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            </molecule>
            <parameterList>
               <parameter dictRef="v:nwrite">
                  <scalar dataType="xsd:integer">0</scalar>
               </parameter>
               <parameter dictRef="v:ispin">
                  <scalar dataType="xsd:integer">2</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">-.3E-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">1677.0000</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 Cu 22Jun2005|PAW_PBE O 08Apr2002|PAW_PBE C 08Apr2002|PAW_PBE H 15Jun2001</array>
                  <array dictRef="cc:atomType" size="4">Cu O C H</array>
                  <array dataType="xsd:double" dictRef="cc:mass" size="4">63.55 16.00 12.01 1.00</array>
                  <array dataType="xsd:double" dictRef="cc:valence" size="4">11.00 6.00 4.00 1.00</array>
                  <array dataType="xsd:integer" dictRef="cc:atomcount" size="4">150 2 3 3</array>
               </module>
            </module>
         </module>
         <module dictRef="cc:calculation" id="calculation"/>
         <module dictRef="cc:finalization" id="finalization">
            <propertyList/>
            <molecule id="final">
               <crystal>
                  <scalar id="sc1" title="a" units="nonsi:angstrom">14.541899</scalar>
                  <scalar id="sc2" title="b" units="nonsi:angstrom">14.541899</scalar>
                  <scalar id="sc3" title="c" units="nonsi:angstrom">22.0</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="Cu"
                        id="a1"
                        x3="13.210209"
                        xFract="0.90842393"
                        y3="0.929108"
                        yFract="0.06389179"
                        z3="1.64747"
                        zFract="0.074885"/>
                  <atom elementType="Cu"
                        id="a2"
                        x3="14.383908"
                        xFract="0.98913546"
                        y3="11.3405"
                        yFract="0.77985"
                        z3="1.97805"
                        zFract="0.08991136"/>
                  <atom elementType="Cu"
                        id="a3"
                        x3="13.845177"
                        xFract="0.95208865"
                        y3="5.10416"
                        yFract="0.3509968"
                        z3="1.79567"
                        zFract="0.08162136"/>
                  <atom elementType="Cu"
                        id="a4"
                        x3="13.806454"
                        xFract="0.94942579"
                        y3="7.31891"
                        yFract="0.50329809"
                        z3="0.546732"
                        zFract="0.02485145"/>
                  <atom elementType="Cu"
                        id="a5"
                        x3="12.1136"
                        xFract="0.83301362"
                        y3="0.837923"
                        yFract="0.05762129"
                        z3="3.83646"
                        zFract="0.17438455"/>
                  <atom elementType="Cu"
                        id="a6"
                        x3="9.85604"
                        xFract="0.67776843"
                        y3="11.8631"
                        yFract="0.81578754"
                        z3="0.548742"
                        zFract="0.02494282"/>
                  <atom elementType="Cu"
                        id="a7"
                        x3="11.1338"
                        xFract="0.7656359"
                        y3="3.13977"
                        yFract="0.21591197"
                        z3="3.79312"
                        zFract="0.17241455"/>
                  <atom elementType="Cu"
                        id="a8"
                        x3="11.2073"
                        xFract="0.77069027"
                        y3="7.58269"
                        yFract="0.5214374"
                        z3="0.930183"
                        zFract="0.04228105"/>
                  <atom elementType="Cu"
                        id="a9"
                        x3="11.4802"
                        xFract="0.78945673"
                        y3="13.6595"
                        yFract="0.93932024"
                        z3="1.25452"
                        zFract="0.05702364"/>
                  <atom elementType="Cu"
                        id="a10"
                        x3="12.2520"
                        xFract="0.84253095"
                        y3="3.22883"
                        yFract="0.22203634"
                        z3="1.58598"
                        zFract="0.07209"/>
                  <atom elementType="Cu"
                        id="a11"
                        x3="11.2470"
                        xFract="0.77342031"
                        y3="5.42698"
                        yFract="0.3731961"
                        z3="2.24213"
                        zFract="0.101915"/>
                  <atom elementType="Cu"
                        id="a12"
                        x3="12.7968"
                        xFract="0.87999511"
                        y3="9.4678"
                        yFract="0.6510704"
                        z3="1.40804"
                        zFract="0.06400182"/>
