<?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 Jun 30 2017 19:19:18) complex</scalar>
               </parameter>
               <parameter dictRef="v:platform">
                  <scalar dataType="xsd:string">MareNostrum4</scalar>
               </parameter>
               <parameter dictRef="cc:rundate">
                  <scalar dataType="xsd:date">2022-09-20T04:38:52.000</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
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                  <scalar id="sc2" title="b" units="nonsi:angstrom">10.951864001</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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                        z3="0.0000"
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                        xFract="0.5000"
                        y3="1.368983"
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                        z3="0.0000"
                        zFract="0.0000"/>
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                        z3="0.0000"
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                        xFract="0.16666667"
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                        z3="0.0000"
                        zFract="0.0000"/>
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                        x3="5.80810298"
                        xFract="0.5000"
                        y3="6.844915"
                        yFract="0.6250"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        id="a9"
                        x3="9.68017159"
                        xFract="0.83333333"
                        y3="6.844915"
                        yFract="0.6250"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        xFract="0.16666667"
                        y3="9.582881"
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                        z3="0.0000"
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                        y3="9.582881"
                        yFract="0.8750"
                        z3="0.0000"
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                        z3="0.0000"
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                        y3="0.0000"
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                        z3="1.368983"
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                        xFract="0.33333333"
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                        yFract="0.0000"
                        z3="1.368983"
                        zFract="0.06844915"/>
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                        yFract="0.0000"
                        z3="1.368983"
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                        x3="3.87206861"
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                        yFract="0.2500"
                        z3="1.368983"
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                        xFract="0.66666667"
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                        yFract="0.2500"
                        z3="1.368983"
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                        x3="0.0000"
                        xFract="0.0000"
                        y3="5.475932"
                        yFract="0.5000"
                        z3="1.368983"
                        zFract="0.06844915"/>
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                        id="a20"
                        x3="3.87206861"
                        xFract="0.33333333"
                        y3="5.475932"
                        yFract="0.5000"
                        z3="1.368983"
                        zFract="0.06844915"/>
                  <atom elementType="Ir"
                        id="a21"
                        x3="7.74413734"
                        xFract="0.66666667"
                        y3="5.475932"
                        yFract="0.5000"
                        z3="1.368983"
                        zFract="0.06844915"/>
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                        x3="0.0000"
                        xFract="0.0000"
                        y3="8.213898"
                        yFract="0.7500"
                        z3="1.368983"
                        zFract="0.06844915"/>
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                        id="a23"
                        x3="3.87206861"
                        xFract="0.33333333"
                        y3="8.213898"
                        yFract="0.7500"
                        z3="1.368983"
                        zFract="0.06844915"/>
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                        id="a24"
                        x3="7.74413734"
                        xFract="0.66666667"
                        y3="8.213898"
                        yFract="0.7500"
                        z3="1.368983"
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                        id="a25"
                        x3="1.93603436"
                        xFract="0.16666667"
                        y3="1.368983"
                        yFract="0.1250"
                        z3="2.737966"
                        zFract="0.1368983"/>
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                        id="a26"
                        x3="5.80810298"
                        xFract="0.5000"
                        y3="1.368983"
                        yFract="0.1250"
                        z3="2.737966"
                        zFract="0.1368983"/>
                  <atom elementType="Ir"
                        id="a27"
                        x3="9.68017159"
                        xFract="0.83333333"
                        y3="1.368983"
                        yFract="0.1250"
                        z3="2.737966"
                        zFract="0.1368983"/>
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                        id="a28"
                        x3="1.93603436"
                        xFract="0.16666667"
                        y3="4.106949"
                        yFract="0.3750"
                        z3="2.737966"
                        zFract="0.1368983"/>
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                        id="a29"
                        x3="5.80810298"
                        xFract="0.5000"
                        y3="4.106949"
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                        z3="2.737966"
                        zFract="0.1368983"/>
