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1583994E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9900189E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1317208E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1053682E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1949679E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2662581E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7516041E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5404385E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">143</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.419226</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.191471</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.009399</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9403961E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2714235E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2398489E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1261422E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1521006E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3551480E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8878699E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4092074E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3773305E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4084533E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1150281E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1412691E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2624107E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3158393E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4965430E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3410334E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1000669E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1227344E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6360764E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3408053E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">144</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.197456</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.575475</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-4.089819</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1177760E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3701757E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3418625E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1400654E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2327647E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5266853E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1316713E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2652600E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7976698E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1714562E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1052859E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7890053E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2638541E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1979068E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4493119E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2752621E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9986997E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7209863E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4404664E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2756205E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">145</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.087505</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.761206</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.925944</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1768233E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2122299E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1015854E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1019324E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1559863E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7488384E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1872096E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1796770E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5126142E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4560146E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2847502E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3822909E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9754065E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7330004E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1018217E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8335565E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1747346E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2352371E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7198864E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4770416E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">146</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.663401</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.801971</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.941748</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3408805E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8586176E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4380177E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7253313E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1387779E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1406325E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3515812E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1985492E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1756027E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1775983E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3372851E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3229891E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1429604E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8163092E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1556338E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8910024E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1316276E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1247718E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5245064E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6769114E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">147</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.562688</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.099211</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">2.056902</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1462065E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9139672E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5793976E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6869505E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1665335E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5602224E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1400556E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1103756E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4991109E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9790638E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2098759E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2796961E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6982027E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5688624E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8201118E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5981512E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1435722E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1905495E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6936401E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4166205E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">148</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.016876</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.409224</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.710985</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3667153E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6211371E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4943962E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1886512E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3252607E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1521317E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3803294E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3023667E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1833475E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3159658E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3697736E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3592179E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1055573E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8998229E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1692595E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1026567E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2173960E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2096248E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5316232E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4722