<?xml version="1.0" encoding="UTF-8"?>
<module xmlns="http://www.xml-cml.org/schema"
        xmlns:cc="http://www.xml-cml.org/dictionary/compchem/"
        xmlns:cml="http://www.xml-cml.org/schema"
        xmlns:cmlx="http://www.xml-cml.org/schema/cmlx"
        xmlns:convention="http://www.xml-cml.org/convention/"
        xmlns:nonsi="http://www.xml-cml.org/unit/nonSi/"
        xmlns:nonsi2="http://www.iochem-bd.org/unit/nonSi2/"
        xmlns:si="http://www.xml-cml.org/unit/si/"
        xmlns:v="http://www.iochem-bd.org/dictionary/vasp/"
        xmlns:xi="http://www.w3.org/2001/XInclude"
        xmlns:xsd="http://www.w3.org/2001/XMLSchema"
        convention="convention:compchem"
        id="vasp.outcar">
   <module dictRef="cc:jobList" id="jobList1">
      <module cmlx:templateRef="job" dictRef="cc:job" id="job">
         <module dictRef="cc:environment" id="environment">
            <parameterList>
               <parameter dictRef="cc:program">
                  <scalar dataType="xsd:string">vasp</scalar>
               </parameter>
               <parameter dictRef="cc:programVersion">
                  <scalar dataType="xsd:string">5.4.4</scalar>
               </parameter>
               <parameter dictRef="cc:subversion">
                  <scalar dataType="xsd:string">18Apr17-6-g9f103f2a35 (build May 11 2017 09:47:33) complex</scalar>
               </parameter>
               <parameter dictRef="v:platform">
                  <scalar dataType="xsd:string">tekla2IFC</scalar>
               </parameter>
               <parameter dictRef="cc:rundate">
                  <scalar dataType="xsd:date">2022-04-04T16:58:50.000</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <molecule id="initial">
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                  <scalar id="sc2" title="b" units="nonsi:angstrom">9.40530916445849</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">60.0</scalar>
               </crystal>
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                        y3="1.35753947"
                        yFract="0.16666667"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        id="a2"
                        x3="3.13510302"
                        xFract="0.33333333"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Zn"
                        id="a3"
                        x3="3.13510307"
                        xFract="0.16666667"
                        y3="2.71507886"
                        yFract="0.33333333"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        xFract="0.5000"
                        y3="1.35753947"
                        yFract="0.16666667"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        xFract="0.83333333"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        id="a6"
                        x3="7.83775765"
                        xFract="0.66666667"
                        y3="2.71507886"
                        yFract="0.33333333"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        id="a7"
                        x3="3.13510307"
                        xFract="0.0000"
                        y3="5.43015781"
                        yFract="0.66666667"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Zn"
                        id="a8"
                        x3="5.48643031"
                        xFract="0.33333333"
                        y3="4.07261833"
                        yFract="0.5000"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Zn"
                        id="a9"
                        x3="5.48643036"
                        xFract="0.16666667"
                        y3="6.7876972"
                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Zn"
                        id="a10"
                        x3="7.83775765"
                        xFract="0.5000"
                        y3="5.43015781"
                        yFract="0.66666667"
                        z3="0.0000"
                        zFract="0.0000"/>
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                        id="a11"
                        x3="10.1890849"
                        xFract="0.83333333"
                        y3="4.07261833"
                        yFract="0.5000"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Zn"
                        id="a12"
                        x3="10.18908494"
                        xFract="0.66666667"
                        y3="6.7876972"
                        yFract="0.83333333"
                        z3="0.0000"
                        zFract="0.0000"/>
                  <atom elementType="Zn"
                        id="a13"
                        x3="0.0000"
                        xFract="0.0000"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="2.3535068"
                        zFract="0.11767534"/>
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                        id="a14"
                        x3="2.35132734"
                        xFract="0.16666667"
                        y3="1.35753947"
                        yFract="0.16666667"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a15"
