<?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">2022-09-20T04:38:50.000</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>
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                        xFract="0.5000"
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                        y3="6.844915"
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                        y3="5.475932"
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                        z3="1.368983"
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                        id="a21"
                        x3="7.74413734"
                        xFract="0.66666667"
                        y3="5.475932"
                        yFract="0.5000"
                        z3="1.368983"
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                        id="a25"
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                        y3="1.368983"
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                        id="a26"
                        x3="5.80810298"
                        xFract="0.5000"
                        y3="1.368983"
                        yFract="0.1250"
                        z3="2.737966"
                        zFract="0.1368983"/>
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                        id="a27"
                        x3="9.68017159"
                        xFract="0.83333333"
                        y3="1.368983"
                        yFract="0.1250"
                        z3="2.737966"
                        zFract="0.1368983"/>
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                        xFract="0.16666667"
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                        id="a29"
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                  <bond atomRefs2="a61 a64" order="S"/>
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                  <bond atomRefs2="a66 a69" order="S"/>
                  <bond atomRefs2="a67 a70" order="S"/>
                  <bond atomRefs2="a68 a82" order="S"/>
                  <bond atomRefs2="a68 a71" order="S"/>
                  <bond atomRefs2="a68 a81" order="S"/>
                  <bond atomRefs2="a69 a72" order="S"/>
                  <bond atomRefs2="a73 a83" order="S"/>
                  <bond atomRefs2="a74 a83" order="S"/>
                  <bond atomRefs2="a75 a84" order="S"/>
                  <bond atomRefs2="a76 a84" order="S"/>
                  <bond atomRefs2="a77 a84" order="S"/>
                  <bond atomRefs2="a78 a81" order="S"/>
                  <bond atomRefs2="a79 a81" order="S"/>
                  <bond atomRefs2="a80 a82" order="S"/>
                  <bond atomRefs2="a81 a82" order="S"/>
                  <bond atomRefs2="a82 a83" order="S"/>
                  <bond atomRefs2="a83 a84" order="S"/>
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               <formula concise="C4H8Ir72">
                  <atomArray count="4 8 72" elementType="C H Ir"/>
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               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">13887.666800000014</scalar>
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            <parameterList>
               <parameter dictRef="v:nwrite">
                  <scalar dataType="xsd:integer">2</scalar>
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               <parameter dictRef="v:ispin">
                  <scalar dataType="xsd:integer">1</scalar>
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               <parameter dictRef="v:energyCutoff">
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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>
               </parameter>
               <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">672.0000</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>
               </parameter>
               <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>
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               <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>
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               <parameter dictRef="v:lhfcalc">
                  <scalar dataType="xsd:boolean">false</scalar>
               </parameter>
               <parameter dictRef="v:lhfone">
                  <scalar dataType="xsd:string">F</scalar>
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               <parameter dictRef="v:aexx">
                  <scalar dataType="xsd:double">0.0000</scalar>
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               <parameter dictRef="v:vdwversion">
                  <scalar dataType="xsd:integer">2</scalar>
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                         delimiter="|"
                         dictRef="v:pseudopotential"
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         </module>
         <module dictRef="cc:calculation" id="calculation">
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-0.003948 -0.003722 -0.000409 0.000455 -0.000985 0.000070 -0.003802 0.002625 -0.002259 -0.000528 0.002580 -0.000843 0.002366 -0.001996 0.002080 0.002509 -0.002235 0.003606 -0.005501 0.002115 -0.002358 -0.003816 0.001044 -0.002302 -0.000574 0.001995 0.002602 0.003596 -0.001305 -0.001295 0.001781 -0.004143 0.001867 -0.002009 0.002239 0.002608 -0.002221 -0.000082 -0.004074 0.000473 -0.001724 -0.000221 -0.001455 -0.001140 0.000429 0.004050 -0.003862 -0.003120 -0.005730 -0.003221 -0.002802 -0.004988 0.000587 0.001198 0.002473 -0.001834 -0.002616 -0.000725 0.000566 0.000416 0.000683 0.004779 -0.002630 -0.006114 -0.002257 -0.004509 -0.000087 -0.000265 0.006055 0.000634 -0.000198 -0.001745 0.001552 0.000445 0.002891 -0.003039 0.003966 0.001630 -0.004585 -0.000955 0.000688 0.002375 -0.002751 0.001833 -0.000299 0.005325 -0.003240 0.004758 0.006777 0.005379 0.006237 -0.005735 0.004124 -0.004104 -0.007326 -0.009216 0.005075 -0.008797 0.000556 -0.000916 0.013391 0.005981 -0.004301 0.001661 0.002866 0.004269 0.014420 0.005190 0.002716 -0.015512 0.006087 -0.002978</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">-665.03086861</array>
