<?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">
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               </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"
                        y3="6.844915"
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                        z3="0.0000"
                        zFract="0.0000"/>
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                        xFract="0.83333333"
                        y3="6.844915"
                        yFract="0.6250"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        yFract="0.0000"
                        z3="1.368983"
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                        z3="1.368983"
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                        z3="1.368983"
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                        xFract="0.0000"
                        y3="5.475932"
                        yFract="0.5000"
                        z3="1.368983"
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                        xFract="0.33333333"
                        y3="5.475932"
                        yFract="0.5000"
                        z3="1.368983"
                        zFract="0.06844915"/>
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                        xFract="0.66666667"
                        y3="5.475932"
                        yFract="0.5000"
                        z3="1.368983"
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                        xFract="0.0000"
                        y3="8.213898"
                        yFract="0.7500"
                        z3="1.368983"
                        zFract="0.06844915"/>
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                        y3="8.213898"
                        yFract="0.7500"
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                        zFract="0.06844915"/>
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                        y3="8.213898"
                        yFract="0.7500"
                        z3="1.368983"
                        zFract="0.06844915"/>
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                        id="a25"
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                        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"/>
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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"
                        y3="4.106949"
                        yFract="0.3750"
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                        zFract="0.1368983"/>
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                        zFract="0.1368983"/>
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                        y3="6.844915"
                        yFract="0.6250"
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                        y3="0.0059001"
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                  <bond atomRefs2="a55 a70" order="S"/>
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                  <bond atomRefs2="a56 a71" order="S"/>
                  <bond atomRefs2="a57 a72" order="S"/>
                  <bond atomRefs2="a57 a69" order="S"/>
                  <bond atomRefs2="a57 a60" order="S"/>
                  <bond atomRefs2="a58 a70" order="S"/>
                  <bond atomRefs2="a58 a71" order="S"/>
                  <bond atomRefs2="a59 a72" order="S"/>
                  <bond atomRefs2="a59 a71" order="S"/>
                  <bond atomRefs2="a60 a72" order="S"/>
                  <bond atomRefs2="a61 a64" order="S"/>
                  <bond atomRefs2="a62 a65" order="S"/>
                  <bond atomRefs2="a63 a66" order="S"/>
                  <bond atomRefs2="a64 a67" order="S"/>
                  <bond atomRefs2="a65 a68" order="S"/>
                  <bond atomRefs2="a66 a69" order="S"/>
                  <bond atomRefs2="a67 a70" order="S"/>
                  <bond atomRefs2="a68 a71" order="S"/>
                  <bond atomRefs2="a68 a79" order="S"/>
                  <bond atomRefs2="a69 a72" order="S"/>
                  <bond atomRefs2="a73 a78" order="S"/>
                  <bond atomRefs2="a74 a78" order="S"/>
                  <bond atomRefs2="a75 a78" order="S"/>
                  <bond atomRefs2="a76 a80" order="S"/>
                  <bond atomRefs2="a77 a79" order="S"/>
                  <bond atomRefs2="a77 a80" order="S"/>
                  <bond atomRefs2="a77 a78" order="S"/>
               </bondArray>
               <formula concise="C2H4Ir72O2">
                  <atomArray count="2 4 72 2" elementType="C H Ir O"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">13895.644200000013</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">672.0000</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 Ir 06Sep2000|PAW_PBE H 15Jun2001|PAW_PBE C 08Apr2002|PAW_PBE O 08Apr2002</array>
                  <array dictRef="cc:atomType" size="4">Ir H C O</array>
                  <array dataType="xsd:double" dictRef="cc:mass" size="4">192.220 1.000 12.011 16.000</array>
                  <array dataType="xsd:double" dictRef="cc:valence" size="4">9.000 1.000 4.000 6.000</array>
                  <array dataType="xsd:integer" dictRef="cc:atomcount" size="4">72 4 2 2</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>