                        x3="4.70265454"
                        xFract="0.33333333"
                        y3="2.71507886"
                        yFract="0.33333333"
                        z3="2.3535068"
                        zFract="0.11767534"/>
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                        id="a16"
                        x3="4.70265458"
                        xFract="0.5000"
                        y3="0.0000"
                        yFract="0.0000"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a17"
                        x3="7.05398192"
                        xFract="0.66666667"
                        y3="1.35753947"
                        yFract="0.16666667"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a18"
                        x3="9.40530912"
                        xFract="0.83333333"
                        y3="2.71507886"
                        yFract="0.33333333"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a19"
                        x3="2.35132729"
                        xFract="0.0000"
                        y3="4.07261833"
                        yFract="0.5000"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a20"
                        x3="4.70265463"
                        xFract="0.16666667"
                        y3="5.43015781"
                        yFract="0.66666667"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a21"
                        x3="7.05398183"
                        xFract="0.33333333"
                        y3="6.7876972"
                        yFract="0.83333333"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a22"
                        x3="7.05398187"
                        xFract="0.5000"
                        y3="4.07261833"
                        yFract="0.5000"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a23"
                        x3="9.40530921"
                        xFract="0.66666667"
                        y3="5.43015781"
                        yFract="0.66666667"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a24"
                        x3="11.75663641"
                        xFract="0.83333333"
                        y3="6.7876972"
                        yFract="0.83333333"
                        z3="2.3535068"
                        zFract="0.11767534"/>
                  <atom elementType="Zn"
                        id="a25"
                        x3="10.19219265"
                        xFract="0.99989377"
                        y3="1.36465271"
                        yFract="0.16753997"
                        z3="4.7348624"
                        zFract="0.23674312"/>
                  <atom elementType="Zn"
                        id="a26"
                        x3="7.8401758"
                        xFract="0.33369693"
                        y3="8.14350189"
                        yFract="0.99978702"
                        z3="4.7349806"
                        zFract="0.23674903"/>
                  <atom elementType="Zn"
                        id="a27"
                        x3="3.12695158"
                        xFract="0.16567801"
                        y3="2.71706581"
                        yFract="0.33357727"
                        z3="4.735978"
                        zFract="0.2367989"/>
                  <atom elementType="Zn"
                        id="a28"
                        x3="5.4902065"
                        xFract="0.50100382"
                        y3="1.34772723"
                        yFract="0.16546201"
                        z3="4.7347032"
                        zFract="0.23673516"/>
                  <atom elementType="Zn"
                        id="a29"
                        x3="12.5365111"
                        xFract="0.83310229"
                        y3="8.14224354"
                        yFract="0.99963253"
                        z3="4.7406986"
                        zFract="0.23703493"/>
                  <atom elementType="Zn"
                        id="a30"
                        x3="7.84065416"
                        xFract="0.66683866"
                        y3="2.71729396"
                        yFract="0.33360528"
                        z3="4.72784"
                        zFract="0.236392"/>
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                        id="a31"
                        x3="3.135328"
                        xFract="0.00000606"
                        y3="5.43044867"
                        yFract="0.66670238"
                        z3="4.7273346"
                        zFract="0.23636673"/>
                  <atom elementType="Zn"
                        id="a32"
                        x3="5.49352892"
                        xFract="0.33361157"
                        y3="4.08038083"
                        yFract="0.50095301"
                        z3="4.7354128"
                        zFract="0.23677064"/>
                  <atom elementType="Zn"
                        id="a33"
                        x3="5.49597854"
                        xFract="0.16784602"
                        y3="6.78502295"
