<?xml version="1.0" encoding="UTF-8"?>
<module xmlns="http://www.xml-cml.org/schema"
        xmlns:v="http://www.iochem-bd.org/dictionary/vasp/"
        xmlns:xi="http://www.w3.org/2001/XInclude"
        xmlns:nonsi="http://www.xml-cml.org/unit/nonSi/"
        xmlns:xsd="http://www.w3.org/2001/XMLSchema"
        xmlns:convention="http://www.xml-cml.org/convention/"
        xmlns:cmlx="http://www.xml-cml.org/schema/cmlx"
        xmlns:cml="http://www.xml-cml.org/schema"
        xmlns:cc="http://www.xml-cml.org/dictionary/compchem/"
        xmlns:si="http://www.xml-cml.org/unit/si/"
        xmlns:nonsi2="http://www.iochem-bd.org/unit/nonSi2/"
        convention="convention:compchem"
        id="vasp.outcar">
   <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">vasp</scalar>
               </parameter>
               <parameter dictRef="cc:programVersion">
                  <scalar dataType="xsd:string">5.3.5</scalar>
               </parameter>
               <parameter dictRef="cc:subversion">
                  <scalar dataType="xsd:string">31Mar14 (build May 07 2014 16:01:45) complex</scalar>
               </parameter>
               <parameter dictRef="v:platform">
                  <scalar dataType="xsd:string">LinuxIFC</scalar>
               </parameter>
               <parameter dictRef="cc:rundate">
                  <scalar dataType="xsd:date">2018-06-27T13:08:23.000+02:00</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <molecule id="initial">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">7.95</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">7.95</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">20.152091</scalar>
                  <scalar id="sc4" title="alpha" units="nonsi:degree">90.0</scalar>
                  <scalar id="sc5" title="beta" units="nonsi:degree">90.0</scalar>
                  <scalar id="sc6" title="gamma" units="nonsi:degree">90.0</scalar>
               </crystal>
               <atomArray>
                  <atom elementType="H"
                        id="a1"
                        x3="1.01986996"
                        xFract="0.12828553"
                        y3="1.00985002"
                        yFract="0.12702516"
                        z3="8.9854099"
                        zFract="0.44587978"/>
                  <atom elementType="H"
                        id="a2"
                        x3="4.99032503"
                        xFract="0.62771384"
                        y3="1.01370498"
                        yFract="0.12751006"
                        z3="8.9854099"
                        zFract="0.44587978"/>
                  <atom elementType="H"
                        id="a3"
                        x3="3.0097327"
                        xFract="0.37858273"
                        y3="3.00797003"
                        yFract="0.37836101"
                        z3="8.9854099"
                        zFract="0.44587978"/>
                  <atom elementType="H"
                        id="a4"
                        x3="6.9796769"
                        xFract="0.87794678"
                        y3="3.00797003"
                        yFract="0.37836101"
                        z3="8.9854099"
                        zFract="0.44587978"/>
                  <atom elementType="H"
                        id="a5"
                        x3="1.01520498"
                        xFract="0.12769874"
                        y3="4.98877001"
                        yFract="0.62751824"
                        z3="8.9854099"
                        zFract="0.44587978"/>
                  <atom elementType="H"
                        id="a6"
                        x3="4.98992498"
                        xFract="0.62766352"
                        y3="4.98880499"
                        yFract="0.62752264"
                        z3="8.9854099"
                        zFract="0.44587978"/>
                  <atom elementType="H"
                        id="a7"
                        x3="3.00922001"
                        xFract="0.37851824"
                        y3="6.98689272"
                        yFract="0.87885443"
                        z3="8.9854099"
                        zFract="0.44587978"/>
                  <atom elementType="H"
                        id="a8"
                        x3="6.97916428"
                        xFract="0.8778823"
                        y3="6.98689272"
                        yFract="0.87885443"
                        z3="8.9854099"
                        zFract="0.44587978"/>
                  <atom elementType="Pt"
                        id="a9"
                        x3="0.0072"
                        xFract="0.00090566"
                        y3="0.00544996"
                        yFract="0.00068553"
                        z3="7.96325998"
                        zFract="0.395158"/>
                  <atom elementType="Pt"
                        id="a10"
                        x3="4.00636998"
                        xFract="0.50394591"
                        y3="0.01372003"
                        yFract="0.00172579"
                        z3="7.90023995"
                        zFract="0.39203078"/>
                  <atom elementType="Pt"
                        id="a11"
                        x3="0.01540002"
                        xFract="0.00193711"
                        y3="4.00522002"
                        yFract="0.50380126"
                        z3="7.9007899"
                        zFract="0.39205807"/>
                  <atom elementType="Pt"
                        id="a12"
                        x3="3.99488001"
                        xFract="0.50250063"
                        y3="3.99369999"
                        yFract="0.5023522"
                        z3="7.88936004"
                        zFract="0.39149089"/>
                  <atom elementType="Pt"
                        id="a13"
                        x3="2.02356001"
                        xFract="0.25453585"
                        y3="2.02223999"
                        yFract="0.25436981"
                        z3="7.96250991"
                        zFract="0.39512078"/>
                  <atom elementType="Pt"
                        id="a14"
                        x3="5.97427999"
                        xFract="0.75148176"
                        y3="2.01369"
                        yFract="0.25329434"
                        z3="7.90174995"
                        zFract="0.39210571"/>
                  <atom elementType="Pt"
                        id="a15"
                        x3="2.01501002"
                        xFract="0.25346038"
                        y3="5.97232"
                        yFract="0.75123522"
                        z3="7.90044006"
                        zFract="0.39204071"/>
                  <atom elementType="Pt"
                        id="a16"
                        x3="5.98497004"
                        xFract="0.75282642"
                        y3="5.98390999"
                        yFract="0.75269308"
                        z3="7.88947995"
                        zFract="0.39149684"/>
                  <atom elementType="Pt"
                        id="a17"
                        x3="0.02357"
                        xFract="0.00296478"
                        y3="2.00515003"
                        yFract="0.25222013"
                        z3="5.96153"
                        zFract="0.29582687"/>