                  <atom elementType="Cu"
                        id="a13"
                        x3="1.0107"
                        xFract="0.06950261"
                        y3="0.209501"
                        yFract="0.01440672"
                        z3="2.35169"
                        zFract="0.106895"/>
                  <atom elementType="Cu"
                        id="a14"
                        x3="0.305582"
                        xFract="0.0210139"
                        y3="2.78962"
                        yFract="0.19183327"
                        z3="1.46618"
                        zFract="0.06664455"/>
                  <atom elementType="Cu"
                        id="a15"
                        x3="1.78774"
                        xFract="0.12293718"
                        y3="7.02216"
                        yFract="0.48289154"
                        z3="0.233281"
                        zFract="0.01060368"/>
                  <atom elementType="Cu"
                        id="a16"
                        x3="0.859954"
                        xFract="0.05913629"
                        y3="9.21548"
                        yFract="0.63371916"
                        z3="1.06912"
                        zFract="0.04859636"/>
                  <atom elementType="Cu"
                        id="a17"
                        x3="2.62898"
                        xFract="0.18078657"
                        y3="2.11328"
                        yFract="0.14532352"
                        z3="1.52178"
                        zFract="0.06917182"/>
                  <atom elementType="Cu"
                        id="a18"
                        x3="3.08007"
                        xFract="0.21180659"
                        y3="10.4453"
                        yFract="0.71828996"
                        z3="0.734371"
                        zFract="0.0333805"/>
                  <atom elementType="Cu"
                        id="a19"
                        x3="3.98399"
                        xFract="0.27396628"
                        y3="6.13259"
                        yFract="0.42171865"
                        z3="0.995795"
                        zFract="0.04526341"/>
                  <atom elementType="Cu"
                        id="a20"
                        x3="3.94461"
                        xFract="0.27125824"
                        y3="8.33661"
                        yFract="0.57328207"
                        z3="21.805632"
                        zFract="0.99116509"/>
                  <atom elementType="Cu"
                        id="a21"
                        x3="4.6979"
                        xFract="0.32305959"
                        y3="12.3091"
                        yFract="0.84645754"
                        z3="1.23022"
                        zFract="0.05591909"/>
                  <atom elementType="Cu"
                        id="a22"
                        x3="5.17542"
                        xFract="0.35589712"
                        y3="1.80547"
                        yFract="0.12415641"
                        z3="1.41029"
                        zFract="0.06410409"/>
                  <atom elementType="Cu"
                        id="a23"
                        x3="6.48483"
                        xFract="0.44594107"
                        y3="5.95082"
                        yFract="0.40921891"
                        z3="0.587032"
                        zFract="0.02668327"/>
                  <atom elementType="Cu"
                        id="a24"
                        x3="5.65471"
                        xFract="0.38885637"
                        y3="10.1839"
                        yFract="0.70031431"
                        z3="0.262322"
                        zFract="0.01192373"/>
                  <atom elementType="Cu"
                        id="a25"
                        x3="6.34913"
                        xFract="0.43660941"
                        y3="14.178849"
                        yFract="0.97503421"
                        z3="1.75869"
                        zFract="0.07994045"/>
                  <atom elementType="Cu"
                        id="a26"
                        x3="7.28591"
                        xFract="0.50102879"
                        y3="12.0787"
                        yFract="0.83061366"
                        z3="0.834173"
                        zFract="0.03791695"/>
                  <atom elementType="Cu"
                        id="a27"
                        x3="8.0166"
                        xFract="0.55127601"
                        y3="1.71282"
                        yFract="0.11778517"
                        z3="1.51449"
                        zFract="0.06884045"/>
                  <atom elementType="Cu"
                        id="a28"
                        x3="8.2756"
                        xFract="0.56908661"
                        y3="7.76977"
                        yFract="0.53430229"
                        z3="1.04618"
                        zFract="0.04755364"/>
                  <atom elementType="Cu"
                        id="a29"
                        x3="8.91044"
                        xFract="0.61274253"
                        y3="13.9607"