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-0.000253 0.002142 0.000957 -0.008109 0.003508 -0.001353 -0.006341 0.003110 -0.003243 0.004918 -0.003906 -0.002740 0.001601 -0.008286 0.000687 0.005531 0.003172 -0.001022 0.001835 0.010510 -0.001958 0.014696 0.005671 0.000892 -0.007039 -0.001708 -0.002215 -0.005652 -0.002895 -0.000179 -0.001754 -0.001361 -0.002598 -0.005929 -0.008412 0.002968 -0.003009 0.006103 0.000393 0.002643 0.002497 0.001134 -0.000842 -0.003537 0.001505 0.006257 -0.000075 0.001474 0.006763 -0.004787 -0.004728 -0.003747 0.001312 -0.001304 0.000222 0.000205 0.006873 0.001876 -0.004265 0.011222 0.001272 -0.004597 0.002614 -0.005306 0.005166 0.000462 -0.001112 0.000646 0.009156 0.000810 -0.003023 -0.006561 0.001229 -0.004899 0.002687 -0.013482 -0.011770 -0.006122 0.009637 0.004639 -0.009254 0.002503 0.003321 0.000608 -0.015474 0.002623 0.001480 -0.014299 -0.002553 -0.012469 -0.002409 -0.002647 0.011740 -0.005958 -0.002805 0.003371 -0.000610 0.009184 -0.002654</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">-645.28203298</array>
                     <array dataType="xsd:double"
                            dictRef="v:noEntropyEnergy"
                            size="1"
                            units="nonsi:electronvolt">-645.21814719</array>
                     <array dataType="xsd:double"
                            dictRef="cc:e0"
                            size="1"
                            units="nonsi:electronvolt">-645.25009008</array>
                     <array dataType="xsd:double"
                            dictRef="v:efermi"
                            size="1"
                            units="nonsi:electronvolt">1.4739</array>
                     <array dataType="xsd:double"
                            dictRef="cc:deltaEnergy"
                            size="1"
                            units="nonsi:electronvolt">0.9980470E-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="-0.00211"
                        xFract="-0.00018164"
                        y3="0.00005"
                        yFract="0.00000457"
                        z3="4.07072"
                        zFract="0.203536"/>
                  <atom elementType="Ir"
                        id="a38"
                        x3="3.87242"
                        xFract="0.33336358"
                        y3="-0.00041"
                        yFract="-0.00003744"
                        z3="4.06824"
                        zFract="0.203412"/>
                  <atom elementType="Ir"
                        id="a39"
                        x3="7.74493"
                        xFract="0.66673491"
                        y3="-0.00079"
                        yFract="-0.00007213"
                        z3="4.07043"
                        zFract="0.2035215"/>
                  <atom elementType="Ir"
                        id="a40"
                        x3="0.00466"
                        xFract="0.00040116"
                        y3="2.74043"
                        yFract="0.25022498"
                        z3="4.07113"
                        zFract="0.2035565"/>
                  <atom elementType="Ir"
                        id="a41"
                        x3="3.87108"
                        xFract="0.33324822"
                        y3="2.74276"
                        yFract="0.25043773"
                        z3="4.06876"
                        zFract="0.203438"/>
                  <atom elementType="Ir"
                        id="a42"
                        x3="7.7425"
                        xFract="0.66652572"
                        y3="2.73851"
                        yFract="0.25004967"
                        z3="4.07324"
                        zFract="0.203662"/>
                  <atom elementType="Ir"
                        id="a43"
                        x3="-0.00005"
                        xFract="-0.0000043"
                        y3="5.47561"
                        yFract="0.4999706"
                        z3="4.06835"
                        zFract="0.2034175"/>
                  <atom elementType="Ir"
                        id="a44"
                        x3="3.87144"
                        xFract="0.33327921"
                        y3="5.47589"
                        yFract="0.49999616"
                        z3="4.13353"
                        zFract="0.2066765"/>
                  <atom elementType="Ir"
                        id="a45"
                        x3="7.74577"
                        xFract="0.66680722"
                        y3="5.47683"
                        yFract="0.500082"
                        z3="4.06896"
                        zFract="0.203448"/>
                  <atom elementType="Ir"
                        id="a46"
                        x3="0.00317"
                        xFract="0.00027289"
                        y3="8.21306"
                        yFract="0.74992348"
                        z3="4.07371"
                        zFract="0.2036855"/>
                  <atom elementType="Ir"
                        id="a47"
                        x3="3.87256"
                        xFract="0.33337563"
                        y3="8.20889"
                        yFract="0.74954273"
                        z3="4.07431"
                        zFract="0.2037155"/>
                  <atom elementType="Ir"
                        id="a48"
                        x3="7.74161"
                        xFract="0.6664491"
                        y3="8.21228"
                        yFract="0.74985226"
                        z3="4.07382"
                        zFract="0.203691"/>
                  <atom elementType="Ir"
                        id="a49"
                        x3="1.92906"
                        xFract="0.16606627"
                        y3="1.36639"
                        yFract="0.12476324"
                        z3="5.48336"
                        zFract="0.274168"/>
                  <atom elementType="Ir"
                        id="a50"
                        x3="5.81619"
                        xFract="0.50069618"
                        y3="1.36559"
                        yFract="0.12469019"
                        z3="5.4811"
                        zFract="0.274055"/>
                  <atom elementType="Ir"
                        id="a51"
                        x3="9.6786"