                  <atom elementType="Pt"
                        id="a18"
                        x3="3.99032999"
                        xFract="0.5019283"
                        y3="2.00384003"
                        yFract="0.25205535"
                        z3="5.95025995"
                        zFract="0.29526762"/>
                  <atom elementType="Pt"
                        id="a19"
                        x3="0.02471003"
                        xFract="0.00310818"
                        y3="5.98909998"
                        yFract="0.75334591"
                        z3="5.95017007"
                        zFract="0.29526316"/>
                  <atom elementType="Pt"
                        id="a20"
                        x3="3.99274003"
                        xFract="0.50223145"
                        y3="5.98590003"
                        yFract="0.7529434"
                        z3="5.93930991"
                        zFract="0.29472425"/>
                  <atom elementType="Pt"
                        id="a21"
                        x3="2.00472002"
                        xFract="0.25216604"
                        y3="0.02415003"
                        yFract="0.00303774"
                        z3="5.96082005"
                        zFract="0.29579164"/>
                  <atom elementType="Pt"
                        id="a22"
                        x3="5.98904998"
                        xFract="0.75333962"
                        y3="0.02521001"
                        yFract="0.00317107"
                        z3="5.95105999"
                        zFract="0.29530732"/>
                  <atom elementType="Pt"
                        id="a23"
                        x3="2.00351003"
                        xFract="0.25201384"
                        y3="3.98975003"
                        yFract="0.50185535"
                        z3="5.95038993"
                        zFract="0.29527407"/>
                  <atom elementType="Pt"
                        id="a24"
                        x3="5.98581997"
                        xFract="0.75293333"
                        y3="3.99252999"
                        yFract="0.50220503"
                        z3="5.93972"
                        zFract="0.2947446"/>
                  <atom elementType="Pt"
                        id="a25"
                        x3="0.01867002"
                        xFract="0.00234843"
                        y3="0.02306001"
                        yFract="0.00290063"
                        z3="3.97172"
                        zFract="0.19708724"/>
                  <atom elementType="Pt"
                        id="a26"
                        x3="3.99064997"
                        xFract="0.50196855"
                        y3="0.02444999"
                        yFract="0.00307547"
                        z3="3.96413999"
                        zFract="0.1967111"/>
                  <atom elementType="Pt"
                        id="a27"
                        x3="0.02022003"
                        xFract="0.0025434"
                        y3="3.99425999"
                        yFract="0.50242264"
                        z3="3.96365997"
                        zFract="0.19668728"/>
                  <atom elementType="Pt"
                        id="a28"
                        x3="3.99152002"
                        xFract="0.50207799"
                        y3="3.99513004"
                        yFract="0.50253208"
                        z3="3.97197008"
                        zFract="0.19709965"/>
                  <atom elementType="Pt"
                        id="a29"
                        x3="2.00528002"
                        xFract="0.25223648"
                        y3="2.00931003"
                        yFract="0.2527434"
                        z3="3.97178992"
                        zFract="0.19709071"/>
                  <atom elementType="Pt"
                        id="a30"
                        x3="5.98357998"
                        xFract="0.75265157"
                        y3="2.00740998"
                        yFract="0.2525044"
                        z3="3.96360999"
                        zFract="0.1966848"/>
                  <atom elementType="Pt"
                        id="a31"
                        x3="2.00328003"
                        xFract="0.25198491"
                        y3="5.98771001"
                        yFract="0.75317107"
                        z3="3.96415994"
                        zFract="0.19671209"/>
                  <atom elementType="Pt"
                        id="a32"
                        x3="5.98264999"
                        xFract="0.75253459"
                        y3="5.98626001"
                        yFract="0.75298868"
                        z3="3.97236003"
                        zFract="0.197119"/>
                  <atom elementType="Pt"
                        id="a33"
                        x3="0.0159"
                        xFract="0.0020"
                        y3="2.01135"
                        yFract="0.2530"
                        z3="1.98749997"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a34"
                        x3="3.9909"
                        xFract="0.5020"
                        y3="2.01135"
                        yFract="0.2530"
                        z3="1.98749997"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a35"
                        x3="0.0159"
                        xFract="0.0020"
                        y3="5.98635"
                        yFract="0.7530"
                        z3="1.98749997"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a36"
                        x3="3.9909"
                        xFract="0.5020"
                        y3="5.98635"
                        yFract="0.7530"
                        z3="1.98749997"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a37"
                        x3="2.0034"
                        xFract="0.2520"
                        y3="0.02385"
                        yFract="0.0030"
                        z3="1.98749997"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a38"
                        x3="5.9784"
                        xFract="0.7520"
                        y3="0.02385"
                        yFract="0.0030"
                        z3="1.98749997"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a39"
                        x3="2.0034"
                        xFract="0.2520"
                        y3="3.99885"
                        yFract="0.5030"
                        z3="1.98749997"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a40"
                        x3="5.9784"
                        xFract="0.7520"
                        y3="3.99885"
                        yFract="0.5030"
                        z3="1.98749997"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a41"
                        x3="0.0159"
                        xFract="0.0020"
                        y3="0.02385"
                        yFract="0.0030"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a42"
                        x3="3.9909"
                        xFract="0.5020"
                        y3="0.02385"
                        yFract="0.0030"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a43"
                        x3="0.0159"
                        xFract="0.0020"