                        yFract="0.9600328"
                        z3="1.58872"
                        zFract="0.07221455"/>
                  <atom elementType="Cu"
                        id="a30"
                        x3="10.6374"
                        xFract="0.73150006"
                        y3="1.33997"
                        yFract="0.09214546"
                        z3="1.73533"
                        zFract="0.07887864"/>
                  <atom elementType="Cu"
                        id="a31"
                        x3="9.61525"
                        xFract="0.66121007"
                        y3="3.60058"
                        yFract="0.2476004"
                        z3="1.85534"
                        zFract="0.08433364"/>
                  <atom elementType="Cu"
                        id="a32"
                        x3="8.2181"
                        xFract="0.56513252"
                        y3="10.0075"
                        yFract="0.68818385"
                        z3="21.9087277"
                        zFract="0.99585126"/>
                  <atom elementType="Cu"
                        id="a33"
                        x3="13.326079"
                        xFract="0.91639194"
                        y3="13.3644"
                        yFract="0.91902715"
                        z3="2.93957"
                        zFract="0.13361682"/>
                  <atom elementType="Cu"
                        id="a34"
                        x3="14.5136725"
                        xFract="0.99805895"
                        y3="0.274825"
                        yFract="0.01889884"
                        z3="4.69219"
                        zFract="0.21328136"/>
                  <atom elementType="Cu"
                        id="a35"
                        x3="0.85719"
                        xFract="0.05894622"
                        y3="6.97449"
                        yFract="0.47961343"
                        z3="2.47066"
                        zFract="0.11230273"/>
                  <atom elementType="Cu"
                        id="a36"
                        x3="14.458146"
                        xFract="0.99424057"
                        y3="9.16662"
                        yFract="0.63035921"
                        z3="3.39638"
                        zFract="0.15438091"/>
                  <atom elementType="Cu"
                        id="a37"
                        x3="10.4540"
                        xFract="0.71888823"
                        y3="13.5560"
                        yFract="0.93220287"
                        z3="3.52533"
                        zFract="0.16024227"/>
                  <atom elementType="Cu"
                        id="a38"
                        x3="9.32071"
                        xFract="0.64095549"
                        y3="1.21316"
                        yFract="0.08342514"
                        z3="3.77608"
                        zFract="0.17164"/>
                  <atom elementType="Cu"
                        id="a39"
                        x3="12.8998"
                        xFract="0.88707809"
                        y3="4.98759"
                        yFract="0.34298065"
                        z3="4.15625"
                        zFract="0.18892045"/>
                  <atom elementType="Cu"
                        id="a40"
                        x3="9.97905"
                        xFract="0.68622743"
                        y3="9.62383"
                        yFract="0.66180009"
                        z3="1.63382"
                        zFract="0.07426455"/>
                  <atom elementType="Cu"
                        id="a41"
                        x3="13.2104"
                        xFract="0.90843706"
                        y3="0.428763"
                        yFract="0.02948466"
                        z3="6.7905"
                        zFract="0.30865909"/>
                  <atom elementType="Cu"
                        id="a42"
                        x3="11.6564"
                        xFract="0.80157344"
                        y3="11.4903"
                        yFract="0.79015127"
                        z3="2.35931"
                        zFract="0.10724136"/>
                  <atom elementType="Cu"
                        id="a43"
                        x3="13.7359"
                        xFract="0.94457402"
                        y3="2.6900"
                        yFract="0.18498272"
                        z3="3.56765"
                        zFract="0.16216591"/>
                  <atom elementType="Cu"
                        id="a44"
                        x3="12.8482"
                        xFract="0.88352972"
                        y3="7.26817"
                        yFract="0.49980886"
                        z3="2.77681"
                        zFract="0.12621864"/>
                  <atom elementType="Cu"
                        id="a45"
                        x3="1.0066"
                        xFract="0.06922067"
                        y3="12.611059"
                        yFract="0.86722229"
                        z3="3.93809"
                        zFract="0.17900409"/>
                  <atom elementType="Cu"
                        id="a46"
                        x3="2.04075"