                        yFract="0.83300501"
                        z3="4.7342018"
                        zFract="0.23671009"/>
                  <atom elementType="Zn"
                        id="a34"
                        x3="7.8511067"
                        xFract="0.50129928"
                        y3="5.43211315"
                        yFract="0.66690673"
                        z3="4.7481462"
                        zFract="0.23740731"/>
                  <atom elementType="Zn"
                        id="a35"
                        x3="10.18377315"
                        xFract="0.83176166"
                        y3="4.08902137"
                        yFract="0.50201382"
                        z3="4.7643014"
                        zFract="0.23821507"/>
                  <atom elementType="Zn"
                        id="a36"
                        x3="10.17919493"
                        xFract="0.66617501"
                        y3="6.77857657"
                        yFract="0.83221358"
                        z3="4.76311"
                        zFract="0.2381555"/>
                  <atom elementType="Zn"
                        id="a37"
                        x3="4.7075611"
                        xFract="0.00064891"
                        y3="8.14316395"
                        yFract="0.99974553"
                        z3="7.132506"
                        zFract="0.3566253"/>
                  <atom elementType="Zn"
                        id="a38"
                        x3="2.35415547"
                        xFract="0.16695092"
                        y3="1.35780737"
                        yFract="0.16669956"
                        z3="7.1386506"
                        zFract="0.35693253"/>
                  <atom elementType="Zn"
                        id="a39"
                        x3="4.70720205"
                        xFract="0.33373879"
                        y3="2.71635025"
                        yFract="0.33348942"
                        z3="7.122703"
                        zFract="0.35613515"/>
                  <atom elementType="Zn"
                        id="a40"
                        x3="9.40367222"
                        xFract="0.49983063"
                        y3="8.14516051"
                        yFract="0.99999065"
                        z3="7.124757"
                        zFract="0.35623785"/>
                  <atom elementType="Zn"
                        id="a41"
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                        x3="2.3554851"
                        xFract="0.00021101"
                        y3="4.07638241"
                        yFract="0.50046212"
                        z3="7.111309"
                        zFract="0.35556545"/>
                  <atom elementType="Zn"
                        id="a44"
                        x3="4.70590252"
                        xFract="0.16684676"
                        y3="5.43284956"
                        yFract="0.66699714"
                        z3="7.129566"
                        zFract="0.3564783"/>
                  <atom elementType="Zn"
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                        id="a46"
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                        xFract="0.50084643"
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                        yFract="0.50050325"
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                  <bond atomRefs2="a4 a17" order="S"/>
                  <bond atomRefs2="a4 a8" order="S"/>
                  <bond atomRefs2="a4 a16" order="S"/>
                  <bond atomRefs2="a4 a15" order="S"/>
                  <bond atomRefs2="a4 a6" order="S"/>
                  <bond atomRefs2="a4 a5" order="S"/>
                  <bond atomRefs2="a5 a6" order="S"/>
                  <bond atomRefs2="a5 a17" order="S"/>
                  <bond atomRefs2="a6 a18" order="S"/>
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                  <bond atomRefs2="a6 a10" order="S"/>
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                  <bond atomRefs2="a6 a17" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a7 a9" order="S"/>
                  <bond atomRefs2="a7 a20" order="S"/>
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                  <bond atomRefs2="a8 a22" order="S"/>
                  <bond atomRefs2="a8 a9" order="S"/>
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                  <bond atomRefs2="a20 a21" order="S"/>
                  <bond atomRefs2="a21 a22" order="S"/>
                  <bond atomRefs2="a21 a33" order="S"/>
                  <bond atomRefs2="a21 a23" order="S"/>
                  <bond atomRefs2="a22 a32" order="S"/>
                  <bond atomRefs2="a22 a30" order="S"/>
                  <bond atomRefs2="a22 a23" order="S"/>
                  <bond atomRefs2="a23 a24" order="S"/>
                  <bond atomRefs2="a25 a42" order="S"/>
                  <bond atomRefs2="a25 a35" order="S"/>
                  <bond atomRefs2="a25 a30" order="S"/>
                  <bond atomRefs2="a26 a36" order="S"/>