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                        y3="6.844915"
                        yFract="0.6250"
                        z3="2.737966"
                        zFract="0.1368983"/>
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                        x3="9.68017159"
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                        y3="6.844915"
                        yFract="0.6250"
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                        xFract="0.5000"
                        y3="9.582881"
                        yFract="0.8750"
                        z3="2.737966"
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                        y3="0.01745552"
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                        z3="4.0721946"
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                        xFract="0.66686108"
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                  <bond atomRefs2="a60 a70" order="S"/>
                  <bond atomRefs2="a61 a64" order="S"/>
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                  <bond atomRefs2="a63 a66" order="S"/>
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                  <bond atomRefs2="a66 a69" order="S"/>
                  <bond atomRefs2="a67 a70" order="S"/>
                  <bond atomRefs2="a68 a71" order="S"/>
                  <bond atomRefs2="a68 a74" order="S"/>
                  <bond atomRefs2="a69 a72" order="S"/>
                  <bond atomRefs2="a73 a83" order="S"/>
                  <bond atomRefs2="a74 a83" order="S"/>
                  <bond atomRefs2="a75 a83" order="S"/>
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                  <bond atomRefs2="a77 a85" order="S"/>
                  <bond atomRefs2="a78 a85" order="S"/>
                  <bond atomRefs2="a79 a84" order="S"/>
                  <bond atomRefs2="a80 a86" order="S"/>
                  <bond atomRefs2="a81 a86" order="S"/>
                  <bond atomRefs2="a82 a86" order="S"/>
                  <bond atomRefs2="a83 a84" order="S"/>
                  <bond atomRefs2="a84 a86" order="S"/>
                  <bond atomRefs2="a84 a85" order="S"/>
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               <formula concise="C4H10Ir72">
                  <atomArray count="4 10 72" elementType="C H Ir"/>
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                  <scalar units="unit:dalton">13887.666800000014</scalar>
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            <parameterList>
               <parameter dictRef="v:nwrite">
                  <scalar dataType="xsd:integer">2</scalar>
               </parameter>
               <parameter dictRef="v:ispin">
                  <scalar dataType="xsd:integer">1</scalar>
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               <parameter dictRef="v:energyCutoff">
                  <scalar dataType="xsd:integer" units="nonsi:electronvolt">450</scalar>
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               <parameter dictRef="v:ediff">
                  <scalar dataType="xsd:double">0.1E-04</scalar>
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               <parameter dictRef="v:ediffg">
                  <scalar dataType="xsd:double">-.2E-01</scalar>
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               <parameter dictRef="v:ibrion">
                  <scalar dataType="xsd:integer">2</scalar>
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               <parameter dictRef="v:potim">
                  <scalar dataType="xsd:double">0.1500</scalar>
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               <parameter dictRef="cc:temp">
                  <scalar dataType="xsd:double" units="si:k">0.0</scalar>
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               <parameter dictRef="v:nelect">
                  <scalar dataType="xsd:double">674.0000</scalar>
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               <parameter dictRef="v:nupdown">
                  <scalar dataType="xsd:double">-1.0000</scalar>
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               <parameter dictRef="v:ismear">
                  <scalar dataType="xsd:integer">0</scalar>
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               <parameter dictRef="v:sigma">
                  <scalar dataType="xsd:double">0.03</scalar>
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               <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>
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               <parameter dictRef="v:lexch">
                  <scalar dataType="xsd:string">8</scalar>
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               <parameter dictRef="v:voskown">
                  <scalar dataType="xsd:string">0</scalar>
               </parameter>
               <parameter dictRef="v:lhfcalc">
                  <scalar dataType="xsd:boolean">false</scalar>
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               <parameter dictRef="v:lhfone">
                  <scalar dataType="xsd:string">F</scalar>
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               <parameter dictRef="v:aexx">
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               <parameter dictRef="v:vdwversion">
                  <scalar dataType="xsd:integer">2</scalar>
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                         dictRef="v:pseudopotential"
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         </module>
         <module dictRef="cc:calculation" id="calculation">
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-0.008377 -0.001273 -0.005157 -0.002830 -0.008807 -0.009215 -0.002632 0.014144 -0.017786 -0.005433 -0.002871 0.008006 -0.017261 0.003611 0.013841 0.007101 -0.000611 -0.009711 -0.007459 -0.005524 0.003884 0.006876 0.001007 0.002561 -0.005918 -0.005862 -0.000467 -0.004896 -0.005967</matrix>
               </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">-672.11217443</array>
                     <array dataType="xsd:double"
                            dictRef="v:noEntropyEnergy"
                            size="1"
                            units="nonsi:electronvolt">-672.04385994</array>
                     <array dataType="xsd:double"
                            dictRef="cc:e0"
                            size="1"
                            units="nonsi:electronvolt">-672.07801718</array>
                     <array dataType="xsd:double"
                            dictRef="v:efermi"