                        y3="3.99885"
                        yFract="0.5030"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a44"
                        x3="3.9909"
                        xFract="0.5020"
                        y3="3.99885"
                        yFract="0.5030"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a45"
                        x3="2.0034"
                        xFract="0.2520"
                        y3="2.01135"
                        yFract="0.2530"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a46"
                        x3="5.9784"
                        xFract="0.7520"
                        y3="2.01135"
                        yFract="0.2530"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a47"
                        x3="2.0034"
                        xFract="0.2520"
                        y3="5.98635"
                        yFract="0.7530"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a48"
                        x3="5.9784"
                        xFract="0.7520"
                        y3="5.98635"
                        yFract="0.7530"
                        z3="0.0000"
                        zFract="0.0000"/>
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               <bondArray>
                  <bond atomRefs2="a1 a9" order="S"/>
                  <bond atomRefs2="a1 a13" order="S"/>
                  <bond atomRefs2="a2 a10" order="S"/>
                  <bond atomRefs2="a2 a14" order="S"/>
                  <bond atomRefs2="a3 a12" order="S"/>
                  <bond atomRefs2="a3 a13" order="S"/>
                  <bond atomRefs2="a4 a14" order="S"/>
                  <bond atomRefs2="a5 a15" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a6 a12" order="S"/>
                  <bond atomRefs2="a6 a16" order="S"/>
                  <bond atomRefs2="a7 a15" order="S"/>
                  <bond atomRefs2="a8 a16" order="S"/>
                  <bond atomRefs2="a9 a13" order="S"/>
                  <bond atomRefs2="a9 a17" order="S"/>
                  <bond atomRefs2="a9 a21" order="S"/>
                  <bond atomRefs2="a10 a13" order="S"/>
                  <bond atomRefs2="a10 a14" order="S"/>
                  <bond atomRefs2="a10 a21" order="S"/>
                  <bond atomRefs2="a10 a18" order="S"/>
                  <bond atomRefs2="a10 a22" order="S"/>
                  <bond atomRefs2="a11 a13" order="S"/>
                  <bond atomRefs2="a11 a15" order="S"/>
                  <bond atomRefs2="a11 a17" order="S"/>
                  <bond atomRefs2="a11 a23" order="S"/>
                  <bond atomRefs2="a11 a19" order="S"/>
                  <bond atomRefs2="a12 a16" order="S"/>
                  <bond atomRefs2="a12 a14" order="S"/>
                  <bond atomRefs2="a12 a15" order="S"/>
                  <bond atomRefs2="a12 a13" order="S"/>
                  <bond atomRefs2="a12 a20" order="S"/>
                  <bond atomRefs2="a12 a24" order="S"/>
                  <bond atomRefs2="a12 a23" order="S"/>
                  <bond atomRefs2="a12 a18" order="S"/>
                  <bond atomRefs2="a13 a17" order="S"/>
                  <bond atomRefs2="a13 a21" order="S"/>
                  <bond atomRefs2="a13 a23" order="S"/>
                  <bond atomRefs2="a13 a18" order="S"/>
                  <bond atomRefs2="a14 a24" order="S"/>
                  <bond atomRefs2="a14 a22" order="S"/>
                  <bond atomRefs2="a14 a18" order="S"/>
                  <bond atomRefs2="a15 a19" order="S"/>
                  <bond atomRefs2="a15 a20" order="S"/>
                  <bond atomRefs2="a15 a23" order="S"/>
                  <bond atomRefs2="a16 a20" order="S"/>
                  <bond atomRefs2="a16 a24" order="S"/>
                  <bond atomRefs2="a17 a27" order="S"/>
                  <bond atomRefs2="a17 a25" order="S"/>
                  <bond atomRefs2="a17 a29" order="S"/>
                  <bond atomRefs2="a17 a23" order="S"/>
                  <bond atomRefs2="a17 a21" order="S"/>
                  <bond atomRefs2="a18 a24" order="S"/>
                  <bond atomRefs2="a18 a30" order="S"/>
                  <bond atomRefs2="a18 a22" order="S"/>
                  <bond atomRefs2="a18 a23" order="S"/>
                  <bond atomRefs2="a18 a28" order="S"/>
                  <bond atomRefs2="a18 a26" order="S"/>
                  <bond atomRefs2="a18 a21" order="S"/>
                  <bond atomRefs2="a18 a29" order="S"/>
                  <bond atomRefs2="a19 a27" order="S"/>
                  <bond atomRefs2="a19 a23" order="S"/>
                  <bond atomRefs2="a19 a31" order="S"/>
                  <bond atomRefs2="a20 a24" order="S"/>
                  <bond atomRefs2="a20 a23" order="S"/>
                  <bond atomRefs2="a20 a31" order="S"/>
                  <bond atomRefs2="a20 a28" order="S"/>
                  <bond atomRefs2="a20 a32" order="S"/>
                  <bond atomRefs2="a21 a26" order="S"/>
                  <bond atomRefs2="a21 a25" order="S"/>
                  <bond atomRefs2="a21 a29" order="S"/>
                  <bond atomRefs2="a22 a26" order="S"/>
                  <bond atomRefs2="a22 a30" order="S"/>
                  <bond atomRefs2="a23 a31" order="S"/>
                  <bond atomRefs2="a23 a27" order="S"/>
                  <bond atomRefs2="a23 a28" order="S"/>
                  <bond atomRefs2="a23 a29" order="S"/>
                  <bond atomRefs2="a24 a28" order="S"/>
                  <bond atomRefs2="a24 a30" order="S"/>
                  <bond atomRefs2="a24 a32" order="S"/>
                  <bond atomRefs2="a25 a29" order="S"/>
                  <bond atomRefs2="a25 a33" order="S"/>
                  <bond atomRefs2="a25 a37" order="S"/>
                  <bond atomRefs2="a26 a30" order="S"/>
                  <bond atomRefs2="a26 a29" order="S"/>
                  <bond atomRefs2="a26 a38" order="S"/>
                  <bond atomRefs2="a26 a37" order="S"/>
                  <bond atomRefs2="a26 a34" order="S"/>
                  <bond atomRefs2="a27 a31" order="S"/>
                  <bond atomRefs2="a27 a29" order="S"/>
                  <bond atomRefs2="a27 a35" order="S"/>
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                  <bond atomRefs2="a27 a33" order="S"/>
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                  <bond atomRefs2="a28 a30" order="S"/>
                  <bond atomRefs2="a28 a36" order="S"/>
                  <bond atomRefs2="a28 a39" order="S"/>
                  <bond atomRefs2="a28 a29" order="S"/>
                  <bond atomRefs2="a28 a40" order="S"/>
                  <bond atomRefs2="a28 a34" order="S"/>
                  <bond atomRefs2="a29 a39" order="S"/>
                  <bond atomRefs2="a29 a33" order="S"/>
                  <bond atomRefs2="a29 a34" order="S"/>
                  <bond atomRefs2="a29 a37" order="S"/>
                  <bond atomRefs2="a30 a34" order="S"/>
                  <bond atomRefs2="a30 a40" order="S"/>
                  <bond atomRefs2="a30 a38" order="S"/>
                  <bond atomRefs2="a31 a39" order="S"/>
                  <bond atomRefs2="a31 a36" order="S"/>
                  <bond atomRefs2="a31 a35" order="S"/>
                  <bond atomRefs2="a32 a36" order="S"/>
                  <bond atomRefs2="a32 a40" order="S"/>
                  <bond atomRefs2="a33 a37" order="S"/>
