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<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:l="http://www.iochem-bd.org/dictionary/lammps/"
        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:xi="http://www.w3.org/2001/XInclude"
        xmlns:xsd="http://www.w3.org/2001/XMLSchema"
        convention="convention:compchem"
        id="lammps.log">
   <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" id="copy.0">LAMMPS</scalar>
               </parameter>
               <parameter dictRef="cc:programVersion">
                  <scalar dataType="xsd:string" id="copy.1">29 Sep 2021 - Update 3</scalar>
               </parameter>
            </parameterList>
         </module>
         <module dictRef="cc:initialization" id="initialization">
            <parameterList/>
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                        z3="7.47713"
                        zFract="0.17388674"/>
                  <atom elementType="O"
                        id="a265"
                        x3="6.21192"
                        xFract="0.26934895"
                        y3="5.07976"
                        yFract="0.4818042"
                        z3="11.8325"
                        zFract="0.27517442"/>
                  <atom elementType="O"
                        id="a266"
                        x3="6.14222"
                        xFract="0.09158687"
                        y3="8.7074"
                        yFract="0.82587798"
                        z3="10.9451"
                        zFract="0.25453721"/>
                  <atom elementType="O"
                        id="a267"
                        x3="12.7372"
                        xFract="0.68415677"
                        y3="7.63507"
                        yFract="0.72416981"
                        z3="3.42551"
                        zFract="0.07966302"/>
                  <atom elementType="O"
                        id="a268"
                        x3="6.4250"
                        xFract="0.09856764"
                        y3="9.04999"
                        yFract="0.8583719"
                        z3="14.2260"
                        zFract="0.33083721"/>
                  <atom elementType="O"
                        id="a269"
                        x3="6.58574"
                        xFract="0.30712519"
                        y3="4.93067"
                        yFract="0.46766334"
                        z3="3.68431"
                        zFract="0.08568163"/>
                  <atom elementType="O"
                        id="a270"
                        x3="14.4931"
                        xFract="0.69937882"
                        y3="10.3554"
                        yFract="0.9821872"
                        z3="28.8832"
                        zFract="0.67170233"/>
                  <atom elementType="O"
                        id="a271"
                        x3="8.81422"
                        xFract="0.32008524"
                        y3="8.51723"
                        yFract="0.80784077"
                        z3="30.7018"
                        zFract="0.71399535"/>
                  <atom elementType="O"
                        id="a272"
                        x3="9.26178"
                        xFract="0.60811326"
                        y3="3.21895"
                        yFract="0.30531042"
                        z3="28.7787"
                        zFract="0.66927209"/>
                  <atom elementType="O"
                        id="a273"
                        x3="3.74428"
                        xFract="0.17649965"
                        y3="2.76354"
                        yFract="0.26211577"
                        z3="24.7048"
                        zFract="0.57453023"/>
                  <atom elementType="O"
                        id="a274"
                        x3="9.38819"
                        xFract="0.76467886"
                        y3="0.136492"
                        yFract="0.01294597"
                        z3="25.5591"
                        zFract="0.59439767"/>
                  <atom elementType="O"
                        id="a275"
                        x3="9.46367"
                        xFract="0.75825611"
                        y3="0.40266"
                        yFract="0.03819143"
                        z3="22.4273"
                        zFract="0.52156512"/>
                  <atom elementType="O"
                        id="a276"
                        x3="11.7056"
                        xFract="0.87182391"
                        y3="1.89106"
                        yFract="0.17936293"
                        z3="20.2576"
                        zFract="0.47110698"/>
                  <atom elementType="O"
                        id="a277"
                        x3="2.99611"
                        xFract="0.08957216"
                        y3="3.30066"
                        yFract="0.31306043"
                        z3="21.1503"
                        zFract="0.49186744"/>
                  <atom elementType="O"
                        id="a278"
                        x3="9.24331"
                        xFract="0.5909486"
                        y3="3.5489"
                        yFract="0.33660546"
                        z3="17.8935"
                        zFract="0.41612791"/>
                  <atom elementType="O"
                        id="a279"
                        x3="12.1129"
                        xFract="0.90178749"
