<?xml version="1.0" encoding="UTF-8"?>
<module xmlns="http://www.xml-cml.org/schema"
        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:v="http://www.iochem-bd.org/dictionary/vasp/"
        xmlns:xi="http://www.w3.org/2001/XInclude"
        xmlns:xsd="http://www.w3.org/2001/XMLSchema"
        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">5.4.4</scalar>
               </parameter>
               <parameter dictRef="cc:subversion">
                  <scalar dataType="xsd:string">18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex</scalar>
               </parameter>
               <parameter dictRef="v:platform">
                  <scalar dataType="xsd:string">tekla2IFC</scalar>
               </parameter>
               <parameter dictRef="cc:rundate">
                  <scalar dataType="xsd:date">2022-09-15T04:11:23.000</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <molecule id="initial">
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                  <scalar id="sc2" title="b" units="nonsi:angstrom">8.417483999</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">20.0</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>
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                        xFract="0.1250"
                        y3="1.40291403"
                        yFract="0.16666667"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a2"
                        x3="4.208742"
                        xFract="0.3750"
                        y3="1.40291403"
                        yFract="0.16666667"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a3"
                        x3="7.01457"
                        xFract="0.6250"
                        y3="1.40291403"
                        yFract="0.16666667"
                        z3="0.0000"
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                        id="a4"
                        x3="9.820398"
                        xFract="0.8750"
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                        yFract="0.16666667"
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                        zFract="0.0000"/>
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                        xFract="0.1250"
                        y3="4.208742"
                        yFract="0.5000"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        id="a6"
                        x3="4.208742"
                        xFract="0.3750"
                        y3="4.208742"
                        yFract="0.5000"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a7"
                        x3="7.01457"
                        xFract="0.6250"
                        y3="4.208742"
                        yFract="0.5000"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a8"
                        x3="9.820398"
                        xFract="0.8750"
                        y3="4.208742"
                        yFract="0.5000"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a9"
                        x3="1.402914"
                        xFract="0.1250"
                        y3="7.01456997"
                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a10"
                        x3="4.208742"
                        xFract="0.3750"
                        y3="7.01456997"
                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a11"
                        x3="7.01457"
                        xFract="0.6250"
                        y3="7.01456997"
                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a12"
                        x3="9.820398"
                        xFract="0.8750"
                        y3="7.01456997"
                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a13"
                        x3="0.0000"
                        xFract="0.0000"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a14"
                        x3="2.805828"
                        xFract="0.2500"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a15"
                        x3="5.611656"
                        xFract="0.5000"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a16"
                        x3="8.417484"
                        xFract="0.7500"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a17"
                        x3="0.0000"
                        xFract="0.0000"
                        y3="2.80582797"
                        yFract="0.33333333"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a18"
                        x3="2.805828"
                        xFract="0.2500"
                        y3="2.80582797"
                        yFract="0.33333333"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a19"
                        x3="5.611656"
                        xFract="0.5000"
                        y3="2.80582797"
                        yFract="0.33333333"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a20"
                        x3="8.417484"
                        xFract="0.7500"
                        y3="2.80582797"
                        yFract="0.33333333"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a21"
                        x3="0.0000"
                        xFract="0.0000"
                        y3="5.61165603"
                        yFract="0.66666667"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a22"
                        x3="2.805828"
                        xFract="0.2500"
                        y3="5.61165603"