                     <array dataType="xsd:double"
                            dictRef="v:noEntropyEnergy"
                            size="1"
                            units="nonsi:electronvolt">-664.97054162</array>
                     <array dataType="xsd:double"
                            dictRef="cc:e0"
                            size="1"
                            units="nonsi:electronvolt">-665.00070511</array>
                     <array dataType="xsd:double"
                            dictRef="v:efermi"
                            size="1"
                            units="nonsi:electronvolt">1.3976</array>
                     <array dataType="xsd:double"
                            dictRef="cc:deltaEnergy"
                            size="1"
                            units="nonsi:electronvolt">0.7736795E-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="11.61372"
                        xFract="0.99978599"
                        y3="0.00163"
                        yFract="0.00014883"
                        z3="4.06957"
                        zFract="0.2034785"/>
                  <atom elementType="Ir"
                        id="a38"
                        x3="3.8726"
                        xFract="0.33337908"
                        y3="0.00236"
                        yFract="0.00021549"
                        z3="4.06822"
                        zFract="0.203411"/>
                  <atom elementType="Ir"
                        id="a39"
                        x3="7.74514"
                        xFract="0.66675299"
                        y3="-0.00266"
                        yFract="-0.00024288"
                        z3="4.07314"
                        zFract="0.203657"/>
                  <atom elementType="Ir"
                        id="a40"
                        x3="0.00099"
                        xFract="0.00008523"
                        y3="2.73858"
                        yFract="0.25005606"
                        z3="4.06937"
                        zFract="0.2034685"/>
                  <atom elementType="Ir"
                        id="a41"
                        x3="3.87613"
                        xFract="0.33368296"
                        y3="2.74507"
                        yFract="0.25064866"
                        z3="4.09531"
                        zFract="0.2047655"/>
                  <atom elementType="Ir"
                        id="a42"
                        x3="7.74963"
                        xFract="0.66713951"
                        y3="2.73095"
                        yFract="0.24935938"
                        z3="4.07149"
                        zFract="0.2035745"/>
                  <atom elementType="Ir"
                        id="a43"
                        x3="11.61565"
                        xFract="0.99995214"
                        y3="5.47677"
                        yFract="0.50007652"
                        z3="4.06621"
                        zFract="0.2033105"/>
                  <atom elementType="Ir"
                        id="a44"
                        x3="3.87269"
                        xFract="0.33338682"
                        y3="5.47587"
                        yFract="0.49999434"
                        z3="4.13339"
                        zFract="0.2066695"/>
                  <atom elementType="Ir"
                        id="a45"
                        x3="7.74427"
                        xFract="0.66667809"
                        y3="5.47527"
                        yFract="0.49993955"
                        z3="4.06721"
                        zFract="0.2033605"/>
                  <atom elementType="Ir"
                        id="a46"
                        x3="11.61259"
                        xFract="0.99968871"
                        y3="8.21874"
                        yFract="0.75044212"
                        z3="4.06964"
                        zFract="0.203482"/>
                  <atom elementType="Ir"
                        id="a47"
                        x3="3.87289"
                        xFract="0.33340404"
                        y3="8.20602"
                        yFract="0.74928067"
                        z3="4.07168"
                        zFract="0.203584"/>
                  <atom elementType="Ir"
                        id="a48"
                        x3="7.74301"
                        xFract="0.66656962"
                        y3="8.2147"
                        yFract="0.75007323"
                        z3="4.0712"
                        zFract="0.20356"/>
                  <atom elementType="Ir"
                        id="a49"
                        x3="1.93017"
                        xFract="0.16616183"
                        y3="1.36545"
                        yFract="0.12467741"
                        z3="5.48385"
                        zFract="0.2741925"/>
                  <atom elementType="Ir"
                        id="a50"
                        x3="5.81375"
                        xFract="0.50048613"
                        y3="1.36753"
                        yFract="0.12486733"
                        z3="5.4818"
                        zFract="0.27409"/>
                  <atom elementType="Ir"
                        id="a51"