106E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">149</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.103046</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">5.825849</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.545863</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3387176E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1174318E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9319294E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6401401E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3174127E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1677263E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4193157E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6257791E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6761997E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8029930E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1930248E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8053653E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6123405E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1743822E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2153131E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1708488E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5841983E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1419808E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8099003E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2924500E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">150</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.780501</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.270751</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.172548</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7337376E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1381762E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1943094E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6303619E-17</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1214148E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3017920E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7544800E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1054745E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6326158E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2840474E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5825360E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4105920E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1719440E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1053027E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2488460E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1549791E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8264166E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5080697E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4231640E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1875314E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">151</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.266925</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.131674</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">3.739198</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1180909E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6731374E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1616762E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4954370E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4260481E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5099712E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1274928E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7729971E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3840857E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7208166E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1666088E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2057248E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3911601E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4278980E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6433406E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5165599E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1364822E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1748393E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6651189E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3784815E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">152</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.929046</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.264065</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-6.126870</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2042031E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2501854E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1110223E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8326673E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2081668E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7958844E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1989711E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2285999E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6131035E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8531096E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3359638E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4729566E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1369927E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8881129E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1199978E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9201332E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1803861E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2463281E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7401076E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5100909E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">153</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">+1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.020891</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.713595</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.150433</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1440912E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5073020E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1076687E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3757400E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3233917E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6586092E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1646523E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3431080E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8927181E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1438575E+01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1342662E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1038801E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3038608E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2589613E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5718939E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3407223E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8703226E-03</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6811195E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4528136E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3914896E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,+1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">154</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.151720</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.343643</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">3.439467</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2185123E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3347971E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1942890E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2636780E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6938894E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8828332E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2207083E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2723144E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6187679E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2012477E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3747509E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5287934E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1540426E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9720449E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1296639E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1036987E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1933009E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2638145E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7496648E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5364624E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">155</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.938989</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.547784</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.337500</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2251456E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