                            size="1"
                            units="nonsi:electronvolt">1.3975</array>
                     <array dataType="xsd:double"
                            dictRef="cc:deltaEnergy"
                            size="1"
                            units="nonsi:electronvolt">0.8871737E-04</array>
                  </module>
               </property>
            </propertyList>
            <molecule id="final">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">11.616205953</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">10.951864001</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>
               <atomArray>
                  <atom elementType="Ir"
                        id="a1"
                        x3="1.93603"
                        xFract="0.16666629"
                        y3="1.36898"
                        yFract="0.12499973"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a2"
                        x3="5.8081"
                        xFract="0.49999974"
                        y3="1.36898"
                        yFract="0.12499973"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a3"
                        x3="9.68017"
                        xFract="0.83333319"
                        y3="1.36898"
                        yFract="0.12499973"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a4"
                        x3="1.93603"
                        xFract="0.16666629"
                        y3="4.10695"
                        yFract="0.37500009"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a5"
                        x3="5.8081"
                        xFract="0.49999974"
                        y3="4.10695"
                        yFract="0.37500009"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a6"
                        x3="9.68017"
                        xFract="0.83333319"
                        y3="4.10695"
                        yFract="0.37500009"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a7"
                        x3="1.93603"
                        xFract="0.16666629"
                        y3="6.84492"
                        yFract="0.62500046"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a8"
                        x3="5.8081"
                        xFract="0.49999974"
                        y3="6.84492"
                        yFract="0.62500046"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a9"
                        x3="9.68017"
                        xFract="0.83333319"
                        y3="6.84492"
                        yFract="0.62500046"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a10"
                        x3="1.93603"
                        xFract="0.16666629"
                        y3="9.58288"
                        yFract="0.87499991"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a11"
                        x3="5.8081"
                        xFract="0.49999974"
                        y3="9.58288"
                        yFract="0.87499991"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a12"
                        x3="9.68017"
                        xFract="0.83333319"
                        y3="9.58288"
                        yFract="0.87499991"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Ir"
                        id="a13"
                        x3="0.0000"
                        xFract="0.0000"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a14"
                        x3="3.87207"
                        xFract="0.33333345"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a15"
                        x3="7.74414"
                        xFract="0.6666669"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a16"
                        x3="0.0000"
                        xFract="0.0000"
                        y3="2.73797"
                        yFract="0.25000037"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a17"
                        x3="3.87207"
                        xFract="0.33333345"
                        y3="2.73797"
                        yFract="0.25000037"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a18"
                        x3="7.74414"
                        xFract="0.6666669"
                        y3="2.73797"
                        yFract="0.25000037"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a19"
                        x3="0.0000"
                        xFract="0.0000"
                        y3="5.47593"
                        yFract="0.49999982"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a20"
                        x3="3.87207"
                        xFract="0.33333345"
                        y3="5.47593"
                        yFract="0.49999982"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a21"
                        x3="7.74414"
                        xFract="0.6666669"
                        y3="5.47593"
                        yFract="0.49999982"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a22"
                        x3="0.0000"
                        xFract="0.0000"
                        y3="8.2139"
                        yFract="0.75000018"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a23"
                        x3="3.87207"
                        xFract="0.33333345"
                        y3="8.2139"
                        yFract="0.75000018"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a24"
                        x3="7.74414"
                        xFract="0.6666669"
                        y3="8.2139"
                        yFract="0.75000018"
                        z3="1.36898"
                        zFract="0.068449"/>
                  <atom elementType="Ir"
                        id="a25"
                        x3="1.93603"
                        xFract="0.16666629"
                        y3="1.36898"
                        yFract="0.12499973"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a26"
                        x3="5.8081"
                        xFract="0.49999974"
                        y3="1.36898"
                        yFract="0.12499973"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a27"
                        x3="9.68017"
                        xFract="0.83333319"
                        y3="1.36898"
                        yFract="0.12499973"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a28"
                        x3="1.93603"
                        xFract="0.16666629"
                        y3="4.10695"
                        yFract="0.37500009"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a29"
                        x3="5.8081"