                  <bond atomRefs2="a26 a34" order="S"/>
                  <bond atomRefs2="a26 a33" order="S"/>
                  <bond atomRefs2="a27 a28" order="S"/>
                  <bond atomRefs2="a27 a43" order="S"/>
                  <bond atomRefs2="a27 a31" order="S"/>
                  <bond atomRefs2="a27 a32" order="S"/>
                  <bond atomRefs2="a28 a32" order="S"/>
                  <bond atomRefs2="a28 a30" order="S"/>
                  <bond atomRefs2="a29 a36" order="S"/>
                  <bond atomRefs2="a29 a48" order="S"/>
                  <bond atomRefs2="a30 a35" order="S"/>
                  <bond atomRefs2="a30 a34" order="S"/>
                  <bond atomRefs2="a30 a32" order="S"/>
                  <bond atomRefs2="a31 a33" order="S"/>
                  <bond atomRefs2="a31 a32" order="S"/>
                  <bond atomRefs2="a32 a33" order="S"/>
                  <bond atomRefs2="a32 a46" order="S"/>
                  <bond atomRefs2="a32 a34" order="S"/>
                  <bond atomRefs2="a33 a34" order="S"/>
                  <bond atomRefs2="a34 a36" order="S"/>
                  <bond atomRefs2="a34 a35" order="S"/>
                  <bond atomRefs2="a34 a46" order="S"/>
                  <bond atomRefs2="a35 a42" order="S"/>
                  <bond atomRefs2="a35 a36" order="S"/>
                  <bond atomRefs2="a36 a48" order="S"/>
                  <bond atomRefs2="a36 a40" order="S"/>
                  <bond atomRefs2="a37 a44" order="S"/>
                  <bond atomRefs2="a37 a45" order="S"/>
                  <bond atomRefs2="a38 a39" order="S"/>
                  <bond atomRefs2="a38 a43" order="S"/>
                  <bond atomRefs2="a39 a41" order="S"/>
                  <bond atomRefs2="a39 a43" order="S"/>
                  <bond atomRefs2="a39 a44" order="S"/>
                  <bond atomRefs2="a39 a46" order="S"/>
                  <bond atomRefs2="a40 a47" order="S"/>
                  <bond atomRefs2="a40 a48" order="S"/>
                  <bond atomRefs2="a40 a45" order="S"/>
                  <bond atomRefs2="a41 a42" order="S"/>
                  <bond atomRefs2="a41 a46" order="S"/>
                  <bond atomRefs2="a42 a46" order="S"/>
                  <bond atomRefs2="a42 a47" order="S"/>
                  <bond atomRefs2="a43 a44" order="S"/>
                  <bond atomRefs2="a44 a45" order="S"/>
                  <bond atomRefs2="a44 a46" order="S"/>
                  <bond atomRefs2="a45 a47" order="S"/>
                  <bond atomRefs2="a45 a46" order="S"/>
                  <bond atomRefs2="a46 a47" order="S"/>
                  <bond atomRefs2="a47 a48" order="S"/>
                  <bond atomRefs2="a49 a64" order="S"/>
                  <bond atomRefs2="a50 a64" order="S"/>
                  <bond atomRefs2="a51 a59" order="S"/>
                  <bond atomRefs2="a52 a61" order="S"/>
                  <bond atomRefs2="a53 a61" order="S"/>
                  <bond atomRefs2="a54 a61" order="S"/>
                  <bond atomRefs2="a55 a60" order="S"/>
                  <bond atomRefs2="a56 a62" order="S"/>
                  <bond atomRefs2="a57 a62" order="S"/>
                  <bond atomRefs2="a58 a62" order="S"/>
                  <bond atomRefs2="a59 a64" order="S"/>
                  <bond atomRefs2="a59 a63" order="S"/>
                  <bond atomRefs2="a60 a62" order="S"/>
                  <bond atomRefs2="a60 a61" order="S"/>
                  <bond atomRefs2="a60 a63" order="S"/>
               </bondArray>
               <formula concise="C4H10N2Zn48">
                  <atomArray count="4 10 2 48" elementType="C H N Zn"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">3215.6882000000023</scalar>
               </property>
            </molecule>
            <parameterList>
               <parameter dictRef="v:nwrite">
                  <scalar dataType="xsd:integer">0</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">612.0000</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 Zn 06Sep2000|PAW_PBE H 15Jun2001|PAW_PBE C 08Apr2002|PAW_PBE N 08Apr2002</array>
                  <array dictRef="cc:atomType" size="4">Zn H C N</array>
                  <array dataType="xsd:double" dictRef="cc:mass" size="4">65.39 1.00 12.01 14.00</array>
                  <array dataType="xsd:double" dictRef="cc:valence" size="4">12.00 1.00 4.00 5.00</array>
                  <array dataType="xsd:integer" dictRef="cc:atomcount" size="4">48 10 4 2</array>
               </module>
               <module cmlx:templateRef="kpoints"
                       dictRef="cc:userDefinedModule"
                       id="vasp.kpoints">
                  <scalar dataType="xsd:string" dictRef="v:comment">K-POINTS</scalar>
                  <scalar dataType="xsd:integer" dictRef="v:kpointnum">0</scalar>
                  <scalar dataType="xsd:string" dictRef="v:meshScheme">Gamma</scalar>
                  <array dataType="xsd:integer" dictRef="v:subdivisionN" size="3">3 3 1</array>
                  <array dataType="xsd:double" dictRef="v:shiftS" size="3">0 0 0</array>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation">