1486421E-10</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9937523E-11</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1073089E-10</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2652989E-11</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8867113E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2216778E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2850096E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6475449E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5619610E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3870291E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5523804E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1653513E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1011586E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1341832E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1050539E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1939963E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2657220E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7538847E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5415254E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">156</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">3.130666</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.797787</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.144131</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3000329E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2419879E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2218012E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4610316E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8506989E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1466034E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3665086E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4938128E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6320488E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4798559E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1417464E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6500014E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5082550E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1483464E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1868779E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1415610E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5254444E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1209806E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7938145E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2694119E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">157</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">3.448589</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.545340</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.628812</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3357354E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1976250E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1078619E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1643121E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2056681E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1704218E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4260544E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6241379E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6557678E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4865566E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1816183E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7892910E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6076727E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1723381E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2130911E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1731650E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5905280E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1431173E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8087530E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2932375E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">158</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.357963</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.244420</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">2.992139</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2049831E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2324271E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4857226E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4857226E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2220446E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8319041E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2079760E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2374516E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5902961E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2393749E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3432631E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4785501E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1352870E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8926387E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1205218E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9610172E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1853094E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2519984E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7406452E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5186015E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">159</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.646619</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.708051</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.476969</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2103064E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2001077E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1915135E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4996004E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2949030E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8222190E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2055547E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2442779E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6233229E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.9890342E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3505815E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4956082E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1450267E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9236803E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1241068E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9575653E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1843670E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2520609E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7442623E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5193799E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">160</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">0.446124</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.755580</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">6.495213</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2186302E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2111942E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1040140E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4732326E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1776079E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8581378E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2145344E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2662275E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6371473E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1673881E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3708397E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5271450E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1563053E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9727443E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1297441E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1008939E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1893266E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2589903E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7497409E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5329094E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">161</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.867158</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.830717</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.889111</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3230431E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5642965E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2322497E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2777502E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4328343E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1671707E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4179267E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5864307E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6269320E