                        xFract="0.49999974"
                        y3="4.10695"
                        yFract="0.37500009"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a30"
                        x3="9.68017"
                        xFract="0.83333319"
                        y3="4.10695"
                        yFract="0.37500009"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a31"
                        x3="1.93603"
                        xFract="0.16666629"
                        y3="6.84492"
                        yFract="0.62500046"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a32"
                        x3="5.8081"
                        xFract="0.49999974"
                        y3="6.84492"
                        yFract="0.62500046"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a33"
                        x3="9.68017"
                        xFract="0.83333319"
                        y3="6.84492"
                        yFract="0.62500046"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a34"
                        x3="1.93603"
                        xFract="0.16666629"
                        y3="9.58288"
                        yFract="0.87499991"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a35"
                        x3="5.8081"
                        xFract="0.49999974"
                        y3="9.58288"
                        yFract="0.87499991"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a36"
                        x3="9.68017"
                        xFract="0.83333319"
                        y3="9.58288"
                        yFract="0.87499991"
                        z3="2.73797"
                        zFract="0.1368985"/>
                  <atom elementType="Ir"
                        id="a37"
                        x3="0.00011"
                        xFract="0.00000947"
                        y3="0.00041"
                        yFract="0.00003744"
                        z3="4.06956"
                        zFract="0.203478"/>
                  <atom elementType="Ir"
                        id="a38"
                        x3="3.87278"
                        xFract="0.33339457"
                        y3="0.00143"
                        yFract="0.00013057"
                        z3="4.07132"
                        zFract="0.203566"/>
                  <atom elementType="Ir"
                        id="a39"
                        x3="7.74535"
                        xFract="0.66677106"
                        y3="0.00014"
                        yFract="0.00001278"
                        z3="4.07054"
                        zFract="0.203527"/>
                  <atom elementType="Ir"
                        id="a40"
                        x3="-0.0000"
                        xFract="0.0000"
                        y3="2.73771"
                        yFract="0.24997662"
                        z3="4.07003"
                        zFract="0.2035015"/>
                  <atom elementType="Ir"
                        id="a41"
                        x3="3.87237"
                        xFract="0.33335928"
                        y3="2.7398"
                        yFract="0.25016746"
                        z3="4.08532"
                        zFract="0.204266"/>
                  <atom elementType="Ir"
                        id="a42"
                        x3="7.74479"
                        xFract="0.66672286"
                        y3="2.7379"
                        yFract="0.24999397"
                        z3="4.06908"
                        zFract="0.203454"/>
                  <atom elementType="Ir"
                        id="a43"
                        x3="-0.00025"
                        xFract="-0.00002152"
                        y3="5.47604"
                        yFract="0.50000986"
                        z3="4.06956"
                        zFract="0.203478"/>
                  <atom elementType="Ir"
                        id="a44"
                        x3="3.87275"
                        xFract="0.33339199"
                        y3="5.47534"
                        yFract="0.49994595"
                        z3="4.09451"
                        zFract="0.2047255"/>
                  <atom elementType="Ir"
                        id="a45"
                        x3="7.74496"
                        xFract="0.66673749"
                        y3="5.47667"
                        yFract="0.50006739"
                        z3="4.07268"
                        zFract="0.203634"/>
                  <atom elementType="Ir"
                        id="a46"
                        x3="11.61535"
                        xFract="0.99992631"
                        y3="8.21512"
                        yFract="0.75011158"
                        z3="4.06976"
                        zFract="0.203488"/>
                  <atom elementType="Ir"
                        id="a47"
                        x3="3.87217"
                        xFract="0.33334206"
                        y3="8.21257"
                        yFract="0.74987874"
                        z3="4.07003"
                        zFract="0.2035015"/>
                  <atom elementType="Ir"
                        id="a48"
                        x3="7.74519"
                        xFract="0.66675729"
                        y3="8.21484"
                        yFract="0.75008601"
                        z3="4.07057"
                        zFract="0.2035285"/>
                  <atom elementType="Ir"
                        id="a49"
                        x3="1.93322"
                        xFract="0.16642439"
                        y3="1.36825"
                        yFract="0.12493307"
                        z3="5.48415"
                        zFract="0.2742075"/>
                  <atom elementType="Ir"
                        id="a50"
                        x3="5.81159"
                        xFract="0.50030019"
                        y3="1.36739"
                        yFract="0.12485455"
                        z3="5.48399"
                        zFract="0.2741995"/>
                  <atom elementType="Ir"
                        id="a51"
                        x3="9.68198"
                        xFract="0.83348901"
                        y3="1.36818"
                        yFract="0.12492668"
                        z3="5.48309"
                        zFract="0.2741545"/>
                  <atom elementType="Ir"
                        id="a52"
                        x3="1.93261"
                        xFract="0.16637188"
                        y3="4.10658"
                        yFract="0.37496631"