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="eigenvalues">
                  <list id="spin">
                     <scalar dataType="xsd:integer" dictRef="cc:spin">1</scalar>
                     <array dataType="xsd:integer" dictRef="cc:serial" size="5">1 2 3 4 5</array>
                     <array dataType="xsd:double" dictRef="cc:eigen" size="1860">-20.5351 -18.5149 -15.6912 -13.4015 -12.2344 -10.5375 -10.1704 -10.1265 -9.2288 -8.9192 -8.5500 -8.5135 -8.4678 -8.4675 -8.4632 -8.4301 -8.4299 -8.4285 -8.3467 -8.3444 -8.3409 -8.3353 -8.3339 -8.3326 -8.3274 -8.3269 -8.3201 -8.1455 -8.1409 -8.1403 -8.1230 -8.1226 -8.1219 -8.1212 -8.1201 -8.1155 -8.1145 -8.1138 -8.1053 -8.1041 -8.1033 -8.0693 -8.0686 -8.0676 -8.0673 -8.0666 -8.0659 -8.0639 -8.0633 -8.0620 -8.0427 -8.0422 -8.0387 -8.0374 -8.0353 -8.0289 -8.0239 -8.0226 -8.0209 -8.0200 -7.9768 -7.9760 -7.9740 -7.9695 -7.9685 -7.9642 -7.9117 -7.9109 -7.8966 -7.8960 -7.8926 -7.8810 -7.8806 -7.8800 -7.8790 -7.8786 -7.8776 -7.8749 -7.8735 -7.8675 -7.8668 -7.8642 -7.8637 -7.8631 -7.8608 -7.8590 -7.8561 -7.8498 -7.8420 -7.8409 -7.7984 -7.7983 -7.7568 -7.7567 -7.7213 -7.7117 -7.7104 -7.7051 -7.7033 -7.7021 -7.7020 -7.7008 -7.7003 -7.6987 -7.6716 -7.6712 -7.6700 -7.6696 -7.6653 -7.6647 -7.6634 -7.6621 -7.6613 -7.6605 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                        y3="6.78769722"
                        yFract="0.83333333"
                        z3="2.35350684"
                        zFract="0.11767534"/>
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                        id="a25"
                        x3="10.1922776"
                        xFract="0.99992604"
                        y3="1.36427422"
                        yFract="0.1674935"
                        z3="4.73500573"
                        zFract="0.23675029"/>
                  <atom elementType="Zn"
                        id="a26"
                        x3="7.84029348"
                        xFract="0.33374073"
                        y3="8.1429922"
                        yFract="0.99972444"
                        z3="4.73445485"
                        zFract="0.23672274"/>
                  <atom elementType="Zn"
                        id="a27"
                        x3="3.12770957"
                        xFract="0.16577781"
                        y3="2.71675293"
                        yFract="0.33353886"
                        z3="4.73596166"
                        zFract="0.23679808"/>
                  <atom elementType="Zn"
                        id="a28"
                        x3="5.48992014"
                        xFract="0.50094422"
                        y3="1.34820218"
                        yFract="0.16552032"
                        z3="4.73483958"
                        zFract="0.23674198"/>
                  <atom elementType="Zn"
                        id="a29"
                        x3="12.53673561"
                        xFract="0.83310005"
                        y3="8.14266892"
                        yFract="0.99968476"
                        z3="4.73984388"
                        zFract="0.23699219"/>
                  <atom elementType="Zn"
                        id="a30"
                        x3="7.84003935"
                        xFract="0.66674094"
                        y3="2.71782094"
                        yFract="0.33366998"
                        z3="4.72925386"
                        zFract="0.23646269"/>
                  <atom elementType="Zn"
                        id="a31"
                        x3="3.13559734"
                        xFract="0.00001853"
                        y3="5.43071208"
                        yFract="0.66673472"
                        z3="4.72749959"
                        zFract="0.23637498"/>
                  <atom elementType="Zn"
                        id="a32"
                        x3="5.49351852"
                        xFract="0.33363385"
                        y3="4.07999985"
                        yFract="0.50090624"
                        z3="4.73547729"
                        zFract="0.23677386"/>
                  <atom elementType="Zn"
                        id="a33"
                        x3="5.49627172"
                        xFract="0.16789638"
                        y3="6.78471033"
                        yFract="0.83296663"
                        z3="4.73427875"
                        zFract="0.23671394"/>
                  <atom elementType="Zn"
                        id="a34"
                        x3="7.85064897"
                        xFract="0.50124111"
                        y3="5.43226792"
                        yFract="0.66692573"
                        z3="4.74829405"
                        zFract="0.2374147"/>
                  <atom elementType="Zn"
                        id="a35"
                        x3="10.18398689"
                        xFract="0.83178789"
                        y3="4.08896429"
                        yFract="0.50200681"
                        z3="4.76417277"
                        zFract="0.23820864"/>
                  <atom elementType="Zn"
                        id="a36"