                        y3="1.9647"
                        yFract="0.18634753"
                        z3="24.1692"
                        zFract="0.56207442"/>
                  <atom elementType="O"
                        id="a280"
                        x3="15.2426"
                        xFract="0.91645808"
                        y3="7.07615"
                        yFract="0.67115746"
                        z3="16.4454"
                        zFract="0.38245116"/>
                  <atom elementType="O"
                        id="a281"
                        x3="9.20796"
                        xFract="0.42718635"
                        y3="6.94083"
                        yFract="0.65832265"
                        z3="16.6441"
                        zFract="0.38707209"/>
                  <atom elementType="O"
                        id="a282"
                        x3="11.8913"
                        xFract="0.72430766"
                        y3="5.32329"
                        yFract="0.50490249"
                        z3="25.8420"
                        zFract="0.60097674"/>
               </atomArray>
               <bondArray/>
               <formula concise="Cu192O90">
                  <atomArray count="192 90" elementType="Cu O"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">13640.778000000084</scalar>
               </property>
               <formula convention="iupac:inchi" inline="InChI=1S/192Cu.90O">
                  <scalar dataType="xsd:integer" id="auxInfo">AuxInfo=1/0/N:1;2;3;4;5;6;7;8;9;10;11;12;13;14;15;16;17;18;19;20;21;22;23;24;25;26;27;28;29;30;31;32;33;34;35;36;37;38;39;40;41;42;43;44;45;46;47;48;49;50;51;52;53;54;55;56;57;58;59;60;61;62;63;64;65;66;67;68;69;70;71;72;73;74;75;76;77;78;79;80;81;82;83;84;85;86;87;88;89;90;91;92;93;94;95;96;97;98;99;100;101;102;103;104;105;106;107;108;109;110;111;112;113;114;115;116;117;118;119;120;121;122;123;124;125;126;127;128;129;130;131;132;133;134;135;136;137;138;139;140;141;142;143;144;145;146;147;148;149;150;151;152;153;154;155;156;157;158;159;160;161;162;163;164;165;166;167;168;169;170;171;172;173;174;175;176;177;178;179;180;181;182;183;184;185;186;187;188;189;190;191;192;193;194;195;196;197;198;199;200;201;202;203;204;205;206;207;208;209;210;211;212;213;214;215;216;217;218;219;220;221;222;223;224;225;226;227;228;229;230;231;232;233;234;235;236;237;238;239;240;241;242;243;244;245;246;247;248;249;250;251;252;253;254;255;256;257;258;259;260;261;262;263;264;265;266;267;268;269;270;271;272;273;274;275;276;277;278;279;280;281;282/rA:282CuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuCuO3O4O4O4OO3O3O4OO3O4OO4O3OO4O1O4O4O3O3O4OO3O4O3O3O3O3O3O3O4OO4O4O3O3O4O3O4O4OOO3O1O3O4O3O1OO4O4O3O4O4OOO3O3OO3O1O3OO4O4O4O1O4O4O4O4O4O3O3OO4OO4O5O3O1OO4O3O4O3OO4O4/rB:;;;;;;;;;s10;;;;s5s12;;s8s10s11;;;;s7;s11s14;;;;;;;s26;;;;s24;;;;s18;;;;s4;s38;;s36;s9s17s22;s25;s10s11s22;;;;s15;;;s8s52;;;;s30;s36s44;s55;;;;s5;;s34;;;s1;s58;s41;;;s59;s3s66;s65;s14;;;s66;;;;s42;s59;s15s51;s78;s53;s3s18s36;s23;s48;;;s47s82;;s42;s1s39;s27;s24s83;s75s80;s84;s84;s28;s32;s28s96s101s103;;s49s54;;;s55s109;;;;s56;;;;s84;;s34s75;s8s9s93;s16s60;;s26;s18s115;s77s82;;s77;;;;s117;;s90;s113;s105;;s25;;;s42s96;s117s132;;s2s75;s2;s83;s1s6s32s104;;s98s118s125;s118;;s60s68;;s25s30s115;;;s55;s57;s57;s25s30s155;s153;s87;s153;s153;;;;s28s101s103s166;s24s148;s27s42;s26s139;;s4s13;;s128;;s26s41;;s3s89s125;s81s129s133s142;s72s149;s151s155;s165;s175;s122;s13s22s173;s39s97s137s140;;s25s46s138;s42s170;;s139s171;s52s65s135;s12s65s71s76;s4s13s40s41;s29s59s74s177;s83s136;s72s137s168;s27s96s146;s36s59s69s182;s53s176;s30s72s160;s73s95s124s177;s62s69;s39s97s187s188;s49s50s54;s108s185;s92s153s157s165;s107;s8s48s52s54;s13s17s45s67;s71s73s173;s67s86s130;s2s145s170s190;s38s141;s25s139s192;s140s166s181s182;s96s136s141;s82s132s142;s39s53s151;s31s35s169;s57s108s127;s61s113s159;s9s87s121s163;s87s109;s78s110s119s128;s26s151s155s160;s118s149s168;s70s125s154;s46s132s172s191;s24s31s33;s34s120s148s169;s167s173s184s186;s127s164;s134s174;s77s128s133;s171;s112s124s139;s79s100s120s144;s28s98s166;s150;s7s178;s106s111s115s117;s18s44s115s155;s116s123s138;s125s145s178s179;s3s18s37s149;s130s131;s123s133;s40s94s143;s38s102s190;s16s50;s56s68s152;s121;s8s11s93;s113s135;s9s14s45s175;s20s22s77s186;s60s90s109s134;s63;s43s91s107s156;s153s156s158s163;s48s161s164s184;s55s110s122s161;s174s175s183s191;s131s165s183;s49s57s159;s167s192;s16s56s122s185;s31s104;s24s83s99s146;s27s75s98s120s144;s21s118s150;s3;s89s179;s19s44s85s143;s21s58s106;s20s29s63s189;s36s80s89;s41s176;s4s26s46s171;s1s34s37s97;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;</scalar>
               </formula>
            </molecule>
            <module dictRef="cc:userDefinedModule" id="otherComponents">
               <module cmlx:templateRef="box" id="box">
                  <scalar dataType="xsd:double" dictRef="l:xlo">0.0</scalar>
                  <scalar dataType="xsd:double" dictRef="l:xhi">12.174243</scalar>
                  <scalar dataType="xsd:double" dictRef="l:ylo">0.0</scalar>
                  <scalar dataType="xsd:double" dictRef="l:yhi">10.543204</scalar>
                  <scalar dataType="xsd:double" dictRef="l:zlo">0.0</scalar>
                  <scalar dataType="xsd:double" dictRef="l:zhi">43.000000</scalar>
               </module>
               <module cmlx:templateRef="tilt" id="tilt">
                  <scalar dataType="xsd:double" dictRef="l:xyTilt">6.087121</scalar>
                  <scalar dataType="xsd:double" dictRef="l:xzTilt">0.000000</scalar>