                  <bond atomRefs2="a33 a39" order="S"/>
                  <bond atomRefs2="a33 a41" order="S"/>
                  <bond atomRefs2="a33 a45" order="S"/>
                  <bond atomRefs2="a33 a43" order="S"/>
                  <bond atomRefs2="a34 a38" order="S"/>
                  <bond atomRefs2="a34 a37" order="S"/>
                  <bond atomRefs2="a34 a39" order="S"/>
                  <bond atomRefs2="a34 a40" order="S"/>
                  <bond atomRefs2="a34 a42" order="S"/>
                  <bond atomRefs2="a34 a45" order="S"/>
                  <bond atomRefs2="a34 a46" order="S"/>
                  <bond atomRefs2="a34 a44" order="S"/>
                  <bond atomRefs2="a35 a39" order="S"/>
                  <bond atomRefs2="a35 a47" order="S"/>
                  <bond atomRefs2="a35 a43" order="S"/>
                  <bond atomRefs2="a36 a39" order="S"/>
                  <bond atomRefs2="a36 a40" order="S"/>
                  <bond atomRefs2="a36 a47" order="S"/>
                  <bond atomRefs2="a36 a48" order="S"/>
                  <bond atomRefs2="a36 a44" order="S"/>
                  <bond atomRefs2="a37 a45" order="S"/>
                  <bond atomRefs2="a37 a41" order="S"/>
                  <bond atomRefs2="a37 a42" order="S"/>
                  <bond atomRefs2="a38 a46" order="S"/>
                  <bond atomRefs2="a38 a42" order="S"/>
                  <bond atomRefs2="a39 a43" order="S"/>
                  <bond atomRefs2="a39 a44" order="S"/>
                  <bond atomRefs2="a39 a47" order="S"/>
                  <bond atomRefs2="a39 a45" order="S"/>
                  <bond atomRefs2="a40 a48" order="S"/>
                  <bond atomRefs2="a40 a46" order="S"/>
                  <bond atomRefs2="a40 a44" order="S"/>
                  <bond atomRefs2="a41 a45" order="S"/>
                  <bond atomRefs2="a42 a45" order="S"/>
                  <bond atomRefs2="a42 a46" order="S"/>
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                  <bond atomRefs2="a44 a45" order="S"/>
                  <bond atomRefs2="a44 a47" order="S"/>
                  <bond atomRefs2="a44 a46" order="S"/>
                  <bond atomRefs2="a44 a48" order="S"/>
               </bondArray>
               <formula concise="H 8 Pt 40">
                  <atomArray count="8 40" elementType="H Pt"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">7803.120000000008</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1S/40Pt.8H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N: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;1;2;3;4;5;6;7;8/rA:48H2H2H2HH2H2HHPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPt/rB:;;;;;;;s1;s2;s5;s3s6;s1s3s9s10s11s12;s2s4s10s12;s5s7s11s12;s6s8s12;s9s11s13;s10s12s13s14;s11s15;s12s15s16;s9s10s13s17s18;s10s14s18;s11s12s13s15s17s18s19s20;s12s14s16s18s20;s17s21;s18s21s22;s17s19s23;s18s20s23s24;s17s18s21s23s25s26s27s28;s18s22s24s26s28;s19s20s23s27s28;s20s24s28;s25s27s29;s26s28s29s30;s27s31;s28s31s32;s25s26s29s33s34;s26s30s34;s27s28s29s31s33s34s35s36;s28s30s32s34s36;s33s37;s34s37s38;s33s35s39;s34s36s39s40;s33s34s37s39s41s42s43s44;s34s38s40s42s44;s35s36s39s43s44;s36s40s44;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
            <parameterList>
               <parameter dictRef="v:ispin">
                  <scalar dataType="xsd:integer">1</scalar>
               </parameter>
               <parameter dictRef="v:energyCutoff">
                  <scalar dataType="xsd:integer" units="nonsi:electronvolt">400</scalar>
               </parameter>
               <parameter dictRef="v:ediff">
                  <scalar dataType="xsd:double">0.1E-05</scalar>
               </parameter>
               <parameter dictRef="v:ediffg">
                  <scalar dataType="xsd:double">-.2E-01</scalar>
               </parameter>
               <parameter dictRef="v:ibrion">
                  <scalar dataType="xsd:integer">2</scalar>
               </parameter>
               <parameter dictRef="v:potim">
                  <scalar dataType="xsd:double">0.1500</scalar>
               </parameter>
               <parameter dictRef="cc:temp">
                  <scalar dataType="xsd:double" units="si:k">0.0</scalar>
               </parameter>
               <parameter dictRef="v:nelect">
                  <scalar dataType="xsd:double">408.0000</scalar>
               </parameter>
               <parameter dictRef="v:nupdown">
                  <scalar dataType="xsd:double">-1.0000</scalar>
               </parameter>
               <parameter dictRef="v:ismear">
                  <scalar dataType="xsd:integer">1</scalar>
               </parameter>
               <parameter dictRef="v:sigma">
                  <scalar dataType="xsd:double">0.20</scalar>
               </parameter>
               <parameter dictRef="v:ldipol">
                  <scalar dataType="xsd:string">T</scalar>
               </parameter>
               <parameter dictRef="v:idipol">
                  <scalar dataType="xsd:integer">3</scalar>
               </parameter>
               <parameter dictRef="v:gga">
                  <scalar dataType="xsd:string">PE</scalar>
               </parameter>
               <parameter dictRef="v:lexch">
                  <scalar dataType="xsd:string">8</scalar>
               </parameter>
               <parameter dictRef="v:voskown">
                  <scalar dataType="xsd:string">0</scalar>
               </parameter>
               <parameter dictRef="v:lhfcalc">
                  <scalar dataType="xsd:boolean">false</scalar>
               </parameter>
               <parameter dictRef="v:lhfone">
                  <scalar dataType="xsd:string">F</scalar>
               </parameter>
               <parameter dictRef="v:aexx">
                  <scalar dataType="xsd:double">0.0000</scalar>
               </parameter>
            </parameterList>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="potcar" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:string"
                         delimiter="|"
                         dictRef="v:pseudopotential"
                         size="2">PAW_PBE H 15Jun2001|PAW_PBE Pt 05Jan2001</array>
                  <array dictRef="cc:atomType" size="2">H Pt</array>
                  <array dataType="xsd:double" dictRef="cc:mass" size="2">1.000 195.080</array>
                  <array dataType="xsd:double" dictRef="cc:valence" size="2">1.000 10.000</array>
                  <array dataType="xsd:integer" dictRef="cc:atomcount" size="2">8 40</array>
               </module>
               <module cmlx:templateRef="lattice" dictRef="cc:userDefinedModule">
                  <array dataType="xsd:double" dictRef="cc:lattice" size="3">7.950000000 0.000000000 0.000000000</array>
                  <array dataType="xsd:double" dictRef="cc:lattice" size="3">0.000000000 7.950000000 0.000000000</array>
                  <array dataType="xsd:double" dictRef="cc:lattice" size="3">0.000000000 0.000000000 20.152091000</array>
               </module>
               <module cmlx:templateRef="kpoints"
                       dictRef="cc:userDefinedModule"
                       id="vasp.kpoints">
                  <scalar dataType="xsd:string" dictRef="v:meshScheme">Gamma</scalar>
                  <array dataType="xsd:integer" dictRef="v:subdivisionN" size="3">5 5 1</array>
                  <array dataType="xsd:double" dictRef="v:shiftS" size="3">0. 0. 0.</array>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation">