                        x3="10.17935532"
                        xFract="0.66619979"
                        y3="6.77845068"
                        yFract="0.83219812"
                        z3="4.76258964"
                        zFract="0.23812948"/>
                  <atom elementType="Zn"
                        id="a37"
                        x3="4.70858648"
                        xFract="0.00075847"
                        y3="8.14315513"
                        yFract="0.99974445"
                        z3="7.13150359"
                        zFract="0.35657518"/>
                  <atom elementType="Zn"
                        id="a38"
                        x3="2.35459309"
                        xFract="0.16702808"
                        y3="1.35730843"
                        yFract="0.1666383"
                        z3="7.13787012"
                        zFract="0.35689351"/>
                  <atom elementType="Zn"
                        id="a39"
                        x3="4.70639408"
                        xFract="0.3336845"
                        y3="2.71583522"
                        yFract="0.33342619"
                        z3="7.12277404"
                        zFract="0.3561387"/>
                  <atom elementType="Zn"
                        id="a40"
                        x3="9.40375356"
                        xFract="0.49984514"
                        y3="8.14506501"
                        yFract="0.99997893"
                        z3="7.12513872"
                        zFract="0.35625694"/>
                  <atom elementType="Zn"
                        id="a41"
                        x3="7.05647092"
                        xFract="0.66678542"
                        y3="1.35991601"
                        yFract="0.16695844"
                        z3="7.13466932"
                        zFract="0.35673347"/>
                  <atom elementType="Zn"
                        id="a42"
                        x3="9.40843905"
                        xFract="0.83368077"
                        y3="2.71484008"
                        yFract="0.33330401"
                        z3="7.10939866"
                        zFract="0.35546993"/>
                  <atom elementType="Zn"
                        id="a43"
                        x3="2.3551722"
                        xFract="0.00018881"
                        y3="4.07620203"
                        yFract="0.50043997"
                        z3="7.11123479"
                        zFract="0.35556174"/>
                  <atom elementType="Zn"
                        id="a44"
                        x3="4.70630909"
                        xFract="0.16691395"
                        y3="5.43245913"
                        yFract="0.66694921"
                        z3="7.12933471"
                        zFract="0.35646674"/>
                  <atom elementType="Zn"
                        id="a45"
                        x3="7.05678405"
                        xFract="0.33369176"
                        y3="6.78671182"
                        yFract="0.83321235"
                        z3="7.14420479"
                        zFract="0.35721024"/>
                  <atom elementType="Zn"
                        id="a46"
                        x3="7.06392656"
                        xFract="0.50083643"
                        y3="4.07621726"
                        yFract="0.50044184"
                        z3="7.10814073"
                        zFract="0.35540704"/>
                  <atom elementType="Zn"
                        id="a47"
                        x3="9.39847237"
                        xFract="0.66562676"
                        y3="5.43525674"
                        yFract="0.66729267"
                        z3="7.39308982"
                        zFract="0.36965449"/>
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                        id="a48"
                        x3="11.75707746"
                        xFract="0.83337859"
                        y3="6.78772388"
                        yFract="0.83333661"
                        z3="7.11291667"
                        zFract="0.35564583"/>
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                        y3="4.30440803"
                        yFract="0.52845709"
                        z3="10.03112782"
                        zFract="0.50155639"/>
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                        id="a50"
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                        y3="5.64651025"
                        yFract="0.69322851"
                        z3="9.98387719"
                        zFract="0.49919386"/>
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                        id="a51"
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                        xFract="0.51112431"
                        y3="7.13038293"
                        yFract="0.87540525"
                        z3="10.75718177"
                        zFract="0.53785909"/>
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                        id="a52"