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1631410E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1580682E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7340632E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5759949E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1637064E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2036904E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1672534E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5803786E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1384109E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8037021E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2881799E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">162</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.649208</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.666555</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">5.698167</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3411039E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2761453E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2101075E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1756304E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3556715E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1792574E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4481434E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6693351E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6401483E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1974711E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1793681E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8068796E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6275115E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1760221E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2170947E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1832668E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6213433E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1515575E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8108078E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2949525E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">163</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">3.160093</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">1.068937</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">5.925793</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3362941E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1068273E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8518102E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4426577E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4687006E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1698364E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4245911E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6252815E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6598537E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8744823E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1838859E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7923629E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6084770E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1727205E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2135070E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1726129E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5897452E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1429774E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8089690E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2926906E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">164</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-1.434594</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">0.730627</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-2.319075</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3238222E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3052495E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1025028E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2864303E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2506286E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1664288E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4160720E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5852945E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6322599E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4547927E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1610614E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7381948E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5771334E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1642330E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2042648E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1666764E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5776618E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1379046E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8040201E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2885364E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">165</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-0.507423</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-1.308093</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.291300</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2144525E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1127751E-10</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6291134E-11</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8972129E-11</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2665472E-11</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8593850E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2148462E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2601713E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6160899E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6462045E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3638385E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5128307E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1489922E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9480400E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1269100E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1005162E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1902941E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2599254E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7470177E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5282147E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">166</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.082115</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">4.223871</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.920267</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2975691E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3459393E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6057048E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3185956E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1204246E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1487579E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3718946E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4948187E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6143932E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1865340E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1328861E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6376669E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5047808E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1467244E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1850952E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1432235E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5322766E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1221678E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7926968E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2690772E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">167</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.672081</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-1.189808</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">0.711144</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5563212E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2037061E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1344515E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7981067E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1305728E-14</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1359572E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3398930E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1345638E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4109165E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2153598E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4593748E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5788565E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1194817E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1568505E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2728483E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1354860E