                        yFract="0.66666667"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a23"
                        x3="5.611656"
                        xFract="0.5000"
                        y3="5.61165603"
                        yFract="0.66666667"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a24"
                        x3="8.417484"
                        xFract="0.7500"
                        y3="5.61165603"
                        yFract="0.66666667"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a25"
                        x3="1.37759982"
                        xFract="0.1227445"
                        y3="1.38926996"
                        yFract="0.16504575"
                        z3="3.8994702"
                        zFract="0.19497351"/>
                  <atom elementType="Pt"
                        id="a26"
                        x3="4.21516634"
                        xFract="0.37557241"
                        y3="1.4005727"
                        yFract="0.16638852"
                        z3="3.9060302"
                        zFract="0.19530151"/>
                  <atom elementType="Pt"
                        id="a27"
                        x3="7.02600004"
                        xFract="0.62601842"
                        y3="1.40499651"
                        yFract="0.16691407"
                        z3="3.9195784"
                        zFract="0.19597892"/>
                  <atom elementType="Pt"
                        id="a28"
                        x3="9.81246682"
                        xFract="0.87429333"
                        y3="1.3976579"
                        yFract="0.16604224"
                        z3="3.9254842"
                        zFract="0.19627421"/>
                  <atom elementType="Pt"
                        id="a29"
                        x3="1.38613369"
                        xFract="0.12350487"
                        y3="4.1994379"
                        yFract="0.49889467"
                        z3="3.8964564"
                        zFract="0.19482282"/>
                  <atom elementType="Pt"
                        id="a30"
                        x3="4.21780595"
                        xFract="0.3758076"
                        y3="4.20685169"
                        yFract="0.49977543"
                        z3="3.9330284"
                        zFract="0.19665142"/>
                  <atom elementType="Pt"
                        id="a31"
                        x3="7.02858208"
                        xFract="0.62624848"
                        y3="4.20806397"
                        yFract="0.49991945"
                        z3="3.9161692"
                        zFract="0.19580846"/>
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                        id="a32"
                        x3="9.81493617"
                        xFract="0.87451335"
                        y3="4.20459235"
                        yFract="0.49950702"
                        z3="3.9166458"
                        zFract="0.19583229"/>
                  <atom elementType="Pt"
                        id="a33"
                        x3="1.38630282"
                        xFract="0.12351994"
                        y3="7.01277191"
                        yFract="0.83311972"
                        z3="3.9011146"
                        zFract="0.19505573"/>
                  <atom elementType="Pt"
                        id="a34"
                        x3="4.21426847"
                        xFract="0.37549241"
                        y3="7.01815456"
                        yFract="0.83375918"
                        z3="3.9014732"
                        zFract="0.19507366"/>
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                        id="a35"
                        x3="7.03675063"
                        xFract="0.6269763"
                        y3="7.02900065"
                        yFract="0.8350477"
                        z3="3.9079996"
                        zFract="0.19539998"/>
                  <atom elementType="Pt"
                        id="a36"
                        x3="9.81758084"
                        xFract="0.87474899"
                        y3="7.01993452"
                        yFract="0.83397064"
                        z3="3.9221916"
                        zFract="0.19610958"/>
                  <atom elementType="Pt"
                        id="a37"
                        x3="11.21791112"
                        xFract="0.99951878"
                        y3="8.41144908"
                        yFract="0.99928305"
                        z3="5.8483846"
                        zFract="0.29241923"/>
                  <atom elementType="Pt"
                        id="a38"
                        x3="2.80018312"
                        xFract="0.24949704"
                        y3="8.41608451"
                        yFract="0.99983374"
                        z3="5.8101962"
                        zFract="0.29050981"/>
                  <atom elementType="Pt"
                        id="a39"
                        x3="5.61329876"
                        xFract="0.50014637"
                        y3="0.00723247"
                        yFract="0.00085922"
                        z3="5.8375902"
                        zFract="0.29187951"/>
                  <atom elementType="Pt"
                        id="a40"
                        x3="8.42288488"
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                        y3="0.00255403"
                        yFract="0.00030342"