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                        xFract="0.70889867"
                        y3="3.45660483"
                        yFract="0.42437132"
                        z3="11.89334821"
                        zFract="0.59466741"/>
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                        id="a53"
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                        y3="2.40988584"
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                        z3="11.71354002"
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                        yFract="0.40568048"
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                        y3="4.99469488"
                        yFract="0.61320439"
                        z3="10.00163432"
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                        yFract="0.74783479"
                        z3="10.61126809"
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                        id="a60"
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                        z3="11.87269657"
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                        yFract="0.5308907"
                        z3="10.77762353"
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                        y3="5.7439596"
                        yFract="0.70519247"
                        z3="10.9940731"
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                        y3="5.3147727"
                        yFract="0.65250071"
                        z3="9.93298151"
                        zFract="0.49664908"/>
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               <bondArray>
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                  <bond atomRefs2="a1 a13" order="S"/>
                  <bond atomRefs2="a1 a2" order="S"/>
                  <bond atomRefs2="a2 a3" order="S"/>
                  <bond atomRefs2="a2 a4" order="S"/>
                  <bond atomRefs2="a2 a16" order="S"/>
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                  <bond atomRefs2="a3 a8" order="S"/>
                  <bond atomRefs2="a3 a15" order="S"/>
                  <bond atomRefs2="a3 a4" order="S"/>
                  <bond atomRefs2="a3 a14" order="S"/>
                  <bond atomRefs2="a3 a19" order="S"/>
                  <bond atomRefs2="a3 a7" order="S"/>
                  <bond atomRefs2="a4 a8" order="S"/>
                  <bond atomRefs2="a4 a15" order="S"/>
                  <bond atomRefs2="a4 a17" order="S"/>
                  <bond atomRefs2="a4 a16" order="S"/>
                  <bond atomRefs2="a4 a6" order="S"/>
                  <bond atomRefs2="a4 a5" order="S"/>
                  <bond atomRefs2="a5 a6" order="S"/>
                  <bond atomRefs2="a5 a17" order="S"/>
                  <bond atomRefs2="a6 a18" order="S"/>
                  <bond atomRefs2="a6 a11" order="S"/>
                  <bond atomRefs2="a6 a10" order="S"/>
                  <bond atomRefs2="a6 a8" order="S"/>
                  <bond atomRefs2="a6 a17" order="S"/>
                  <bond atomRefs2="a6 a22" order="S"/>
                  <bond atomRefs2="a7 a8" order="S"/>
                  <bond atomRefs2="a7 a9" order="S"/>
                  <bond atomRefs2="a7 a20" order="S"/>
                  <bond atomRefs2="a7 a19" order="S"/>
                  <bond atomRefs2="a8 a9" order="S"/>
                  <bond atomRefs2="a8 a22" order="S"/>
                  <bond atomRefs2="a8 a20" order="S"/>
                  <bond atomRefs2="a8 a15" order="S"/>
                  <bond atomRefs2="a8 a10" order="S"/>
                  <bond atomRefs2="a9 a21" order="S"/>
                  <bond atomRefs2="a9 a20" order="S"/>
                  <bond atomRefs2="a9 a10" order="S"/>
                  <bond atomRefs2="a10 a23" order="S"/>
                  <bond atomRefs2="a10 a12" order="S"/>
                  <bond atomRefs2="a10 a11" order="S"/>
                  <bond atomRefs2="a10 a22" order="S"/>
                  <bond atomRefs2="a10 a21" order="S"/>
                  <bond atomRefs2="a11 a18" order="S"/>
                  <bond atomRefs2="a11 a23" order="S"/>
                  <bond atomRefs2="a11 a12" order="S"/>
                  <bond atomRefs2="a12 a23" order="S"/>
                  <bond atomRefs2="a12 a24" order="S"/>
                  <bond atomRefs2="a13 a14" order="S"/>
                  <bond atomRefs2="a14 a15" order="S"/>
                  <bond atomRefs2="a14 a19" order="S"/>
                  <bond atomRefs2="a14 a16" order="S"/>
                  <bond atomRefs2="a15 a19" order="S"/>
                  <bond atomRefs2="a15 a17" order="S"/>
                  <bond atomRefs2="a15 a16" order="S"/>
                  <bond atomRefs2="a15 a20" order="S"/>
                  <bond atomRefs2="a15 a22" order="S"/>
                  <bond atomRefs2="a16 a28" order="S"/>
                  <bond atomRefs2="a16 a17" order="S"/>
                  <bond atomRefs2="a17 a28" order="S"/>
                  <bond atomRefs2="a17 a22" order="S"/>
                  <bond atomRefs2="a17 a18" order="S"/>