                        xFract="0.14033587"
                        y3="10.4238"
                        yFract="0.71681147"
                        z3="3.0313"
                        zFract="0.13778636"/>
                  <atom elementType="Cu"
                        id="a47"
                        x3="1.83395"
                        xFract="0.12611489"
                        y3="4.76082"
                        yFract="0.3273864"
                        z3="1.48977"
                        zFract="0.06771682"/>
                  <atom elementType="Cu"
                        id="a48"
                        x3="3.01323"
                        xFract="0.20721021"
                        y3="6.0967"
                        yFract="0.41925061"
                        z3="3.39452"
                        zFract="0.15429636"/>
                  <atom elementType="Cu"
                        id="a49"
                        x3="2.06359"
                        xFract="0.1419065"
                        y3="12.5335"
                        yFract="0.86188881"
                        z3="1.65386"
                        zFract="0.07517545"/>
                  <atom elementType="Cu"
                        id="a50"
                        x3="4.05877"
                        xFract="0.27910866"
                        y3="3.98053"
                        yFract="0.27372835"
                        z3="2.24421"
                        zFract="0.10200955"/>
                  <atom elementType="Cu"
                        id="a51"
                        x3="5.59478"
                        xFract="0.38473517"
                        y3="5.85784"
                        yFract="0.40282497"
                        z3="2.89642"
                        zFract="0.13165545"/>
                  <atom elementType="Cu"
                        id="a52"
                        x3="3.03135"
                        xFract="0.20845627"
                        y3="8.27122"
                        yFract="0.56878541"
                        z3="2.0677"
                        zFract="0.09398636"/>
                  <atom elementType="Cu"
                        id="a53"
                        x3="3.64138"
                        xFract="0.25040609"
                        y3="14.412384"
                        yFract="0.99109367"
                        z3="2.04308"
                        zFract="0.09286727"/>
                  <atom elementType="Cu"
                        id="a54"
                        x3="4.69722"
                        xFract="0.32301283"
                        y3="10.1173"
                        yFract="0.69573444"
                        z3="2.5952"
                        zFract="0.11796364"/>
                  <atom elementType="Cu"
                        id="a55"
                        x3="6.58807"
                        xFract="0.45304056"
                        y3="3.76939"
                        yFract="0.25920892"
                        z3="1.81901"
                        zFract="0.08268227"/>
                  <atom elementType="Cu"
                        id="a56"
                        x3="5.66904"
                        xFract="0.38984179"
                        y3="8.02726"
                        yFract="0.55200906"
                        z3="1.53771"
                        zFract="0.06989591"/>
                  <atom elementType="Cu"
                        id="a57"
                        x3="6.30676"
                        xFract="0.43369576"
                        y3="11.9720"
                        yFract="0.82327624"
                        z3="3.14347"
                        zFract="0.142885"/>
                  <atom elementType="Cu"
                        id="a58"
                        x3="6.62879"
                        xFract="0.45584074"
                        y3="1.48012"
                        yFract="0.10178313"
                        z3="3.44771"
                        zFract="0.15671409"/>
                  <atom elementType="Cu"
                        id="a59"
                        x3="8.2128"
                        xFract="0.56476805"
                        y3="5.60313"
                        yFract="0.38530937"
                        z3="2.31205"
                        zFract="0.10509318"/>
                  <atom elementType="Cu"
                        id="a60"
                        x3="7.30845"
                        xFract="0.50257879"
                        y3="9.85055"
                        yFract="0.6773909"
                        z3="2.14471"
                        zFract="0.09748682"/>
                  <atom elementType="Cu"
                        id="a61"
                        x3="7.76763"
                        xFract="0.53415513"
                        y3="13.809496"
                        yFract="0.94963498"
                        z3="3.94356"
                        zFract="0.17925273"/>
                  <atom elementType="Cu"
                        id="a62"
                        x3="8.91778"
                        xFract="0.61324728"
                        y3="11.7098"
                        yFract="0.80524559"
                        z3="2.77998"
                        zFract="0.12636273"/>