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="eigenvalues">
                  <list id="spin">
                     <scalar dataType="xsd:integer" dictRef="cc:spin">1</scalar>
                     <array dataType="xsd:integer" dictRef="cc:serial" size="13">1 2 3 4 5 6 7 8 9 10 11 12 13</array>
                     <array dataType="xsd:double" dictRef="cc:eigen" size="2964">-8.5950 -7.7142 -6.4969 -6.4118 -6.0068 -5.9847 -5.9844 -5.9841 -5.9838 -5.7912 -5.7873 -5.7302 -5.6604 -5.5132 -5.4963 -5.4953 -5.4930 -5.4921 -5.4868 -5.4865 -5.3482 -5.2167 -5.1718 -5.0807 -5.0533 -4.8311 -4.8308 -4.8302 -4.8298 -4.8292 -4.7892 -4.7057 -4.6747 -4.5971 -4.4095 -4.4020 -4.2136 -4.2135 -4.2130 -4.2128 -4.1410 -4.1408 -4.1407 -4.1404 -4.1277 -4.1219 -4.0701 -4.0394 -4.0392 -4.0387 -4.0385 -3.9689 -3.7373 -3.7372 -3.7365 -3.7364 -3.6630 -3.5945 -3.5943 -3.5937 -3.5936 -3.4308 -3.3864 -3.3859 -3.3858 -3.3855 -3.3436 -3.3433 -3.3432 -3.3429 -3.2986 -3.2984 -3.2982 -3.2981 -3.1075 -3.0953 -3.0200 -3.0085 -2.9705 -2.9359 -2.9229 -2.8718 -2.8286 -2.8103 -2.7436 -2.7433 -2.7430 -2.7426 -2.7271 -2.5520 -2.5431 -2.5404 -2.5401 -2.5390 -2.5389 -2.5385 -2.5287 -2.5216 -2.4966 -2.4825 -2.3724 -2.3494 -2.2805 -2.2452 -2.2447 -2.2433 -2.2427 -2.0999 -1.9198 -1.8930 -1.8567 -1.7911 -1.7613 -1.7585 -1.7116 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                     <array dataType="xsd:double" dictRef="v:totalspin1" size="301">0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 -0.1869E-30 -0.1324E-28 -0.8186E-27 -0.4368E-25 -0.2011E-23 -0.7985E-22 -0.2735E-20 -0.8075E-19 -0.2055E-17 -0.4361E-16 -0.8237E-15 -0.1336E-13 -0.1864E-12 -0.2237E-11 -0.2308E-10 -0.2045E-09 -0.1556E-08 -0.1015E-07 -0.5672E-07 -0.2713E-06 -0.1109E-05 -0.3868E-05 -0.1147E-04 -0.2876E-04 -0.6022E-04 -0.1024E-03 -0.1303E-03 -0.8312E-04 0.1369E-03 0.6366E-03 0.1468E-02 0.2548E-02 0.3624E-02 0.4343E-02 0.4430E-02 0.3907E-02 0.3178E-02 0.2861E-02 0.3398E-02 0.4692E-02 0.6070E-02 0.6685E-02 0.6093E-02 0.4599E-02 0.3084E-02 0.2460E-02 0.3170E-02 0.5037E-02 0.7459E-02 0.9720E-02 0.1127E-01 0.1194E-01 0.1197E-01 0.1178E-01 0.1165E-01 0.1150E-01 0.1101E-01 0.9905E-02 0.8231E-02 0.6525E-02 0.5757E-02 0.6868E-02 0.1006E-01 0.1442E-01 0.1831E-01 0.2031E-01 0.2002E-01 0.1813E-01 0.1604E-01 0.1503E-01 0.1560E-01 0.1734E-01 0.1947E-01 0.2154E-01 0.2360E-01 0.2573E-01 0.2767E-01 0.2917E-01 0.3065E-01 0.3319E-01 0.3775E-01 0.4394E-01 0.4984E-01 0.5309E-01 0.5278E-01 0.5052E-01 0.4974E-01 0.5359E-01 0.6276E-01 0.7481E-01 0.8563E-01 0.9200E-01 0.9368E-01 0.9314E-01 0.9317E-01 0.9453E-01 0.9588E-01 0.9595E-01 0.9526E-01 0.9552E-01 0.9759E-01 0.1004E+00 0.1021E+00 0.1016E+00 0.9929E-01 0.9670E-01 0.9538E-01 0.9591E-01 0.9763E-01 0.9938E-01 0.1006E+00 0.1015E+00 0.1025E+00 0.1031E+00 0.1023E+00 0.9941E-01 0.9473E-01 0.8969E-01 0.8597E-01 0.8452E-01 0.8496E-01 0.8615E-01 0.8759E-01 0.9039E-01 0.9657E-01 0.1071E+00 0.1200E+00 0.1312E+00 0.1365E+00 0.1346E+00 0.1278E+00 0.1202E+00 0.1144E+00 0.1111E+00 0.1091E+00 0.1079E+00 0.1082E+00 0.1113E+00 0.1181E+00 0.1292E+00 0.1443E+00 0.1616E+00 0.1779E+00 0.1892E+00 0.1936E+00 0.1919E+00 0.1856E+00 0.1754E+00 0.1605E+00 0.1414E+00 0.1214E+00 0.1055E+00 0.9734E-01 0.9707E-01 0.1020E+00 0.1085E+00 0.1141E+00 0.1185E+00 0.1231E+00 0.1286E+00 0.1339E+00 0.1370E+00 0.1361E+00 0.1317E+00 0.1263E+00 0.1231E+00 0.1246E+00 0.1302E+00 0.1367E+00 0.1405E+00 0.1404E+00 0.1382E+00 0.1363E+00 0.1354E+00 0.1350E+00 0.1346E+00 0.1345E+00 0.1345E+00 0.1338E+00 0.1320E+00 0.1304E+00 0.1311E+00 0.1344E+00 0.1376E+00 0.1370E+00 0.1315E+00 0.1240E+00 0.1188E+00 0.1181E+00 0.1210E+00 0.1253E+00 0.1293E+00 0.1323E+00 0.1342E+00 0.1355E+00 0.1369E+00 0.1393E+00 0.1419E+00 0.1427E+00 0.1405E+00 0.1364E+00 0.1336E+00 0.1350E+00 0.1404E+00 0.1467E+00 0.1495E+00 0.1464E+00 0.1364E+00 0.1204E+00 0.9961E-01 0.7628E-01 0.5401E-01 0.3704E-01 0.2834E-01 0.2790E-01 0.3275E-01 0.3861E-01 0.4182E-01 0.4058E-01 0.3520E-01 0.2776E-01 0.2117E-01 0.1776E-01 0.1816E-01 0.2114E-01 0.2462E-01 0.2694E-01 0.2758E-01 0.2706E-01 0.2646E-01 0.2668E-01 0.2819E-01 0.3077E-01 0.3366E-01 0.3567E-01 0.3575E-01 0.3352E-01 0.2949E-01 0.2470E-01 0.2026E-01 0.1693E-01 0.1500E-01 0.1421E-01 0.1396E-01 0.1372E-01 0.1347E-01 0.1356E-01 0.1416E-01 0.1489E-01 0.1507E-01 0.1421E-01 0.1233E-01 0.9769E-02 0.7082E-02 0.4835E-02 0.3371E-02 0.2596E-02 0.2099E-02 0.1534E-02 0.8724E-03 0.2965E-03 -0.4419E-04 -0.1537E-03 -0.1326E-03 -0.7742E-04 -0.3492E-04 -0.1275E-04 -0.3854E-05 -0.9763E-06 -0.2089E-06 -0.3797E-07 -0.5880E-08 -0.7780E-09 -0.8814E-10 -0.8561E-11 -0.7139E-12 -0.5115E-13 -0.3150E-14 -0.1684E-15 -0.7892E-17 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00 0.0000E+00</array>
                  </module>

               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:energies">
                  <module cmlx:templateRef="energies">
                     <scalar dataType="xsd:double"
                             dictRef="cc:freeEnergy"
                             units="nonsi:electronvolt">-273.37946812</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="v:noEntropyEnergy"
                             units="nonsi:electronvolt">-273.27077180</scalar>
                     <scalar dataType="xsd:double" dictRef="cc:e0" units="nonsi:electronvolt">-273.34323601</scalar>
                     <scalar dataType="xsd:double"
                             dictRef="cc:deltaEnergy"
                             units="nonsi:electronvolt">0.2120395E-03</scalar>
                     <scalar dataType="xsd:double" dictRef="v:efermi" units="nonsi:electronvolt">0.8139</scalar>
                  </module>
               </property>
            </propertyList>
            <molecule id="final">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">7.95</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">7.95</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">20.152091</scalar>
                  <scalar id="sc4" title="alpha" units="nonsi:degree">90.0</scalar>
                  <scalar id="sc5" title="beta" units="nonsi:degree">90.0</scalar>
                  <scalar id="sc6" title="gamma" units="nonsi:degree">90.0</scalar>
               </crystal>
               <atomArray>
                  <atom elementType="H"
                        id="a1"
                        x3="1.01351"
                        xFract="0.12748553"
                        y3="1.00918"
                        yFract="0.12694088"
                        z3="9.02892"
                        zFract="0.44803887"/>
                  <atom elementType="H"
                        id="a2"
                        x3="4.98703"
                        xFract="0.62729937"
                        y3="1.01044"
                        yFract="0.12709937"
                        z3="9.03319"
                        zFract="0.44825075"/>
                  <atom elementType="H"
                        id="a3"
                        x3="2.99718"
                        xFract="0.37700377"
                        y3="2.99515"
                        yFract="0.37674843"
                        z3="9.03108"
                        zFract="0.44814605"/>
                  <atom elementType="H"
                        id="a4"
                        x3="6.9728"
                        xFract="0.87708176"
                        y3="2.99844"
                        yFract="0.37716226"
                        z3="9.03342"