                  <bond atomRefs2="a17 a30" order="S"/>
                  <bond atomRefs2="a18 a25" order="S"/>
                  <bond atomRefs2="a18 a30" order="S"/>
                  <bond atomRefs2="a18 a23" order="S"/>
                  <bond atomRefs2="a18 a22" order="S"/>
                  <bond atomRefs2="a19 a20" order="S"/>
                  <bond atomRefs2="a19 a31" order="S"/>
                  <bond atomRefs2="a19 a27" order="S"/>
                  <bond atomRefs2="a20 a32" order="S"/>
                  <bond atomRefs2="a20 a31" order="S"/>
                  <bond atomRefs2="a20 a22" order="S"/>
                  <bond atomRefs2="a20 a21" order="S"/>
                  <bond atomRefs2="a21 a33" order="S"/>
                  <bond atomRefs2="a21 a22" order="S"/>
                  <bond atomRefs2="a21 a23" order="S"/>
                  <bond atomRefs2="a22 a32" order="S"/>
                  <bond atomRefs2="a22 a30" order="S"/>
                  <bond atomRefs2="a22 a23" order="S"/>
                  <bond atomRefs2="a23 a24" order="S"/>
                  <bond atomRefs2="a25 a35" order="S"/>
                  <bond atomRefs2="a25 a30" order="S"/>
                  <bond atomRefs2="a25 a42" order="S"/>
                  <bond atomRefs2="a26 a36" order="S"/>
                  <bond atomRefs2="a26 a34" order="S"/>
                  <bond atomRefs2="a26 a33" order="S"/>
                  <bond atomRefs2="a27 a28" order="S"/>
                  <bond atomRefs2="a27 a32" order="S"/>
                  <bond atomRefs2="a27 a43" order="S"/>
                  <bond atomRefs2="a27 a31" order="S"/>
                  <bond atomRefs2="a28 a32" order="S"/>
                  <bond atomRefs2="a28 a30" order="S"/>
                  <bond atomRefs2="a29 a36" order="S"/>
                  <bond atomRefs2="a29 a48" order="S"/>
                  <bond atomRefs2="a30 a46" order="S"/>
                  <bond atomRefs2="a30 a35" order="S"/>
                  <bond atomRefs2="a30 a34" order="S"/>
                  <bond atomRefs2="a30 a32" order="S"/>
                  <bond atomRefs2="a31 a32" order="S"/>
                  <bond atomRefs2="a31 a33" order="S"/>
                  <bond atomRefs2="a32 a33" order="S"/>
                  <bond atomRefs2="a32 a46" order="S"/>
                  <bond atomRefs2="a32 a34" order="S"/>
                  <bond atomRefs2="a33 a34" order="S"/>
                  <bond atomRefs2="a34 a36" order="S"/>
                  <bond atomRefs2="a34 a46" order="S"/>
                  <bond atomRefs2="a34 a35" order="S"/>
                  <bond atomRefs2="a35 a42" order="S"/>
                  <bond atomRefs2="a35 a36" order="S"/>
                  <bond atomRefs2="a36 a48" order="S"/>
                  <bond atomRefs2="a36 a40" order="S"/>
                  <bond atomRefs2="a37 a45" order="S"/>
                  <bond atomRefs2="a37 a44" order="S"/>
                  <bond atomRefs2="a38 a39" order="S"/>
                  <bond atomRefs2="a38 a43" order="S"/>
                  <bond atomRefs2="a39 a41" order="S"/>
                  <bond atomRefs2="a39 a44" order="S"/>
                  <bond atomRefs2="a39 a43" order="S"/>
                  <bond atomRefs2="a39 a46" order="S"/>
                  <bond atomRefs2="a40 a45" order="S"/>
                  <bond atomRefs2="a40 a47" order="S"/>
                  <bond atomRefs2="a40 a48" order="S"/>
                  <bond atomRefs2="a41 a46" order="S"/>
                  <bond atomRefs2="a41 a42" order="S"/>
                  <bond atomRefs2="a42 a46" order="S"/>
                  <bond atomRefs2="a42 a47" order="S"/>
                  <bond atomRefs2="a43 a44" order="S"/>
                  <bond atomRefs2="a44 a45" order="S"/>
                  <bond atomRefs2="a44 a46" order="S"/>
                  <bond atomRefs2="a45 a47" order="S"/>
                  <bond atomRefs2="a45 a46" order="S"/>
                  <bond atomRefs2="a46 a47" order="S"/>
                  <bond atomRefs2="a47 a48" order="S"/>
                  <bond atomRefs2="a49 a64" order="S"/>
                  <bond atomRefs2="a50 a64" order="S"/>
                  <bond atomRefs2="a51 a59" order="S"/>
                  <bond atomRefs2="a52 a61" order="S"/>
                  <bond atomRefs2="a53 a61" order="S"/>
                  <bond atomRefs2="a54 a61" order="S"/>
                  <bond atomRefs2="a55 a60" order="S"/>
                  <bond atomRefs2="a56 a62" order="S"/>
                  <bond atomRefs2="a57 a62" order="S"/>
                  <bond atomRefs2="a58 a62" order="S"/>
                  <bond atomRefs2="a59 a64" order="S"/>
                  <bond atomRefs2="a59 a63" order="S"/>
                  <bond atomRefs2="a60 a62" order="S"/>
                  <bond atomRefs2="a60 a61" order="S"/>
                  <bond atomRefs2="a60 a63" order="S"/>
               </bondArray>
               <formula concise="C4H10N2Zn48">
                  <atomArray count="4 10 2 48" elementType="C H N Zn"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">3215.6882000000023</scalar>
               </property>
            </molecule>
         </module>
      </module>
   </module>
</module>