                  <scalar dataType="xsd:double" dictRef="l:yzTilt">0.000000</scalar>
               </module>
               <module cmlx:templateRef="masses" id="masses">
                  <list cmlx:templateRef="atomType">
                     <list>
                        <scalar dataType="xsd:integer" dictRef="x:serial">1</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:atomicmass">15.9994</scalar>
                        <scalar dictRef="cc:atomType">O</scalar>
                     </list>
                     <list>
                        <scalar dataType="xsd:integer" dictRef="x:serial">2</scalar>
                        <scalar dataType="xsd:double" dictRef="cc:atomicmass">63.546</scalar>
                        <scalar dictRef="cc:atomType">Cu</scalar>
                     </list>
                  </list>
                  <map id="atomTypeLabels">
                     <link from="1" to="O"/>
                     <link from="2" to="Cu"/>
                  </map>
               </module>
               <module cmlx:templateRef="atoms" id="atoms">
                  <list dictRef="l:axis">
                     <array dictRef="cc:lattice">12.174243 0 0</array>
                     <array dictRef="cc:lattice">6.087121 10.543204 0</array>
                     <array dictRef="cc:lattice">0 0 43</array>
                  </list>
               </module>
               <module cmlx:templateRef="input" id="input">
                  <parameterList>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">variable</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">Htemperature equal 1100</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">variable</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">Ltemperature equal 300</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">variable</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">pressure equal 1.0</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">variable</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">N_steps equal 333333</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">variable</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">N_steps_cooling equal 333333*10</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">variable</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">seed equal 18</scalar>
                     </parameter>
                     <parameter/>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">units</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">metal</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">box</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">tilt large</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">boundary</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">p p p</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">atom_style</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">atomic</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">read_data</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">structure.lammps</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">pair_style</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">nnp dir /gpfs/projects/iciq72/zlian/1NN/n2p2/al/final-combine/n2p2/HDNNP_1 showew yes resetew yes maxew 750000000 showewsum 10000 cflength 1.889726124626 cfenergy 0.036749322175655 emap "1:O,2:Cu"</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">pair_coeff</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">* * 6.350126530836</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">timestep</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">0.003</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">thermo</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">1000</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">variable</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">thermo equal 0</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">thermo_style</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">custom v_thermo step time temp epair etotal fmax fnorm press</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">thermo_modify</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">format line "thermo %8d %10.1f %8.1f %15.3f %15.3f %9.3f %9.3f %9.1f"</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">velocity</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">all create ${Htemperature} ${seed}</scalar>
                     </parameter>
                     <parameter/>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">fix</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">annealing all nvt temp ${Htemperature} ${Ltemperature} $(100.0*dt) fixedpoint 0.0 0.0 0.0</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">dump</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">annealing all custom 100 annealing.lammpstrj id element x y z</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">dump_modify</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">annealing pbc yes sort id element  O Cu</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">run</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">${N_steps_cooling}</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">unfix</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">annealing</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">undump</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">annealing</scalar>
                     </parameter>