                        x3="9.6828"
                        xFract="0.8335596"
                        y3="1.37051"
                        yFract="0.12513943"
                        z3="5.48344"
                        zFract="0.274172"/>
                  <atom elementType="Ir"
                        id="a52"
                        x3="1.93494"
                        xFract="0.16657246"
                        y3="4.11277"
                        yFract="0.37553151"
                        z3="5.48406"
                        zFract="0.274203"/>
                  <atom elementType="Ir"
                        id="a53"
                        x3="5.81153"
                        xFract="0.50029502"
                        y3="4.10734"
                        yFract="0.3750357"
                        z3="5.47976"
                        zFract="0.273988"/>
                  <atom elementType="Ir"
                        id="a54"
                        x3="9.67998"
                        xFract="0.83331684"
                        y3="4.10599"
                        yFract="0.37491243"
                        z3="5.47362"
                        zFract="0.273681"/>
                  <atom elementType="Ir"
                        id="a55"
                        x3="1.93579"
                        xFract="0.16664563"
                        y3="6.84505"
                        yFract="0.62501233"
                        z3="5.48217"
                        zFract="0.2741085"/>
                  <atom elementType="Ir"
                        id="a56"
                        x3="5.80207"
                        xFract="0.49948064"
                        y3="6.83959"
                        yFract="0.62451378"
                        z3="5.49845"
                        zFract="0.2749225"/>
                  <atom elementType="Ir"
                        id="a57"
                        x3="9.68145"
                        xFract="0.83344338"
                        y3="6.84857"
                        yFract="0.62533373"
                        z3="5.47322"
                        zFract="0.273661"/>
                  <atom elementType="Ir"
                        id="a58"
                        x3="1.92919"
                        xFract="0.16607746"
                        y3="9.58219"
                        yFract="0.87493691"
                        z3="5.4825"
                        zFract="0.274125"/>
                  <atom elementType="Ir"
                        id="a59"
                        x3="5.81392"
                        xFract="0.50050077"
                        y3="9.58264"
                        yFract="0.87497799"
                        z3="5.48253"
                        zFract="0.2741265"/>
                  <atom elementType="Ir"
                        id="a60"
                        x3="9.68035"
                        xFract="0.83334869"
                        y3="9.5811"
                        yFract="0.87483738"
                        z3="5.48734"
                        zFract="0.274367"/>
                  <atom elementType="Ir"
                        id="a61"
                        x3="0.00018"
                        xFract="0.0000155"
                        y3="0.00212"
                        yFract="0.00019357"
                        z3="6.68199"
                        zFract="0.3340995"/>
                  <atom elementType="Ir"
                        id="a62"
                        x3="3.86927"
                        xFract="0.33309241"
                        y3="-0.01406"
                        yFract="-0.0012838"
                        z3="6.67585"
                        zFract="0.3337925"/>
                  <atom elementType="Ir"
                        id="a63"
                        x3="7.74753"
                        xFract="0.66695873"
                        y3="-0.00109"
                        yFract="-0.00009953"
                        z3="6.68321"
                        zFract="0.3341605"/>
                  <atom elementType="Ir"
                        id="a64"
                        x3="0.00151"
                        xFract="0.00012999"
                        y3="2.74762"
                        yFract="0.25088149"
                        z3="6.68373"
                        zFract="0.3341865"/>
                  <atom elementType="Ir"
                        id="a65"
                        x3="3.86074"
                        xFract="0.33235809"
                        y3="2.70618"
                        yFract="0.24709766"
                        z3="6.69368"
                        zFract="0.334684"/>
                  <atom elementType="Ir"
                        id="a66"
                        x3="7.74768"
                        xFract="0.66697165"
                        y3="2.74187"
                        yFract="0.25035647"
                        z3="6.68132"
                        zFract="0.334066"/>
                  <atom elementType="Ir"
                        id="a67"
                        x3="11.60448"
                        xFract="0.99899055"
                        y3="5.47571"
                        yFract="0.49997973"
                        z3="6.67374"
                        zFract="0.333687"/>
                  <atom elementType="Ir"
                        id="a68"
                        x3="3.86462"
                        xFract="0.3326921"
                        y3="5.47384"
                        yFract="0.49980898"
                        z3="6.80677"
                        zFract="0.3403385"/>
                  <atom elementType="Ir"
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         </module>
      </module>
   </module>
</module>