                        zFract="0.44826217"/>
                  <atom elementType="H"
                        id="a5"
                        x3="1.01207"
                        xFract="0.1273044"
                        y3="4.98537"
                        yFract="0.62709057"
                        z3="9.03353"
                        zFract="0.44826763"/>
                  <atom elementType="H"
                        id="a6"
                        x3="4.98691"
                        xFract="0.62728428"
                        y3="4.98564"
                        yFract="0.62712453"
                        z3="9.03359"
                        zFract="0.4482706"/>
                  <atom elementType="H"
                        id="a7"
                        x3="2.99883"
                        xFract="0.37721132"
                        y3="6.97176"
                        yFract="0.87695094"
                        z3="9.03324"
                        zFract="0.44825324"/>
                  <atom elementType="H"
                        id="a8"
                        x3="6.9743"
                        xFract="0.87727044"
                        y3="6.97534"
                        yFract="0.87740126"
                        z3="9.03135"
                        zFract="0.44815945"/>
                  <atom elementType="Pt"
                        id="a9"
                        x3="0.01579"
                        xFract="0.00198616"
                        y3="0.01825"
                        yFract="0.0022956"
                        z3="7.97512"
                        zFract="0.39574653"/>
                  <atom elementType="Pt"
                        id="a10"
                        x3="3.99123"
                        xFract="0.50204151"
                        y3="0.0183"
                        yFract="0.00230189"
                        z3="7.97845"
                        zFract="0.39591177"/>
                  <atom elementType="Pt"
                        id="a11"
                        x3="0.01611"
                        xFract="0.00202642"
                        y3="3.99355"
                        yFract="0.50233333"
                        z3="7.9786"
                        zFract="0.39591921"/>
                  <atom elementType="Pt"
                        id="a12"
                        x3="3.99123"
                        xFract="0.50204151"
                        y3="3.99347"
                        yFract="0.50232327"
                        z3="7.97996"
                        zFract="0.3959867"/>
                  <atom elementType="Pt"
                        id="a13"
                        x3="2.00327"
                        xFract="0.25198365"
                        y3="2.00538"
                        yFract="0.25224906"
                        z3="7.97482"
                        zFract="0.39573164"/>
                  <atom elementType="Pt"
                        id="a14"
                        x3="5.97899"
                        xFract="0.75207421"
                        y3="2.00604"
                        yFract="0.25233208"
                        z3="7.97804"
                        zFract="0.39589142"/>
                  <atom elementType="Pt"
                        id="a15"
                        x3="2.00383"
                        xFract="0.25205409"
                        y3="5.98096"
                        yFract="0.75232201"
                        z3="7.97811"
                        zFract="0.3958949"/>
                  <atom elementType="Pt"
                        id="a16"
                        x3="5.9784"
                        xFract="0.7520"
                        y3="5.98097"
                        yFract="0.75232327"
                        z3="7.97955"
                        zFract="0.39596635"/>
                  <atom elementType="Pt"
                        id="a17"
                        x3="0.01474"
                        xFract="0.00185409"
                        y3="2.00685"
                        yFract="0.25243396"
                        z3="5.94858"
                        zFract="0.29518426"/>
                  <atom elementType="Pt"
                        id="a18"
                        x3="3.99142"
                        xFract="0.50206541"
                        y3="2.00663"
                        yFract="0.25240629"
                        z3="5.94897"
                        zFract="0.29520361"/>
                  <atom elementType="Pt"
                        id="a19"
                        x3="0.01515"
                        xFract="0.00190566"
                        y3="5.98017"
                        yFract="0.75222264"
                        z3="5.94907"
                        zFract="0.29520857"/>
                  <atom elementType="Pt"
                        id="a20"
                        x3="3.99054"
                        xFract="0.50195472"
                        y3="5.98123"
                        yFract="0.75235597"
                        z3="5.94926"
                        zFract="0.295218"/>
                  <atom elementType="Pt"
                        id="a21"
                        x3="2.00373"
                        xFract="0.25204151"
                        y3="0.01801"
                        yFract="0.00226541"
                        z3="5.94854"
                        zFract="0.29518227"/>
                  <atom elementType="Pt"
                        id="a22"
                        x3="5.9771"
                        xFract="0.75183648"
                        y3="0.01872"
                        yFract="0.00235472"
                        z3="5.94918"
                        zFract="0.29521403"/>
                  <atom elementType="Pt"
                        id="a23"
                        x3="2.00355"
                        xFract="0.25201887"
                        y3="3.99468"
                        yFract="0.50247547"
                        z3="5.94913"
                        zFract="0.29521155"/>
                  <atom elementType="Pt"
                        id="a24"
                        x3="5.97805"
                        xFract="0.75195597"
                        y3="3.99403"
                        yFract="0.50239371"
                        z3="5.94946"
                        zFract="0.29522792"/>
                  <atom elementType="Pt"
                        id="a25"
                        x3="0.01544"
                        xFract="0.00194214"
                        y3="0.02251"
                        yFract="0.00283145"
                        z3="3.95926"
                        zFract="0.19646894"/>
                  <atom elementType="Pt"
                        id="a26"
                        x3="3.99023"
                        xFract="0.50191572"
                        y3="0.02276"
                        yFract="0.00286289"
                        z3="3.95925"
                        zFract="0.19646845"/>
                  <atom elementType="Pt"
                        id="a27"
                        x3="0.01595"
                        xFract="0.00200629"
                        y3="3.99687"
                        yFract="0.50275094"
                        z3="3.95936"
                        zFract="0.1964739"/>
                  <atom elementType="Pt"
                        id="a28"
                        x3="3.99055"
                        xFract="0.50195597"