                  <atom elementType="Cu"
                        id="a63"
                        x3="8.04924"
                        xFract="0.55352055"
                        y3="3.40475"
                        yFract="0.23413379"
                        z3="3.76211"
                        zFract="0.171005"/>
                  <atom elementType="Cu"
                        id="a64"
                        x3="9.84539"
                        xFract="0.67703606"
                        y3="7.41558"
                        yFract="0.50994578"
                        z3="2.96054"
                        zFract="0.13457"/>
                  <atom elementType="Cu"
                        id="a65"
                        x3="1.56698"
                        xFract="0.10775622"
                        y3="14.302138"
                        yFract="0.9835124"
                        z3="6.68053"
                        zFract="0.30366045"/>
                  <atom elementType="Cu"
                        id="a66"
                        x3="13.392789"
                        xFract="0.92097937"
                        y3="11.2101"
                        yFract="0.77088281"
                        z3="4.26804"
                        zFract="0.19400182"/>
                  <atom elementType="Cu"
                        id="a67"
                        x3="0.557323"
                        xFract="0.03832532"
                        y3="2.1951"
                        yFract="0.15095002"
                        z3="6.18071"
                        zFract="0.28094136"/>
                  <atom elementType="Cu"
                        id="a68"
                        x3="14.438073"
                        xFract="0.99286022"
                        y3="6.96002"
                        yFract="0.47861837"
                        z3="4.7186"
                        zFract="0.21448182"/>
                  <atom elementType="Cu"
                        id="a69"
                        x3="9.41048"
                        xFract="0.64712869"
                        y3="13.402749"
                        yFract="0.92166429"
                        z3="5.89796"
                        zFract="0.26808909"/>
                  <atom elementType="Cu"
                        id="a70"
                        x3="10.5440"
                        xFract="0.72507724"
                        y3="11.3390"
                        yFract="0.77974685"
                        z3="4.66555"
                        zFract="0.21207045"/>
                  <atom elementType="Cu"
                        id="a71"
                        x3="12.7458"
                        xFract="0.876488"
                        y3="2.69515"
                        yFract="0.18533687"
                        z3="5.7411"
                        zFract="0.26095909"/>
                  <atom elementType="Cu"
                        id="a72"
                        x3="11.4788"
                        xFract="0.78936045"
                        y3="6.95391"
                        yFract="0.47819821"
                        z3="4.7727"
                        zFract="0.21694091"/>
                  <atom elementType="Cu"
                        id="a73"
                        x3="12.1894"
                        xFract="0.83822615"
                        y3="13.2447"
                        yFract="0.91079576"
                        z3="5.28204"
                        zFract="0.24009273"/>
                  <atom elementType="Cu"
                        id="a74"
                        x3="10.8450"
                        xFract="0.74577605"
                        y3="0.749546"
                        yFract="0.05154389"
                        z3="5.89991"
                        zFract="0.26817773"/>
                  <atom elementType="Cu"
                        id="a75"
                        x3="14.4233"
                        xFract="0.99184433"
                        y3="4.65606"
                        yFract="0.32018239"
                        z3="6.21605"
                        zFract="0.28254773"/>
                  <atom elementType="Cu"
                        id="a76"
                        x3="11.5359"
                        xFract="0.79328704"
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                  <bond atomRefs2="a110 a126" order="S"/>
                  <bond atomRefs2="a110 a124" order="S"/>
                  <bond atomRefs2="a110 a125" order="S"/>
                  <bond atomRefs2="a110 a129" order="S"/>
                  <bond atomRefs2="a110 a112" order="S"/>
                  <bond atomRefs2="a110 a113" order="S"/>
                  <bond atomRefs2="a110 a111" order="S"/>
                  <bond atomRefs2="a111 a151" order="S"/>
                  <bond atomRefs2="a111 a126" order="S"/>
                  <bond atomRefs2="a111 a155" order="S"/>
                  <bond atomRefs2="a111 a125" order="S"/>
                  <bond atomRefs2="a112 a113" order="S"/>
                  <bond atomRefs2="a112 a147" order="S"/>
                  <bond atomRefs2="a112 a145" order="S"/>
                  <bond atomRefs2="a113 a121" order="S"/>
                  <bond atomRefs2="a113 a124" order="S"/>
                  <bond atomRefs2="a113 a125" order="S"/>