                     <parameter/>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">fix</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">int all nvt temp ${Ltemperature} ${Ltemperature} 0.1 fixedpoint 0.0 0.0 0.0</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">dump</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">eq all custom 100 eqLT.lammpstrj id element x y z</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">dump_modify</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">eq pbc yes sort id element  O Cu</scalar>
                     </parameter>
                     <parameter>
                        <scalar dataType="xsd:string" dictRef="x:label">run</scalar>
                        <scalar dataType="xsd:string" dictRef="x:value">${N_steps}</scalar>
                     </parameter>
                  </parameterList>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation"/>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList>
               <property dictRef="cc:walltime">
                  <scalar dataType="xsd:string">6:29:59</scalar>
               </property>
               <property dictRef="cc:walltime">
                  <scalar dataType="xsd:integer" id="walltime" units="si:s">23399</scalar>
               </property>
               <property dictRef="l:nsperday">
                  <scalar dataType="xsd:double">40.565</scalar>
               </property>
               <property dictRef="l:hourperns">
                  <scalar dataType="xsd:double">0.592</scalar>
               </property>
               <property dictRef="l:timestepperns">
                  <scalar dataType="xsd:double">156.501</scalar>
               </property>
               <property dictRef="l:cpuusage">
                  <scalar dataType="xsd:double">99.7</scalar>
               </property>
               <property dictRef="mpi">
                  <list cmlx:templateRef="timing">
                     <array dataType="xsd:string" dictRef="l:section" size="6">Pair Neigh Comm Output Modify Other</array>
                     <array dataType="xsd:double" dictRef="l:mintime" size="5">3.7196 0.5526 82.585 4.2163 32.913</array>
                     <array dataType="xsd:double" dictRef="l:avgtime" size="6">12658 4.339 4763.2 5.3787 3844 23.72</array>
                     <array dataType="xsd:double" dictRef="l:maxtime" size="5">20616 8.4014 18860 9.8909 21185</array>
                     <array dataType="xsd:double" dictRef="l:varavg" size="5">6940.1 130.9 7656.5 41.4 12544.0</array>
                     <array dataType="xsd:double" dictRef="l:totalpercent" size="6">59.43 0.02 22.36 0.03 18.05 0.11</array>
                  </list>
               </property>
            </propertyList>
            <molecule id="finalization">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">12.174243</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">12.174243001281722</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">43.0</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>
               <atomArray>
                  <atom elementType="Cu"
                        id="a1"
                        x3="13.8333"
                        xFract="0.87282621"
                        y3="5.55521"
                        yFract="0.5268996"
                        z3="25.5556"
                        zFract="0.59431628"/>
                  <atom elementType="Cu"
                        id="a2"
                        x3="6.74808"
                        xFract="0.52233656"
                        y3="0.673816"
                        yFract="0.06390998"
                        z3="28.4355"
                        zFract="0.6612907"/>
                  <atom elementType="Cu"
                        id="a3"
                        x3="8.79778"
                        xFract="0.63269204"
                        y3="1.8970"
                        yFract="0.17992633"
                        z3="25.5089"
                        zFract="0.59323023"/>
                  <atom elementType="Cu"
                        id="a4"
                        x3="10.8779"
                        xFract="0.59726514"
                        y3="6.2469"
                        yFract="0.5925049"
                        z3="16.0728"
                        zFract="0.37378605"/>
                  <atom elementType="Cu"
                        id="a5"
                        x3="15.2983"
                        xFract="0.8196519"
                        y3="9.21392"
                        yFract="0.8739203"
                        z3="15.6451"
                        zFract="0.36383953"/>
                  <atom elementType="Cu"
                        id="a6"
                        x3="16.7848"
                        xFract="0.93475275"
                        y3="9.36155"
                        yFract="0.88792268"
                        z3="25.6547"
                        zFract="0.59662093"/>
                  <atom elementType="Cu"
                        id="a7"
                        x3="1.33655"
                        xFract="0.05159735"
                        y3="1.22697"
                        yFract="0.11637544"
                        z3="23.1333"
                        zFract="0.53798372"/>
                  <atom elementType="Cu"
                        id="a8"
                        x3="12.6373"
                        xFract="0.88476788"
                        y3="3.23187"
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      </module>
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</module>