                        y3="3.99705"
                        yFract="0.50277358"
                        z3="3.95866"
                        zFract="0.19643917"/>
                  <atom elementType="Pt"
                        id="a29"
                        x3="2.00305"
                        xFract="0.25195597"
                        y3="2.00985"
                        yFract="0.25281132"
                        z3="3.95941"
                        zFract="0.19647639"/>
                  <atom elementType="Pt"
                        id="a30"
                        x3="5.97835"
                        xFract="0.75199371"
                        y3="2.0093"
                        yFract="0.25274214"
                        z3="3.95949"
                        zFract="0.19648036"/>
                  <atom elementType="Pt"
                        id="a31"
                        x3="2.00276"
                        xFract="0.2519195"
                        y3="5.98519"
                        yFract="0.75285409"
                        z3="3.95927"
                        zFract="0.19646944"/>
                  <atom elementType="Pt"
                        id="a32"
                        x3="5.97812"
                        xFract="0.75196478"
                        y3="5.98478"
                        yFract="0.75280252"
                        z3="3.95843"
                        zFract="0.19642776"/>
                  <atom elementType="Pt"
                        id="a33"
                        x3="0.0159"
                        xFract="0.0020"
                        y3="2.01135"
                        yFract="0.2530"
                        z3="1.9875"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a34"
                        x3="3.9909"
                        xFract="0.5020"
                        y3="2.01135"
                        yFract="0.2530"
                        z3="1.9875"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a35"
                        x3="0.0159"
                        xFract="0.0020"
                        y3="5.98635"
                        yFract="0.7530"
                        z3="1.9875"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a36"
                        x3="3.9909"
                        xFract="0.5020"
                        y3="5.98635"
                        yFract="0.7530"
                        z3="1.9875"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a37"
                        x3="2.0034"
                        xFract="0.2520"
                        y3="0.02385"
                        yFract="0.0030"
                        z3="1.9875"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a38"
                        x3="5.9784"
                        xFract="0.7520"
                        y3="0.02385"
                        yFract="0.0030"
                        z3="1.9875"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a39"
                        x3="2.0034"
                        xFract="0.2520"
                        y3="3.99885"
                        yFract="0.5030"
                        z3="1.9875"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a40"
                        x3="5.9784"
                        xFract="0.7520"
                        y3="3.99885"
                        yFract="0.5030"
                        z3="1.9875"
                        zFract="0.098625"/>
                  <atom elementType="Pt"
                        id="a41"
                        x3="0.0159"
                        xFract="0.0020"
                        y3="0.02385"
                        yFract="0.0030"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a42"
                        x3="3.9909"
                        xFract="0.5020"
                        y3="0.02385"
                        yFract="0.0030"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a43"
                        x3="0.0159"
                        xFract="0.0020"
                        y3="3.99885"
                        yFract="0.5030"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a44"
                        x3="3.9909"
                        xFract="0.5020"
                        y3="3.99885"
                        yFract="0.5030"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a45"
                        x3="2.0034"
                        xFract="0.2520"
                        y3="2.01135"
                        yFract="0.2530"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a46"
                        x3="5.9784"
                        xFract="0.7520"
                        y3="2.01135"
                        yFract="0.2530"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a47"
                        x3="2.0034"
                        xFract="0.2520"
                        y3="5.98635"
                        yFract="0.7530"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a48"
                        x3="5.9784"
                        xFract="0.7520"
                        y3="5.98635"
                        yFract="0.7530"
                        z3="0.0000"
                        zFract="0.0000"/>
               </atomArray>
               <bondArray>
                  <bond atomRefs2="a1 a9" order="S"/>
                  <bond atomRefs2="a1 a13" order="S"/>
                  <bond atomRefs2="a2 a14" order="S"/>
                  <bond atomRefs2="a2 a10" order="S"/>
                  <bond atomRefs2="a3 a12" order="S"/>
                  <bond atomRefs2="a3 a13" order="S"/>
                  <bond atomRefs2="a4 a14" order="S"/>
                  <bond atomRefs2="a5 a15" order="S"/>
                  <bond atomRefs2="a5 a11" order="S"/>
                  <bond atomRefs2="a6 a12" order="S"/>
                  <bond atomRefs2="a6 a16" order="S"/>
                  <bond atomRefs2="a7 a15" order="S"/>
                  <bond atomRefs2="a8 a16" order="S"/>
                  <bond atomRefs2="a9 a17" order="S"/>
                  <bond atomRefs2="a9 a21" order="S"/>
                  <bond atomRefs2="a9 a13" order="S"/>
                  <bond atomRefs2="a10 a18" order="S"/>
                  <bond atomRefs2="a10 a21" order="S"/>
                  <bond atomRefs2="a10 a22" order="S"/>
                  <bond atomRefs2="a10 a14" order="S"/>
                  <bond atomRefs2="a10 a13" order="S"/>
                  <bond atomRefs2="a11 a23" order="S"/>
                  <bond atomRefs2="a11 a17" order="S"/>
                  <bond atomRefs2="a11 a19" order="S"/>
                  <bond atomRefs2="a11 a13" order="S"/>
                  <bond atomRefs2="a11 a15" order="S"/>
                  <bond atomRefs2="a12 a23" order="S"/>
                  <bond atomRefs2="a12 a20" order="S"/>
                  <bond atomRefs2="a12 a18" order="S"/>
                  <bond atomRefs2="a12 a24" order="S"/>
                  <bond atomRefs2="a12 a13" order="S"/>
                  <bond atomRefs2="a12 a14" order="S"/>
                  <bond atomRefs2="a12 a15" order="S"/>
                  <bond atomRefs2="a12 a16" order="S"/>
                  <bond atomRefs2="a13 a23" order="S"/>
                  <bond atomRefs2="a13 a17" order="S"/>
                  <bond atomRefs2="a13 a18" order="S"/>
                  <bond atomRefs2="a13 a21" order="S"/>
                  <bond atomRefs2="a14 a18" order="S"/>