                  <bond atomRefs2="a114 a137" order="S"/>
                  <bond atomRefs2="a114 a118" order="S"/>
                  <bond atomRefs2="a114 a117" order="S"/>
                  <bond atomRefs2="a114 a116" order="S"/>
                  <bond atomRefs2="a114 a115" order="S"/>
                  <bond atomRefs2="a115 a117" order="S"/>
                  <bond atomRefs2="a115 a128" order="S"/>
                  <bond atomRefs2="a115 a116" order="S"/>
                  <bond atomRefs2="a115 a118" order="S"/>
                  <bond atomRefs2="a118 a137" order="S"/>
                  <bond atomRefs2="a118 a142" order="S"/>
                  <bond atomRefs2="a119 a127" order="S"/>
                  <bond atomRefs2="a119 a120" order="S"/>
                  <bond atomRefs2="a119 a131" order="S"/>
                  <bond atomRefs2="a119 a132" order="S"/>
                  <bond atomRefs2="a120 a127" order="S"/>
                  <bond atomRefs2="a120 a132" order="S"/>
                  <bond atomRefs2="a120 a123" order="S"/>
                  <bond atomRefs2="a120 a122" order="S"/>
                  <bond atomRefs2="a121 a135" order="S"/>
                  <bond atomRefs2="a121 a123" order="S"/>
                  <bond atomRefs2="a121 a124" order="S"/>
                  <bond atomRefs2="a121 a122" order="S"/>
                  <bond atomRefs2="a122 a124" order="S"/>
                  <bond atomRefs2="a122 a132" order="S"/>
                  <bond atomRefs2="a123 a127" order="S"/>
                  <bond atomRefs2="a123 a125" order="S"/>
                  <bond atomRefs2="a123 a124" order="S"/>
                  <bond atomRefs2="a123 a133" order="S"/>
                  <bond atomRefs2="a124 a127" order="S"/>
                  <bond atomRefs2="a124 a125" order="S"/>
                  <bond atomRefs2="a124 a129" order="S"/>
                  <bond atomRefs2="a124 a132" order="S"/>
                  <bond atomRefs2="a125 a127" order="S"/>
                  <bond atomRefs2="a125 a126" order="S"/>
                  <bond atomRefs2="a125 a133" order="S"/>
                  <bond atomRefs2="a126 a127" order="S"/>
                  <bond atomRefs2="a126 a129" order="S"/>
                  <bond atomRefs2="a126 a131" order="S"/>
                  <bond atomRefs2="a127 a131" order="S"/>
                  <bond atomRefs2="a128 a131" order="S"/>
                  <bond atomRefs2="a128 a130" order="S"/>
                  <bond atomRefs2="a129 a131" order="S"/>
                  <bond atomRefs2="a129 a130" order="S"/>
                  <bond atomRefs2="a129 a132" order="S"/>
                  <bond atomRefs2="a130 a131" order="S"/>
                  <bond atomRefs2="a133 a134" order="S"/>
                  <bond atomRefs2="a134 a135" order="S"/>
                  <bond atomRefs2="a136 a137" order="S"/>
                  <bond atomRefs2="a136 a145" order="S"/>
                  <bond atomRefs2="a136 a143" order="S"/>
                  <bond atomRefs2="a136 a150" order="S"/>
                  <bond atomRefs2="a137 a143" order="S"/>
                  <bond atomRefs2="a137 a142" order="S"/>
                  <bond atomRefs2="a138 a147" order="S"/>
                  <bond atomRefs2="a138 a144" order="S"/>
                  <bond atomRefs2="a138 a139" order="S"/>
                  <bond atomRefs2="a138 a140" order="S"/>
                  <bond atomRefs2="a139 a144" order="S"/>
                  <bond atomRefs2="a139 a148" order="S"/>
                  <bond atomRefs2="a139 a141" order="S"/>
                  <bond atomRefs2="a139 a140" order="S"/>
                  <bond atomRefs2="a140 a141" order="S"/>
                  <bond atomRefs2="a142 a146" order="S"/>
                  <bond atomRefs2="a142 a143" order="S"/>
                  <bond atomRefs2="a143 a145" order="S"/>
                  <bond atomRefs2="a143 a146" order="S"/>
                  <bond atomRefs2="a143 a149" order="S"/>
                  <bond atomRefs2="a143 a150" order="S"/>
                  <bond atomRefs2="a143 a144" order="S"/>
                  <bond atomRefs2="a144 a147" order="S"/>
                  <bond atomRefs2="a144 a149" order="S"/>
                  <bond atomRefs2="a144 a145" order="S"/>
                  <bond atomRefs2="a144 a146" order="S"/>
                  <bond atomRefs2="a145 a147" order="S"/>
                  <bond atomRefs2="a145 a146" order="S"/>
                  <bond atomRefs2="a148 a150" order="S"/>
                  <bond atomRefs2="a149 a150" order="S"/>
                  <bond atomRefs2="a151 a154" order="S"/>
                  <bond atomRefs2="a152 a156" order="S"/>
                  <bond atomRefs2="a152 a155" order="S"/>
                  <bond atomRefs2="a153 a157" order="S"/>
                  <bond atomRefs2="a153 a155" order="S"/>
                  <bond atomRefs2="a153 a154" order="S"/>
                  <bond atomRefs2="a154 a158" order="S"/>
               </bondArray>
               <formula concise="C3H3Cu150O2">
                  <atomArray count="3 3 150 2" elementType="C H Cu O"/>
               </formula>
               <property dictRef="cml:molmass">
                  <scalar units="unit:dalton">9599.930900000021</scalar>
               </property>
            </molecule>
         </module>
      </module>
   </module>
</module>