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7710630E-02</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8498172E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5748634E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1757133E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">168</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.664279</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-0.963346</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-1.357250</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2647097E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5283968E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4433468E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1039373E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2680370E-13</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1126013E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2815032E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3683659E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6678612E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3557973E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1256730E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5328491E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4071762E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1255292E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1616393E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1014540E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4394742E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.9500720E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7766008E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2308530E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">169</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">1.830134</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">-2.409864</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-0.028088</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3387986E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4657575E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2473027E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.3934485E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3113990E-16</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1691477E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4228692E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6340509E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6707847E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5591759E-02</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1908442E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.8045577E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6137134E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1744378E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2153736E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1722191E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5908228E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1435410E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8099313E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2914903E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">170</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">2.157693</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">3.614252</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">-3.832161</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3299677E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8123992E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5170874E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1503352E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6082865E-15</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1717629E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4294071E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.6154882E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6321251E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1896551E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1661270E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.7616611E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.5955341E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1684019E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.2088080E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1733712E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5947430E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1431356E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.8064918E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2915060E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <module cmlx:templateRef="point">
                     <scalar dataType="xsd:integer" dictRef="a:id">171</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:rank">3</scalar>
                     <scalar dataType="xsd:integer" dictRef="a:signature">-1</scalar>
                     <list cmlx:templateRef="coords">
                        <scalar dataType="xsd:double" dictRef="cc:x3">-2.591442</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:y3">2.815999</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:z3">1.911762</scalar>
                     </list>
                     <module cmlx:templateRef="functions">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Rho</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2949385E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">|GRAD(Rho)|</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3644772E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)x</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2204072E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)y</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1322207E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">GRAD(Rho)z</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2584221E-12</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Laplacian</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1436995E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">(-1/4)Del**2(Rho))</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.3592486E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Diamond</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.4762146E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Metallicity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6266772E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ellipticity</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1782270E-01</scalar>
                        </list>
                     </module>
                     <module cmlx:templateRef="energycomp">
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Gb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1357225E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Vb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.6306936E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Hb(Abramov)</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.4949711E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ex_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1449975E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Ec_ueg</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1831955E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ex</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.1377324E+00</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_ec</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.5166062E-01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Delta_et</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">-0.1180579E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Pxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.7914904E+01</scalar>
                        </list>
                        <list>
                           <scalar dataType="xsd:string" dictRef="cc:parameter">Qxc</scalar>
                           <scalar dataType="xsd:double" dictRef="cc:value">0.2666100E+01</scalar>
                        </list>
                     </module>
                     <scalar dictRef="a:ranksignature">3,-1</scalar>
                  </module>
                  <list cmlx:templateRef="bondPaths">
                     <array dataType="xsd:integer" dictRef="a:bondPath" size="84">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</array>
                     <array dataType="xsd:integer" dictRef="a:cp" size="84">159 99 137 135 138 100 165 95 125 126 124 94 63 79 88 120 86 147 108 130 127 104 160 112 116 163 152 151 139 111 157 106 129 121 149 70 93 128 132 83 102 85 122 155 84 73 136 134 82 171 161 74 118 145 142 67 72 143 158 64 80 62 141 66 131 87 114 119 68 168 117 156 133 162 170 154 113 164 78 166 167 115 169 140</array>
                     <array dataType="xsd:integer" dictRef="x:atomInx1" size="84">1 1 1 1 1 1 2 2 2 2 2 2 3 3 4 4 4 4 6 6 6 6 6 6 7 8 9 10 11 11 11 12 12 13 13 14 15 15 15 15 15 16 16 16 16 16 17 18 18 21 21 21 22 22 22 22 22 22 23 24 24 24 24 25 26 26 27 29 30 31 32 32 35 36 38 39 42 43 47 47 48 48 48 49</array>