                        z3="5.48243"
                        zFract="0.2741215"/>
                  <atom elementType="Ir"
                        id="a53"
                        x3="5.81074"
                        xFract="0.50022701"
                        y3="4.1070"
                        yFract="0.37500466"
                        z3="5.48754"
                        zFract="0.274377"/>
                  <atom elementType="Ir"
                        id="a54"
                        x3="9.68175"
                        xFract="0.83346921"
                        y3="4.10638"
                        yFract="0.37494805"
                        z3="5.48308"
                        zFract="0.274154"/>
                  <atom elementType="Ir"
                        id="a55"
                        x3="1.93247"
                        xFract="0.16635983"
                        y3="6.84866"
                        yFract="0.62534195"
                        z3="5.48226"
                        zFract="0.274113"/>
                  <atom elementType="Ir"
                        id="a56"
                        x3="5.81124"
                        xFract="0.50027006"
                        y3="6.8486"
                        yFract="0.62533647"
                        z3="5.48516"
                        zFract="0.274258"/>
                  <atom elementType="Ir"
                        id="a57"
                        x3="9.68148"
                        xFract="0.83344597"
                        y3="6.8451"
                        yFract="0.62501689"
                        z3="5.48329"
                        zFract="0.2741645"/>
                  <atom elementType="Ir"
                        id="a58"
                        x3="1.93292"
                        xFract="0.16639856"
                        y3="9.58506"
                        yFract="0.87519896"
                        z3="5.48227"
                        zFract="0.2741135"/>
                  <atom elementType="Ir"
                        id="a59"
                        x3="5.81212"
                        xFract="0.50034581"
                        y3="9.58436"
                        yFract="0.87513505"
                        z3="5.48289"
                        zFract="0.2741445"/>
                  <atom elementType="Ir"
                        id="a60"
                        x3="9.68156"
                        xFract="0.83345285"
                        y3="9.58248"
                        yFract="0.87496339"
                        z3="5.48296"
                        zFract="0.274148"/>
                  <atom elementType="Ir"
                        id="a61"
                        x3="-0.00001"
                        xFract="-0.00000086"
                        y3="0.00066"
                        yFract="0.00006026"
                        z3="6.68201"
                        zFract="0.3341005"/>
                  <atom elementType="Ir"
                        id="a62"
                        x3="3.87211"
                        xFract="0.33333689"
                        y3="-0.00264"
                        yFract="-0.00024105"
                        z3="6.67815"
                        zFract="0.3339075"/>
                  <atom elementType="Ir"
                        id="a63"
                        x3="7.74704"
                        xFract="0.66691655"
                        y3="0.00027"
                        yFract="0.00002465"
                        z3="6.68274"
                        zFract="0.334137"/>
                  <atom elementType="Ir"
                        id="a64"
                        x3="0.00042"
                        xFract="0.00003616"
                        y3="2.73853"
                        yFract="0.2500515"
                        z3="6.68189"
                        zFract="0.3340945"/>
                  <atom elementType="Ir"
                        id="a65"
                        x3="3.87537"
                        xFract="0.33361754"
                        y3="2.73231"
                        yFract="0.24948356"
                        z3="6.69094"
                        zFract="0.334547"/>
                  <atom elementType="Ir"
                        id="a66"
                        x3="7.74681"
                        xFract="0.66689675"
                        y3="2.73685"
                        yFract="0.2498981"
                        z3="6.68009"
                        zFract="0.3340045"/>
                  <atom elementType="Ir"
                        id="a67"
                        x3="-0.00118"
                        xFract="-0.00010158"
                        y3="5.47548"
                        yFract="0.49995873"
                        z3="6.67994"
                        zFract="0.333997"/>
                  <atom elementType="Ir"
                        id="a68"
                        x3="3.86835"
                        xFract="0.33301321"
                        y3="5.48862"
                        yFract="0.50115852"
                        z3="6.69747"
                        zFract="0.3348735"/>
                  <atom elementType="Ir"
                        id="a69"
                        x3="7.74578"
                        xFract="0.66680808"
                        y3="5.47484"
                        yFract="0.49990029"
                        z3="6.68301"
                        zFract="0.3341505"/>
                  <atom elementType="Ir"
                        id="a70"
                        x3="0.0006"
                        xFract="0.00005165"
                        y3="8.21309"
                        yFract="0.74992622"
                        z3="6.68176"
                        zFract="0.334088"/>
                  <atom elementType="Ir"
                        id="a71"
                        x3="3.87225"
                        xFract="0.33334895"
                        y3="8.23155"
                        yFract="0.75161178"
                        z3="6.67589"
                        zFract="0.3337945"/>
                  <atom elementType="Ir"
                        id="a72"
                        x3="7.74561"
                        xFract="0.66679345"
                        y3="8.21338"
                        yFract="0.7499527"
                        z3="6.68214"
                        zFract="0.334107"/>
                  <atom elementType="H"
                        id="a73"
                        x3="2.62438"
                        xFract="0.22592402"
                        y3="5.25983"
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         </module>
      </module>
   </module>
</module>