                        z3="5.8615626"
                        zFract="0.29307813"/>
                  <atom elementType="Pt"
                        id="a41"
                        x3="11.20743404"
                        xFract="0.99858527"
                        y3="2.80462587"
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                        z3="5.8425476"
                        zFract="0.29212738"/>
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                        id="a44"
                        x3="8.42957139"
                        xFract="0.75107699"
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                        z3="5.8610678"
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                  <bond atomRefs2="a22 a23" order="S"/>
                  <bond atomRefs2="a23 a31" order="S"/>
                  <bond atomRefs2="a23 a35" order="S"/>
                  <bond atomRefs2="a23 a24" order="S"/>
                  <bond atomRefs2="a23 a34" order="S"/>
                  <bond atomRefs2="a23 a30" order="S"/>
                  <bond atomRefs2="a24 a31" order="S"/>
                  <bond atomRefs2="a24 a35" order="S"/>
                  <bond atomRefs2="a24 a36" order="S"/>
                  <bond atomRefs2="a24 a32" order="S"/>
                  <bond atomRefs2="a25 a26" order="S"/>
                  <bond atomRefs2="a25 a42" order="S"/>
                  <bond atomRefs2="a25 a29" order="S"/>
                  <bond atomRefs2="a26 a30" order="S"/>
                  <bond atomRefs2="a26 a42" order="S"/>
                  <bond atomRefs2="a26 a27" order="S"/>
                  <bond atomRefs2="a26 a43" order="S"/>
                  <bond atomRefs2="a26 a39" order="S"/>
                  <bond atomRefs2="a27 a28" order="S"/>
                  <bond atomRefs2="a27 a40" order="S"/>
                  <bond atomRefs2="a27 a44" order="S"/>
                  <bond atomRefs2="a27 a43" order="S"/>
                  <bond atomRefs2="a27 a39" order="S"/>
                  <bond atomRefs2="a27 a31" order="S"/>
                  <bond atomRefs2="a28 a41" order="S"/>
                  <bond atomRefs2="a28 a40" order="S"/>
                  <bond atomRefs2="a28 a44" order="S"/>
                  <bond atomRefs2="a28 a32" order="S"/>
                  <bond atomRefs2="a29 a42" order="S"/>
                  <bond atomRefs2="a29 a30" order="S"/>
                  <bond atomRefs2="a29 a46" order="S"/>
                  <bond atomRefs2="a29 a33" order="S"/>
                  <bond atomRefs2="a30 a42" order="S"/>
                  <bond atomRefs2="a30 a46" order="S"/>
                  <bond atomRefs2="a30 a34" order="S"/>
                  <bond atomRefs2="a30 a31" order="S"/>
                  <bond atomRefs2="a30 a47" order="S"/>
                  <bond atomRefs2="a30 a43" order="S"/>
                  <bond atomRefs2="a31 a48" order="S"/>
                  <bond atomRefs2="a31 a32" order="S"/>
                  <bond atomRefs2="a31 a47" order="S"/>
                  <bond atomRefs2="a31 a35" order="S"/>
                  <bond atomRefs2="a31 a44" order="S"/>
                  <bond atomRefs2="a31 a43" order="S"/>
                  <bond atomRefs2="a32 a36" order="S"/>
                  <bond atomRefs2="a32 a48" order="S"/>
                  <bond atomRefs2="a32 a45" order="S"/>
                  <bond atomRefs2="a32 a41" order="S"/>
                  <bond atomRefs2="a32 a44" order="S"/>
                  <bond atomRefs2="a33 a38" order="S"/>
                  <bond atomRefs2="a33 a46" order="S"/>
                  <bond atomRefs2="a33 a34" order="S"/>
                  <bond atomRefs2="a34 a38" order="S"/>
                  <bond atomRefs2="a34 a46" order="S"/>
                  <bond atomRefs2="a34 a35" order="S"/>
                  <bond atomRefs2="a34 a47" order="S"/>
                  <bond atomRefs2="a35 a36" order="S"/>
                  <bond atomRefs2="a35 a48" order="S"/>
                  <bond atomRefs2="a35 a47" order="S"/>
                  <bond atomRefs2="a36 a37" order="S"/>
                  <bond atomRefs2="a36 a45" order="S"/>
                  <bond atomRefs2="a36 a48" order="S"/>
                  <bond atomRefs2="a37 a45" order="S"/>
                  <bond atomRefs2="a38 a46" order="S"/>
                  <bond atomRefs2="a39 a43" order="S"/>
                  <bond atomRefs2="a39 a40" order="S"/>
                  <bond atomRefs2="a40 a44" order="S"/>
                  <bond atomRefs2="a41 a44" order="S"/>
                  <bond atomRefs2="a41 a45" order="S"/>
                  <bond atomRefs2="a42 a46" order="S"/>
                  <bond atomRefs2="a42 a43" order="S"/>
                  <bond atomRefs2="a43 a44" order="S"/>
                  <bond atomRefs2="a43 a47" order="S"/>
                  <bond atomRefs2="a44 a48" order="S"/>
                  <bond atomRefs2="a45 a48" order="S"/>
                  <bond atomRefs2="a46 a47" order="S"/>
                  <bond atomRefs2="a47 a48" order="S"/>
                  <bond atomRefs2="a49 a57" order="S"/>
                  <bond atomRefs2="a50 a57" order="S"/>
                  <bond atomRefs2="a51 a57" order="S"/>
                  <bond atomRefs2="a52 a58" order="S"/>
                  <bond atomRefs2="a53 a58" order="S"/>
                  <bond atomRefs2="a54 a60" order="S"/>
                  <bond atomRefs2="a55 a60" order="S"/>
                  <bond atomRefs2="a56 a60" order="S"/>
                  <bond atomRefs2="a57 a58" order="S"/>
                  <bond atomRefs2="a58 a59" order="S"/>