                  <bond atomRefs2="a14 a24" order="S"/>
                  <bond atomRefs2="a14 a22" order="S"/>
                  <bond atomRefs2="a15 a19" order="S"/>
                  <bond atomRefs2="a15 a20" order="S"/>
                  <bond atomRefs2="a15 a23" order="S"/>
                  <bond atomRefs2="a16 a20" order="S"/>
                  <bond atomRefs2="a16 a24" order="S"/>
                  <bond atomRefs2="a17 a27" order="S"/>
                  <bond atomRefs2="a17 a21" order="S"/>
                  <bond atomRefs2="a17 a29" order="S"/>
                  <bond atomRefs2="a17 a23" order="S"/>
                  <bond atomRefs2="a17 a25" order="S"/>
                  <bond atomRefs2="a18 a28" order="S"/>
                  <bond atomRefs2="a18 a29" order="S"/>
                  <bond atomRefs2="a18 a30" order="S"/>
                  <bond atomRefs2="a18 a21" order="S"/>
                  <bond atomRefs2="a18 a23" order="S"/>
                  <bond atomRefs2="a18 a24" order="S"/>
                  <bond atomRefs2="a18 a26" order="S"/>
                  <bond atomRefs2="a18 a22" order="S"/>
                  <bond atomRefs2="a19 a31" order="S"/>
                  <bond atomRefs2="a19 a23" order="S"/>
                  <bond atomRefs2="a19 a27" order="S"/>
                  <bond atomRefs2="a20 a32" order="S"/>
                  <bond atomRefs2="a20 a31" order="S"/>
                  <bond atomRefs2="a20 a28" order="S"/>
                  <bond atomRefs2="a20 a24" order="S"/>
                  <bond atomRefs2="a20 a23" order="S"/>
                  <bond atomRefs2="a21 a29" order="S"/>
                  <bond atomRefs2="a21 a25" order="S"/>
                  <bond atomRefs2="a21 a26" order="S"/>
                  <bond atomRefs2="a22 a30" order="S"/>
                  <bond atomRefs2="a22 a26" order="S"/>
                  <bond atomRefs2="a23 a31" order="S"/>
                  <bond atomRefs2="a23 a28" order="S"/>
                  <bond atomRefs2="a23 a27" order="S"/>
                  <bond atomRefs2="a23 a29" order="S"/>
                  <bond atomRefs2="a24 a32" order="S"/>
                  <bond atomRefs2="a24 a28" order="S"/>
                  <bond atomRefs2="a24 a30" order="S"/>
                  <bond atomRefs2="a25 a29" order="S"/>
                  <bond atomRefs2="a25 a33" order="S"/>
                  <bond atomRefs2="a25 a37" order="S"/>
                  <bond atomRefs2="a26 a30" order="S"/>
                  <bond atomRefs2="a26 a29" order="S"/>
                  <bond atomRefs2="a26 a34" order="S"/>
                  <bond atomRefs2="a26 a38" order="S"/>
                  <bond atomRefs2="a26 a37" order="S"/>
                  <bond atomRefs2="a27 a31" order="S"/>
                  <bond atomRefs2="a27 a29" order="S"/>
                  <bond atomRefs2="a27 a35" order="S"/>
                  <bond atomRefs2="a27 a39" order="S"/>
                  <bond atomRefs2="a27 a33" order="S"/>
                  <bond atomRefs2="a28 a31" order="S"/>
                  <bond atomRefs2="a28 a30" order="S"/>
                  <bond atomRefs2="a28 a32" order="S"/>
                  <bond atomRefs2="a28 a29" order="S"/>
                  <bond atomRefs2="a28 a36" order="S"/>
                  <bond atomRefs2="a28 a40" order="S"/>
                  <bond atomRefs2="a28 a39" order="S"/>
                  <bond atomRefs2="a28 a34" order="S"/>
                  <bond atomRefs2="a29 a39" order="S"/>
                  <bond atomRefs2="a29 a34" order="S"/>
                  <bond atomRefs2="a29 a33" order="S"/>
                  <bond atomRefs2="a29 a37" order="S"/>
                  <bond atomRefs2="a30 a40" order="S"/>
                  <bond atomRefs2="a30 a34" order="S"/>
                  <bond atomRefs2="a30 a38" order="S"/>
                  <bond atomRefs2="a31 a36" order="S"/>
                  <bond atomRefs2="a31 a35" order="S"/>
                  <bond atomRefs2="a31 a39" order="S"/>
                  <bond atomRefs2="a32 a36" order="S"/>
                  <bond atomRefs2="a32 a40" order="S"/>
                  <bond atomRefs2="a33 a41" order="S"/>
                  <bond atomRefs2="a33 a37" order="S"/>
                  <bond atomRefs2="a33 a45" order="S"/>
                  <bond atomRefs2="a33 a43" order="S"/>
                  <bond atomRefs2="a33 a39" order="S"/>
                  <bond atomRefs2="a34 a42" order="S"/>
                  <bond atomRefs2="a34 a37" order="S"/>
                  <bond atomRefs2="a34 a38" order="S"/>
                  <bond atomRefs2="a34 a46" order="S"/>
                  <bond atomRefs2="a34 a45" order="S"/>
                  <bond atomRefs2="a34 a44" order="S"/>
                  <bond atomRefs2="a34 a39" order="S"/>
                  <bond atomRefs2="a34 a40" order="S"/>
                  <bond atomRefs2="a35 a47" order="S"/>
                  <bond atomRefs2="a35 a39" order="S"/>
                  <bond atomRefs2="a35 a43" order="S"/>
                  <bond atomRefs2="a36 a47" order="S"/>
                  <bond atomRefs2="a36 a48" order="S"/>
                  <bond atomRefs2="a36 a44" order="S"/>
                  <bond atomRefs2="a36 a39" order="S"/>
                  <bond atomRefs2="a36 a40" order="S"/>
                  <bond atomRefs2="a37 a45" order="S"/>
                  <bond atomRefs2="a37 a41" order="S"/>
                  <bond atomRefs2="a37 a42" order="S"/>
                  <bond atomRefs2="a38 a46" order="S"/>
                  <bond atomRefs2="a38 a42" order="S"/>
                  <bond atomRefs2="a39 a43" order="S"/>
                  <bond atomRefs2="a39 a47" order="S"/>
                  <bond atomRefs2="a39 a45" order="S"/>
                  <bond atomRefs2="a39 a44" order="S"/>
                  <bond atomRefs2="a40 a44" order="S"/>
                  <bond atomRefs2="a40 a48" order="S"/>
                  <bond atomRefs2="a40 a46" order="S"/>
                  <bond atomRefs2="a41 a45" order="S"/>
                  <bond atomRefs2="a42 a46" order="S"/>
                  <bond atomRefs2="a42 a45" order="S"/>
                  <bond atomRefs2="a43 a47" order="S"/>
                  <bond atomRefs2="a43 a45" order="S"/>
                  <bond atomRefs2="a44 a45" order="S"/>
                  <bond atomRefs2="a44 a46" order="S"/>
                  <bond atomRefs2="a44 a48" order="S"/>
                  <bond atomRefs2="a44 a47" order="S"/>
               </bondArray>
               <formula concise="H 8 Pt 40">
                  <atomArray count="8 40" elementType="H Pt"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">7803.120000000008</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1S/40Pt.8H">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N: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;1;2;3;4;5;6;7;8/rA:48H2H2H2HH2H2HHPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPtPt/rB:;;;;;;;s1;s2;s5;s3s6;s1s3s9s10s11s12;s2s4s10s12;s5s7s11s12;s6s8s12;s9s11s13;s10s12s13s14;s11s15;s12s15s16;s9s10s13s17s18;s10s14s18;s11s12s13s15s17s18s19s20;s12s14s16s18s20;s17s21;s18s21s22;s17s19s23;s18s20s23s24;s17s18s21s23s25s26s27s28;s18s22s24s26s28;s19s20s23s27s28;s20s24s28;s25s27s29;s26s28s29s30;s27s31;s28s31s32;s25s26s29s33s34;s26s30s34;s27s28s29s31s33s34s35s36;s28s30s32s34s36;s33s37;s34s37s38;s33s35s39;s34s36s39s40;s33s34s37s39s41s42s43s44;s34s38s40s42s44;s35s36s39s43s44;s36s40s44;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
         </module>
      </module>
   </module>
</module>