                        xFract="0.83319804"
                        y3="1.37132"
                        yFract="0.12521339"
                        z3="5.4820"
                        zFract="0.2741"/>
                  <atom elementType="Ir"
                        id="a52"
                        x3="1.94175"
                        xFract="0.16715871"
                        y3="4.10498"
                        yFract="0.37482021"
                        z3="5.48841"
                        zFract="0.2744205"/>
                  <atom elementType="Ir"
                        id="a53"
                        x3="5.80495"
                        xFract="0.49972857"
                        y3="4.1055"
                        yFract="0.37486769"
                        z3="5.48273"
                        zFract="0.2741365"/>
                  <atom elementType="Ir"
                        id="a54"
                        x3="9.6803"
                        xFract="0.83334438"
                        y3="4.10667"
                        yFract="0.37497452"
                        z3="5.48047"
                        zFract="0.2740235"/>
                  <atom elementType="Ir"
                        id="a55"
                        x3="1.93863"
                        xFract="0.16689012"
                        y3="6.84697"
                        yFract="0.62518764"
                        z3="5.48329"
                        zFract="0.2741645"/>
                  <atom elementType="Ir"
                        id="a56"
                        x3="5.80535"
                        xFract="0.49976301"
                        y3="6.84699"
                        yFract="0.62518947"
                        z3="5.48311"
                        zFract="0.2741555"/>
                  <atom elementType="Ir"
                        id="a57"
                        x3="9.68184"
                        xFract="0.83347696"
                        y3="6.84556"
                        yFract="0.62505889"
                        z3="5.48061"
                        zFract="0.2740305"/>
                  <atom elementType="Ir"
                        id="a58"
                        x3="1.9297"
                        xFract="0.16612137"
                        y3="9.58701"
                        yFract="0.87537701"
                        z3="5.48387"
                        zFract="0.2741935"/>
                  <atom elementType="Ir"
                        id="a59"
                        x3="5.81419"
                        xFract="0.50052401"
                        y3="9.58581"
                        yFract="0.87526744"
                        z3="5.48257"
                        zFract="0.2741285"/>
                  <atom elementType="Ir"
                        id="a60"
                        x3="9.68134"
                        xFract="0.83343391"
                        y3="9.57944"
                        yFract="0.87468581"
                        z3="5.48396"
                        zFract="0.274198"/>
                  <atom elementType="Ir"
                        id="a61"
                        x3="-0.00544"
                        xFract="-0.00046831"
                        y3="0.00222"
                        yFract="0.00020271"
                        z3="6.68302"
                        zFract="0.334151"/>
                  <atom elementType="Ir"
                        id="a62"
                        x3="3.87322"
                        xFract="0.33343245"
                        y3="0.00399"
                        yFract="0.00036432"
                        z3="6.67781"
                        zFract="0.3338905"/>
                  <atom elementType="Ir"
                        id="a63"
                        x3="7.74878"
                        xFract="0.66706634"
                        y3="-0.00165"
                        yFract="-0.00015066"
                        z3="6.68183"
                        zFract="0.3340915"/>
                  <atom elementType="Ir"
                        id="a64"
                        x3="-0.00457"
                        xFract="-0.00039342"
                        y3="2.74381"
                        yFract="0.25053361"
                        z3="6.68385"
                        zFract="0.3341925"/>
                  <atom elementType="Ir"
                        id="a65"
                        x3="3.8756"
                        xFract="0.33363734"
                        y3="2.69503"
                        yFract="0.24607957"
                        z3="6.67461"
                        zFract="0.3337305"/>
                  <atom elementType="Ir"
                        id="a66"
                        x3="7.74374"
                        xFract="0.66663246"
                        y3="2.74297"
                        yFract="0.25045691"
                        z3="6.68514"
                        zFract="0.334257"/>
                  <atom elementType="Ir"
                        id="a67"
                        x3="-0.00161"
                        xFract="-0.0001386"
                        y3="5.47446"
                        yFract="0.49986559"
                        z3="6.68184"
                        zFract="0.334092"/>
                  <atom elementType="Ir"
                        id="a68"
                        x3="3.87015"
                        xFract="0.33316816"
                        y3="5.47049"
                        yFract="0.4995031"
                        z3="6.75198"
                        zFract="0.337599"/>
                  <atom elementType="Ir"
                        id="a69"
                        x3="7.74836"
                        xFract="0.66703018"
                        y3="5.47507"
                        yFract="0.49992129"
                        z3="6.67696"
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         </module>
      </module>
   </module>
</module>
