864 Lattice="21.442541885375988 0.0 0.0 0.0 21.442541885375988 0.0 0.0 0.0 21.442541885375988" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2772.7807102727797 stress="-0.005787739790036636 -6.063911895724347e-05 -0.00013287609684748398 -6.063911895724347e-05 -0.0056272738741641225 4.922817543860502e-06 -0.00013287609684748398 4.922817543860502e-06 -0.00562298727550685" pbc="F F F" Cu 0.00007144 0.00815794 0.00809627 0.58616764 0.58356905 0.65788803 Cu 1.75280830 1.76429415 0.01182276 0.28670113 0.09832116 -0.25225620 Cu 1.81662633 0.02483787 1.77867470 -0.08137535 -0.24273091 0.11417351 Cu 0.03407921 1.81748211 1.79046565 -0.30463395 -0.30243114 0.05198369 Cu 3.53373808 0.02135131 0.00604345 0.16617935 0.28599711 0.30943753 Cu 5.33366137 1.79950423 0.02603421 0.28803727 -0.16218653 -0.40191867 Cu 5.38695414 0.03476097 1.80484229 -0.26386456 -0.40072817 -0.12507319 Cu 3.59441833 1.81211017 1.75485334 -0.39672474 -0.28797991 0.39562134 Cu 7.14814909 0.00638679 0.02725859 0.04842762 0.42763052 0.29588081 Cu 8.96134570 1.79632701 0.00006546 -0.26479337 -0.09512033 -0.08194276 Cu 8.92823596 0.00635320 1.80942613 0.02747720 -0.18274653 -0.15241856 Cu 7.13704793 1.76828612 1.80916783 0.26036061 0.34064116 -0.15993483 Cu 10.70868369 0.03356459 0.00048895 0.12566154 0.25727824 0.42356258 Cu 12.50755986 1.81231070 0.00622211 0.05722653 -0.21052208 -0.13346917 Cu 12.54666542 0.02560227 1.82252853 -0.12255273 -0.22688895 -0.44511050 Cu 10.71968322 1.78453759 1.77024204 0.05988831 0.14883141 0.30430338 Cu 14.30271946 0.02973150 0.00180640 -0.02977075 0.34204444 0.39267629 Cu 16.10371922 1.77015036 0.03020231 -0.08467488 0.12009832 -0.44233992 Cu 16.09334610 0.00892272 1.79432277 -0.07552017 -0.31272852 0.01797114 Cu 14.31820852 1.81898172 1.77892567 -0.24811425 -0.21104932 0.09257928 Cu 17.84294332 0.00713003 0.00510614 0.09248551 0.41922228 0.48531944 Cu 19.65442701 1.77065146 0.02233363 -0.57767300 0.12793438 0.47783249 Cu 19.64020708 0.02598604 1.81934501 -0.44961929 0.36771100 -0.06145075 Cu 17.84903588 1.78283294 1.79729969 0.27030370 0.09594168 -0.02924716 Cu 0.03416984 3.51094520 0.03295900 0.10566759 0.22018969 0.08977855 Cu 1.76804729 5.34285069 0.01064996 0.17577297 0.03061031 -0.40709973 Cu 1.79851881 3.59313734 1.77594263 0.10179249 -0.27476454 0.24394931 Cu 0.01416514 5.35386341 1.76620594 -0.37405520 -0.11072681 0.04400831 Cu 3.57425514 3.55131488 0.00423624 -0.16603492 0.12696041 -0.42096885 Cu 5.37665714 5.35039842 0.00746126 -0.16240749 -0.18011818 -0.27759139 Cu 5.32702224 3.54935044 1.79969111 0.49157044 0.18467448 -0.11307166 Cu 3.54933747 5.33410526 1.77335009 0.10022687 0.24799479 0.12749451 Cu 7.15889244 3.54945041 0.00347874 -0.06638821 0.03181143 -0.10623886 Cu 8.96690359 5.38164459 0.02532456 -0.25079644 -0.33608503 -0.37543100 Cu 8.91861327 3.59381106 1.78058662 0.15432540 -0.24037570 0.14907910 Cu 7.12561917 5.35141894 1.79548506 0.14811085 -0.22332649 0.09341480 Cu 10.72749160 3.54934071 0.01133304 -0.01589492 0.13567448 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0.02116071 0.04020274 -0.18757676 Cu 19.64527371 12.54133916 0.02005553 -0.42036581 -0.02703648 0.43846109 Cu 19.65466809 10.69484259 1.75592293 0.18883738 0.22681916 0.19946675 Cu 17.84020284 12.47441708 1.82535141 0.14548901 0.27197768 -0.23172239 Cu 0.02301227 14.27435493 0.03239070 0.34713578 0.00008760 0.39650688 Cu 1.77372319 16.07686414 0.01359741 0.14297540 0.15558908 -0.09598554 Cu 1.80727963 14.30886876 1.82208605 -0.10722937 -0.22088083 -0.25843126 Cu 0.01829939 16.11305623 1.77369088 -0.32604722 -0.13770167 0.05727476 Cu 3.58050724 14.31822716 0.01724754 -0.12869299 -0.15238011 -0.26897548 Cu 5.37216871 16.06906014 0.01250850 -0.10092458 0.20165178 -0.32880857 Cu 5.33896535 14.31307933 1.80839742 0.15749068 -0.24372586 0.18767738 Cu 3.58229585 16.11045588 1.79349156 -0.22037507 -0.13328014 0.15452177 Cu 7.11206046 14.33071904 0.00138006 0.24549678 -0.31685090 -0.20647820 Cu 8.95936236 16.07150826 0.00539121 -0.25666777 0.15877216 -0.19090142 Cu 8.92138594 14.31886048 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19.66488145 8.89996979 7.14270604 0.38322077 0.22690909 0.10651838 Cu 19.63768412 7.12500651 8.91026683 0.41696857 0.23758889 0.13460914 Cu 17.90316655 8.94997686 8.90074366 -0.30854742 -0.10092983 0.10902531 Cu 0.02926955 10.74827405 7.13945217 -0.34550733 -0.12907820 -0.00018615 Cu 1.81610132 12.51106638 7.16445313 -0.32937250 -0.15278368 -0.14712362 Cu 1.75484498 10.71986757 8.96561527 0.49599438 0.06449333 -0.33341568 Cu 0.01348072 12.50361713 8.94484285 -0.24135431 0.16608514 0.06685608 Cu 3.60401722 10.72439773 7.12419383 -0.54401399 -0.11232484 0.32723491 Cu 5.32802546 12.47429915 7.13412756 0.43206197 0.31389060 0.11824578 Cu 5.34945607 10.72047786 8.92860427 0.15107928 0.08971116 0.14437931 Cu 3.53993333 12.50965791 8.93253730 0.21123180 -0.16193243 0.14481651 Cu 7.12891361 10.68854604 7.17306723 0.33811671 0.33413906 -0.13191225 Cu 8.93279210 12.52868149 7.16414272 0.15759568 -0.23867695 -0.31726140 Cu 8.94687930 10.71524906 8.93271169 -0.44913656 0.13364282 -0.14899162 Cu 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