                  <bond atomRefs2="a59 a61" order="S"/>
                  <bond atomRefs2="a59 a60" order="S"/>
               </bondArray>
               <formula concise="C4H8OPt48">
                  <atomArray count="4 8 1 48" elementType="C H O Pt"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">9427.78620000001</scalar>
               </property>
            </molecule>
            <parameterList>
               <parameter dictRef="v:nwrite">
                  <scalar dataType="xsd:integer">2</scalar>
               </parameter>
               <parameter dictRef="v:ispin">
                  <scalar dataType="xsd:integer">1</scalar>
               </parameter>
               <parameter dictRef="v:energyCutoff">
                  <scalar dataType="xsd:integer" units="nonsi:electronvolt">450</scalar>
               </parameter>
               <parameter dictRef="v:ediff">
                  <scalar dataType="xsd:double">0.1E-04</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">510.0000</scalar>
               </parameter>
               <parameter dictRef="v:nupdown">
                  <scalar dataType="xsd:double">-1.0000</scalar>
               </parameter>
               <parameter dictRef="v:ismear">
                  <scalar dataType="xsd:integer">0</scalar>
               </parameter>
               <parameter dictRef="v:sigma">
                  <scalar dataType="xsd:double">0.03</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>
               <parameter dictRef="v:vdwversion">
                  <scalar dataType="xsd:integer">2</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="4">PAW_PBE Pt 04Feb2005|PAW_PBE H 15Jun2001|PAW_PBE C 08Apr2002|PAW_PBE O 08Apr2002</array>
                  <array dictRef="cc:atomType" size="4">Pt H C O</array>
                  <array dataType="xsd:double" dictRef="cc:mass" size="4">195.080 1.000 12.011 16.000</array>
                  <array dataType="xsd:double" dictRef="cc:valence" size="4">10.000 1.000 4.000 6.000</array>
                  <array dataType="xsd:integer" dictRef="cc:atomcount" size="4">48 8 4 1</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="5">1 2 3 4 5</array>
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               </module>
            </module>
         </module>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:energies">
                  <module cmlx:templateRef="energies">
                     <array dataType="xsd:double"
                            dictRef="cc:freeEnergy"
                            size="1"
                            units="nonsi:electronvolt">-349.25706471</array>
                     <array dataType="xsd:double"
                            dictRef="v:noEntropyEnergy"
                            size="1"
                            units="nonsi:electronvolt">-349.21487197</array>
                     <array dataType="xsd:double"
                            dictRef="cc:e0"
                            size="1"
                            units="nonsi:electronvolt">-349.23596834</array>
                     <array dataType="xsd:double"
                            dictRef="v:efermi"
                            size="1"
                            units="nonsi:electronvolt">1.3885</array>
                     <array dataType="xsd:double"
                            dictRef="cc:deltaEnergy"
                            size="1"
                            units="nonsi:electronvolt">0.3260515E-04</array>
                  </module>
               </property>
            </propertyList>
            <molecule id="final">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">11.223311999</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">8.417483999</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">20.0</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>
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                        xFract="0.12499964"
                        y3="1.40291"
                        yFract="0.16666619"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a2"
                        x3="4.20874"
                        xFract="0.37499982"
                        y3="1.40291"
                        yFract="0.16666619"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Pt"
                        id="a3"
                        x3="7.01457"
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                        z3="0.0000"
                        zFract="0.0000"/>
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                        z3="0.0000"
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                        id="a5"
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                        yFract="0.49999976"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        yFract="0.49999976"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        zFract="0.0000"/>
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                        x3="9.8204"
                        xFract="0.87500018"
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                        yFract="0.49999976"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        id="a9"
                        x3="1.40291"
                        xFract="0.12499964"
                        y3="7.01457"
                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        id="a10"
                        x3="4.20874"
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                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        x3="7.01457"