                     <array dataType="xsd:integer" dictRef="x:atomInx2" size="84">7 12 14 19 31 42 5 12 14 17 40 48 13 51 16 24 26 46 8 10 20 23 33 59 38 55 15 46 34 41 45 16 34 24 35 43 19 28 37 44 60 26 40 41 42 52 34 27 46 29 30 46 42 44 49 50 51 52 34 25 52 53 54 39 34 46 59 54 40 57 34 56 41 59 60 46 60 50 51 60 56 57 58 53</array>
                     <array dataType="xsd:double" dictRef="a:distance" size="84">1.765757 2.224825 2.520062 1.779951 1.907558 1.974409 1.756430 2.421430 1.815039 2.108535 1.821960 2.235584 1.651583 1.020743 2.208878 2.361029 2.412306 1.915932 1.994794 1.912593 1.751206 2.477067 1.749098 2.469918 1.924378 0.980099 1.777760 1.981527 1.988856 3.227576 0.980620 2.070953 2.383002 2.120845 0.979331 1.885678 2.510150 1.776143 1.774155 2.185750 2.430048 2.017950 2.446232 1.738639 2.025761 1.959923 1.853948 1.662926 1.779747 1.026115 0.996771 2.453002 2.309323 1.825420 1.742741 1.970548 2.019511 2.101040 1.771274 1.772471 2.515374 1.769481 1.816656 3.338395 2.013784 2.275552 1.006426 1.596829 1.761512 1.053643 1.947797 1.017112 2.136163 0.976886 0.989145 1.748716 3.168906 0.993169 1.617128 1.021956 1.626302 1.472166 0.976322 3.246003</array>
                     <array dataType="xsd:double" dictRef="a:length" size="84">1.765773 2.225157 2.521146 1.780225 1.908798 1.974861 1.756452 2.421490 1.815290 2.109091 1.822179 2.236040 1.652116 1.020844 2.209131 2.361363 2.416581 1.916207 1.996105 1.913276 1.751222 2.477348 1.749144 2.470970 1.930221 0.980204 1.777886 1.982042 1.990530 3.458584 0.980701 2.071131 2.383290 2.122271 0.979395 1.887103 2.510778 1.776201 1.774222 2.186473 2.431219 2.018106 2.446730 1.738648 2.026002 1.960116 1.854689 1.664942 1.779822 1.026221 0.996831 2.453632 2.309576 1.825977 1.742768 1.971939 2.020552 2.101617 1.771419 1.772519 2.515926 1.769517 1.816985 3.391233 2.014186 2.275905 1.006607 1.597778 1.764807 1.053713 1.948591 1.017201 2.171952 0.977023 0.989247 1.748761 3.189054 0.993286 1.618715 1.022126 1.630775 1.473026 0.976374 3.260516</array>
                     <array dataType="xsd:double" dictRef="a:steps" size="84">21 27 29 24 25 25 21 27 23 27 23 27 27 19 27 27 29 28 30 26 23 32 21 31 27 17 23 23 26 38 17 26 27 26 16 24 29 23 24 28 27 26 27 21 26 25 24 26 25 18 17 27 27 24 23 26 24 29 21 26 29 23 24 37 27 27 22 22 26 18 27 17 27 20 18 23 35 19 24 20 22 23 18 35</array>
                  </list>
               </module>
               <module cmlx:templateRef="mulliken" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="charges">
                     <list cmlx:templateRef="row" id="row">
                        <array dataType="xsd:integer" dictRef="cc:serial" size="60">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</array>
                        <array dataType="xsd:string" dictRef="cc:elementType" size="60">Mo Mo H O O Mo O O O O O O O O Mo Mo O O O O O Mo O Mo O O H O H H O O O Mo H H O H O O O O H O H Mo H O O O O O O O H H H H O O</array>
                        <array dataType="xsd:double" dictRef="x:charge" size="60">2.3860 2.2482 0.3195 -1.0420 -0.7852 2.1772 -0.8084 -0.8292 -0.8040 -0.9985 -0.7949 -1.1008 -0.8883 -0.8940 1.9233 2.7923 -0.8935 -0.8360 -0.8380 -0.7347 -0.7350 2.4163 -0.8751 2.0530 -0.8206 -1.0897 0.3672 -0.8102 0.3374 0.3534 -0.8338 -0.8172 -0.7374 2.6126 0.3041 0.3397 -0.8056 0.3220 -0.7397 -0.8921 -0.7277 -1.0789 0.3120 -0.9204 0.2722 2.3874 0.3773 -0.8394 -0.7376 -0.8167 -0.8631 -1.0092 -0.8048 -0.8894 0.2927 0.2896 0.3179 0.2919 -0.6891 -0.7132</array>
                        <array dataType="xsd:double" dictRef="a:orbitalS" size="60">0.2163 0.2259 0.5238 1.9485 1.9772 0.1668 1.9856 1.8793 1.9675 1.9441 1.8824 1.9368 1.8756 1.9737 0.1729 0.2227 1.9591 1.9751 1.9819 1.9814 1.8378 0.2083 1.9840 0.1827 1.9714 1.9431 0.4861 1.9673 0.5080 0.5098 1.8852 1.8807 1.9809 0.2077 0.5739 0.5750 1.9698 0.5551 1.9826 1.9743 1.9969 1.9434 0.5487 1.9582 0.6082 0.1888 0.4703 1.8650 1.9822 1.8750 1.8699 1.9572 1.9727 1.9589 0.5924 0.5401 0.4940 0.6066 1.8437 1.8326</array>
                        <array dataType="xsd:double" dictRef="a:orbitalP" size="60">-0.2518 -0.2138 0.1567 5.0699 4.7875 -0.1008 4.8004 4.9231 4.8187 5.0387 4.8867 5.1403 4.9836 4.8983 0.0412 -0.4636 4.9118 4.8387 4.8353 4.7322 4.8637 -0.3001 4.8702 -0.0306 4.8308 5.1222 0.1467 4.8249 0.1546 0.1367 4.9257 4.9109 4.7357 -0.3856 0.1220 0.0852 4.8176 0.1228 4.7354 4.8953 4.7050 5.1075 0.1393 4.9449 0.1196 -0.2135 0.1524 4.9430 4.7335 4.9166 4.9666 5.0283 4.8133 4.9118 0.1148 0.1703 0.1882 0.1015 4.8117 4.8481</array>
                        <array dataType="xsd:double" dictRef="a:orbitalD" size="60">3.6495 3.7397 0.0000 0.0236 0.0205 3.7568 0.0223 0.0269 0.0177 0.0157 0.0258 0.0237 0.0290 0.0219 3.8626 3.4486 0.0226 0.0222 0.0208 0.0211 0.0335 3.6754 0.0209 3.7949 0.0184 0.0245 0.0000 0.0180 0.0000 0.0000 0.0228 0.0256 0.0209 3.5653 0.0000 0.0000 0.0183 0.0000 0.0217 0.0225 0.0258 0.0280 0.0000 0.0173 0.0000 3.6373 0.0000 0.0313 0.0219 0.0251 0.0266 0.0236 0.0188 0.0187 0.0000 0.0000 0.0000 0.0000 0.0337 0.0326</array>
                        <array dataType="xsd:double" dictRef="a:orbitalF" size="60">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</array>
                     </list>
                  </module>
               </module>
               <module cmlx:templateRef="atomic.charges" dictRef="cc:userDefinedModule">
                  <list cmlx:templateRef="multipole">
                     <array dataType="xsd:integer" dictRef="cc:serial" size="60">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</array>
                     <array dataType="xsd:string" dictRef="cc:elementType" size="60">Mo Mo H O O Mo O O O O O O O O Mo Mo O O O O O Mo O Mo O O H O H H O O O Mo H H O H O O O O H O H Mo H O O O O O O O H H H H O O</array>
                     <array dataType="xsd:double" dictRef="a:mdcm" size="60">2.612351 2.592543 0.030618 -1.033418 -0.890788 2.605381 -0.825561 -0.637186 -0.939498 -1.036927 -0.631127 -1.127887 -0.622929 -0.926879 2.570301 2.636249 -0.958866 -0.821076 -0.933841 -0.858346 -0.364681 2.651702 -0.905089 2.577610 -0.953468 -1.076475 0.057364 -0.943457 0.046272 0.051221 -0.709463 -0.679196 -0.849514 2.659248 0.032231 0.107716 -0.936795 0.054045 -0.842095 -0.899902 -0.745221 -1.057479 0.033145 -0.987349 0.061547 2.625417 0.052804 -0.463894 -0.844839 -0.662789 -0.620775 -1.016467 -0.929935 -0.892778 0.071014 0.039875 0.039657 0.082056 -0.307394 -0.356979</array>
                     <array dataType="xsd:double" dictRef="a:mdcd" size="60">1.922055 1.921971 0.291282 -0.711220 -0.743858 1.981990 -0.692366 -0.849331 -0.828611 -0.771251 -0.829368 -0.690800 -0.887183 -0.763566 1.999007 1.925570 -0.765081 -0.713410 -0.747278 -0.724347 -0.728088 1.994404 -0.654014 1.967810 -0.826462 -0.684442 0.277016 -0.819114 0.249449 0.237979 -0.817246 -0.814049 -0.708905 1.931070 0.277595 0.404141 -0.816579 0.294480 -0.709294 -0.671156 -0.576335 -0.651652 0.235986 -0.781142 0.312832 1.955179 0.307132 -0.686659 -0.690918 -0.834763 -0.806586 -0.676849 -0.802799 -0.820939 0.355571 0.295306 0.283863 0.309676 -0.729615 -0.706090</array>
                     <array dataType="xsd:double" dictRef="a:mdcq" size="60">2.012645 2.020825 0.393004 -0.777454 -0.746800 2.169384 -0.734650 -0.887323 -0.860056 -0.840320 -0.841739 -0.729654 -0.945792 -0.858724 2.112534 1.919199 -0.811574 -0.753630 -0.762106 -0.770717 -0.784872 2.109302 -0.809581 2.083169 -0.843646 -0.741893 0.271053 -0.836696 0.350222 0.291144 -0.954283 -0.921306 -0.735446 2.086246 0.308077 0.469959 -0.827309 0.353806 -0.713435 -0.746114 -0.579253 -0.678481 0.294081 -0.870267 0.325077 2.079577 0.365374 -0.892194 -0.686870 -0.848017 -0.898599 -0.745443 -0.842754 -0.889772 0.403469 0.454025 0.512252 0.347145 -0.788585 -0.776216</array>
                  </list>
               </module>
               <module cmlx:templateRef="dipole.moment" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="cc:dipole" size="3">6.10176922 -77.50855470 20.13640422</array>
                  <scalar dataType="xsd:double" dictRef="x:dipole">80.31365023</scalar>
               </module>
               <module cmlx:templateRef="quadrupole.moment" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="cc:quadrupole" size="6">222.62005903 96.12718434 34.57928762 -24.60770894 68.16965423 -198.01235010</array>
               </module>
               <module cmlx:templateRef="bonding.energy" dictRef="cc:userDefinedModule">
                  <module cmlx:templateRef="summary">
                     <scalar dataType="xsd:double" dictRef="cc:eener" units="nonsi:electronvolt">-282.5701</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:kinener"
                             units="nonsi:electronvolt">-66.4706</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:coulombener"
                             units="nonsi:electronvolt">291.6249</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:xcener"
                             units="nonsi:electronvolt">-332.1612</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:solvener"
                             units="nonsi:electronvolt">-43.0300</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:total" units="nonsi:electronvolt">-432.6070</scalar>
                  </module>
               </module>
            </module>
         </module>
      </module>
   </module>
</module>