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                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        id="a12"
                        x3="9.8204"
                        xFract="0.87500018"
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                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        x3="0.0000"
                        xFract="0.0000"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="1.98402"
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                        x3="2.80583"
                        xFract="0.25000018"
                        y3="0.0000"
                        yFract="0.0000"
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                        x3="5.61166"
                        xFract="0.50000036"
                        y3="0.0000"
                        yFract="0.0000"
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                        x3="0.0000"
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                        y3="2.80583"
                        yFract="0.33333357"
                        z3="1.98402"
                        zFract="0.099201"/>
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                        id="a19"
                        x3="5.61166"
                        xFract="0.50000036"
                        y3="2.80583"
                        yFract="0.33333357"
                        z3="1.98402"
                        zFract="0.099201"/>
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                        id="a20"
                        x3="8.41748"
                        xFract="0.74999964"
                        y3="2.80583"
                        yFract="0.33333357"
                        z3="1.98402"
                        zFract="0.099201"/>
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                        id="a21"
                        x3="0.0000"
                        xFract="0.0000"
                        y3="5.61166"
                        yFract="0.66666714"
                        z3="1.98402"
                        zFract="0.099201"/>
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                        id="a22"
                        x3="2.80583"
                        xFract="0.25000018"
                        y3="5.61166"
                        yFract="0.66666714"
                        z3="1.98402"
                        zFract="0.099201"/>
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                        id="a23"
                        x3="5.61166"
                        xFract="0.50000036"
                        y3="5.61166"
                        yFract="0.66666714"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a24"
                        x3="8.41748"
                        xFract="0.74999964"
                        y3="5.61166"
                        yFract="0.66666714"
                        z3="1.98402"
                        zFract="0.099201"/>
                  <atom elementType="Pt"
                        id="a25"
                        x3="1.3983"
                        xFract="0.12458889"
                        y3="1.39998"
                        yFract="0.16631811"
                        z3="3.91771"
                        zFract="0.1958855"/>
                  <atom elementType="Pt"
                        id="a26"
                        x3="4.20958"
                        xFract="0.37507467"
                        y3="1.40313"
                        yFract="0.16669233"
                        z3="3.91897"
                        zFract="0.1959485"/>
                  <atom elementType="Pt"
                        id="a27"
                        x3="7.01593"
                        xFract="0.62512118"
                        y3="1.40414"
                        yFract="0.16681232"
                        z3="3.92066"
                        zFract="0.196033"/>
                  <atom elementType="Pt"
                        id="a28"
                        x3="9.81946"
                        xFract="0.87491642"
                        y3="1.40251"
                        yFract="0.16661867"
                        z3="3.92165"
                        zFract="0.1960825"/>
                  <atom elementType="Pt"
                        id="a29"
                        x3="1.40122"
                        xFract="0.12484906"
                        y3="4.2098"
                        yFract="0.50012569"
                        z3="3.92001"
                        zFract="0.1960005"/>
                  <atom elementType="Pt"
                        id="a30"
                        x3="4.20748"
                        xFract="0.37488756"
                        y3="4.21016"
                        yFract="0.50016846"
                        z3="3.93091"
                        zFract="0.1965455"/>
                  <atom elementType="Pt"
                        id="a31"
                        x3="7.01602"
                        xFract="0.6251292"
                        y3="4.20846"
                        yFract="0.4999665"
                        z3="3.91976"
                        zFract="0.195988"/>
                  <atom elementType="Pt"
                        id="a32"
                        x3="9.8202"
                        xFract="0.87498236"
                        y3="4.20879"
                        yFract="0.5000057"
                        z3="3.92018"
                        zFract="0.196009"/>
                  <atom elementType="Pt"
                        id="a33"
                        x3="1.40226"
                        xFract="0.12494173"
                        y3="7.01325"
                        yFract="0.83317652"
                        z3="3.92108"
                        zFract="0.196054"/>
                  <atom elementType="Pt"
                        id="a34"
                        x3="4.20812"
                        xFract="0.37494458"
                        y3="7.01546"
                        yFract="0.83343907"
                        z3="3.91968"
                        zFract="0.195984"/>
                  <atom elementType="Pt"
                        id="a35"
                        x3="7.01915"
                        xFract="0.62540808"
                        y3="7.01784"
                        yFract="0.83372181"
                        z3="3.91739"
                        zFract="0.1958695"/>
                  <atom elementType="Pt"
                        id="a36"
                        x3="9.82129"
                        xFract="0.87507948"
                        y3="7.01609"
                        yFract="0.83351391"
                        z3="3.92171"
                        zFract="0.1960855"/>
                  <atom elementType="Pt"
                        id="a37"
                        x3="-0.00049"
                        xFract="-0.00004366"
                        y3="-0.00015"
                        yFract="-0.00001782"
                        z3="5.84319"
                        zFract="0.2921595"/>
                  <atom elementType="Pt"
                        id="a38"
                        x3="2.80726"
                        xFract="0.25012759"
                        y3="0.00042"
                        yFract="0.0000499"
                        z3="5.84237"
                        zFract="0.2921185"/>
                  <atom elementType="Pt"
                        id="a39"
                        x3="5.60995"
                        xFract="0.499848"
                        y3="0.00229"
                        yFract="0.00027205"
                        z3="5.84246"
                        zFract="0.292123"/>
                  <atom elementType="Pt"
                        id="a40"
                        x3="8.41776"
                        xFract="0.75002459"
                        y3="0.00108"
                        yFract="0.0001283"
                        z3="5.84295"
                        zFract="0.2921475"/>
                  <atom elementType="Pt"
                        id="a41"
                        x3="11.21984"
                        xFract="0.99969064"
                        y3="2.80725"
                        yFract="0.33350227"
                        z3="5.8423"
                        zFract="0.292115"/>
                  <atom elementType="Pt"
                        id="a42"
                        x3="2.79032"
                        xFract="0.24861823"
                        y3="2.78942"
                        yFract="0.33138406"
                        z3="5.82795"
                        zFract="0.2913975"/>
                  <atom elementType="Pt"
                        id="a43"
                        x3="5.62035"
                        xFract="0.50077464"
                        y3="2.79823"
                        yFract="0.33243069"
                        z3="5.84162"
                        zFract="0.292081"/>
                  <atom elementType="Pt"
                        id="a44"
                        x3="8.4205"
                        xFract="0.75026873"
                        y3="2.80769"
                        yFract="0.33355454"
                        z3="5.84371"
                        zFract="0.2921855"/>
                  <atom elementType="Pt"
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                        x3="11.21801"
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                        y3="5.61006"
                        yFract="0.66647706"
                        z3="5.84436"
                        zFract="0.292218"/>
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                        y3="5.62515"
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                        z3="5.84479"
                        zFract="0.2922395"/>
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                        y3="5.63042"
                        yFract="0.66889584"
                        z3="5.82664"
                        zFract="0.291332"/>
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                        yFract="0.66647825"
                        z3="5.84256"
                        zFract="0.292128"/>
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                        zFract="0.447671"/>
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                        zFract="0.4455365"/>
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                        yFract="0.51855281"
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                  <bond atomRefs2="a19 a31" order="S"/>
                  <bond atomRefs2="a19 a23" order="S"/>
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                  <bond atomRefs2="a20 a31" order="S"/>
                  <bond atomRefs2="a20 a24" order="S"/>
                  <bond atomRefs2="a20 a32" order="S"/>
                  <bond atomRefs2="a21 a33" order="S"/>
                  <bond atomRefs2="a21 a22" order="S"/>
                  <bond atomRefs2="a21 a29" order="S"/>
                  <bond atomRefs2="a22 a34" order="S"/>
                  <bond atomRefs2="a22 a33" order="S"/>
                  <bond atomRefs2="a22 a30" order="S"/>
                  <bond atomRefs2="a22 a29" order="S"/>
                  <bond atomRefs2="a22 a23" order="S"/>
                  <bond atomRefs2="a23 a31" order="S"/>
                  <bond atomRefs2="a23 a35" order="S"/>
                  <bond atomRefs2="a23 a24" order="S"/>
                  <bond atomRefs2="a23 a34" order="S"/>
                  <bond atomRefs2="a23 a30" order="S"/>
                  <bond atomRefs2="a24 a31" order="S"/>
                  <bond atomRefs2="a24 a35" order="S"/>
                  <bond atomRefs2="a24 a32" order="S"/>
                  <bond atomRefs2="a24 a36" order="S"/>
                  <bond atomRefs2="a25 a42" order="S"/>
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                  <bond atomRefs2="a25 a37" order="S"/>
                  <bond atomRefs2="a25 a26" order="S"/>
                  <bond atomRefs2="a25 a38" order="S"/>
                  <bond atomRefs2="a26 a42" order="S"/>
                  <bond atomRefs2="a26 a30" order="S"/>
                  <bond atomRefs2="a26 a38" order="S"/>
                  <bond atomRefs2="a26 a27" order="S"/>
                  <bond atomRefs2="a26 a39" order="S"/>
                  <bond atomRefs2="a26 a43" order="S"/>
                  <bond atomRefs2="a27 a28" order="S"/>
                  <bond atomRefs2="a27 a40" order="S"/>
                  <bond atomRefs2="a27 a44" order="S"/>
                  <bond atomRefs2="a27 a39" order="S"/>
                  <bond atomRefs2="a27 a43" order="S"/>
                  <bond atomRefs2="a27 a31" order="S"/>
                  <bond atomRefs2="a28 a41" order="S"/>
                  <bond atomRefs2="a28 a40" order="S"/>
                  <bond atomRefs2="a28 a44" order="S"/>
                  <bond atomRefs2="a28 a32" order="S"/>
                  <bond atomRefs2="a29 a42" order="S"/>
                  <bond atomRefs2="a29 a30" order="S"/>
                  <bond atomRefs2="a29 a46" order="S"/>
                  <bond atomRefs2="a29 a33" order="S"/>
                  <bond atomRefs2="a30 a42" order="S"/>
                  <bond atomRefs2="a30 a46" order="S"/>
                  <bond atomRefs2="a30 a34" order="S"/>
                  <bond atomRefs2="a30 a31" order="S"/>
                  <bond atomRefs2="a30 a47" order="S"/>
                  <bond atomRefs2="a30 a43" order="S"/>
                  <bond atomRefs2="a31 a32" order="S"/>
                  <bond atomRefs2="a31 a48" order="S"/>
                  <bond atomRefs2="a31 a47" order="S"/>
                  <bond atomRefs2="a31 a35" order="S"/>
                  <bond atomRefs2="a31 a44" order="S"/>
                  <bond atomRefs2="a31 a43" order="S"/>
                  <bond atomRefs2="a32 a36" order="S"/>
                  <bond atomRefs2="a32 a45" order="S"/>
                  <bond atomRefs2="a32 a48" order="S"/>
                  <bond atomRefs2="a32 a41" order="S"/>
                  <bond atomRefs2="a32 a44" order="S"/>
                  <bond atomRefs2="a33 a46" order="S"/>
                  <bond atomRefs2="a33 a34" order="S"/>
                  <bond atomRefs2="a34 a46" order="S"/>
                  <bond atomRefs2="a34 a35" order="S"/>
                  <bond atomRefs2="a34 a47" order="S"/>
                  <bond atomRefs2="a35 a48" order="S"/>
                  <bond atomRefs2="a35 a47" order="S"/>
                  <bond atomRefs2="a35 a36" order="S"/>
                  <bond atomRefs2="a36 a45" order="S"/>
                  <bond atomRefs2="a36 a48" order="S"/>
                  <bond atomRefs2="a37 a38" order="S"/>
                  <bond atomRefs2="a38 a42" order="S"/>
                  <bond atomRefs2="a38 a39" order="S"/>
                  <bond atomRefs2="a39 a43" order="S"/>
                  <bond atomRefs2="a39 a40" order="S"/>
                  <bond atomRefs2="a40 a44" order="S"/>
                  <bond atomRefs2="a41 a44" order="S"/>
                  <bond atomRefs2="a41 a45" order="S"/>
                  <bond atomRefs2="a42 a46" order="S"/>
                  <bond atomRefs2="a42 a43" order="S"/>
                  <bond atomRefs2="a43 a44" order="S"/>
                  <bond atomRefs2="a43 a47" order="S"/>
                  <bond atomRefs2="a44 a48" order="S"/>
                  <bond atomRefs2="a45 a48" order="S"/>
                  <bond atomRefs2="a46 a47" order="S"/>
                  <bond atomRefs2="a47 a48" order="S"/>
                  <bond atomRefs2="a49 a57" order="S"/>
                  <bond atomRefs2="a50 a57" order="S"/>
                  <bond atomRefs2="a51 a57" order="S"/>
                  <bond atomRefs2="a52 a58" order="S"/>
                  <bond atomRefs2="a53 a58" order="S"/>
                  <bond atomRefs2="a54 a60" order="S"/>
                  <bond atomRefs2="a55 a60" order="S"/>
                  <bond atomRefs2="a56 a60" order="S"/>
                  <bond atomRefs2="a57 a58" order="S"/>
                  <bond atomRefs2="a58 a59" order="S"/>
                  <bond atomRefs2="a59 a60" order="S"/>
                  <bond atomRefs2="a59 a61" order="S"/>
               </bondArray>
               <formula concise="C4H8OPt48">
                  <atomArray count="4 8 1 48" elementType="C H O Pt"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">9427.78620000001</scalar>
               </property>
            </molecule>
         </module>
      </module>
   </module>
</module>
