864 Lattice="21.442349332888483 0.0 0.0 0.0 21.442349332888483 0.0 0.0 0.0 21.442349332888483" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2773.1400382863258 stress="-0.004717283017710537 -0.00017807725447298956 6.023597763284007e-05 -0.00017807725447298956 -0.004922716150140214 -3.916199191173328e-05 6.023597763284007e-05 -3.916199191173328e-05 -0.004881501620983585" pbc="F F F" Cu 0.01151342 0.00687472 0.02639146 0.55851436 0.57196027 0.59810236 Cu 1.78113558 1.75419932 0.02852869 0.02098086 0.13964108 -0.25593495 Cu 1.77502964 0.01025399 1.81823489 0.06819425 -0.15947659 -0.09589867 Cu 0.02832275 1.81505030 1.78433399 -0.25125500 -0.06468541 0.18422356 Cu 3.55939813 0.02021852 0.00710482 -0.02003364 0.28952474 0.41521272 Cu 5.36579546 1.77099662 0.03563097 -0.13679904 0.18328636 -0.38197767 Cu 5.37185381 0.02281582 1.77610200 -0.03653740 -0.35682303 0.13984777 Cu 3.57212809 1.79937008 1.79278323 -0.12872380 -0.21073468 0.07039502 Cu 7.14845909 0.02624291 0.03183455 0.09967511 0.24110217 0.30472418 Cu 8.94267369 1.76176840 0.00722873 -0.11490349 0.17962199 -0.19041680 Cu 8.95937231 0.02137569 1.81420546 -0.36386095 -0.23295316 -0.13522028 Cu 7.12454723 1.83903060 1.77638978 0.21954027 -0.41645411 0.26140447 Cu 10.69151788 0.01950666 0.01325818 0.22731737 0.26279599 0.36660040 Cu 12.50835325 1.78377813 0.02261516 -0.06743418 0.12401748 -0.12718553 Cu 12.53888906 0.01266553 1.82080984 -0.25330386 -0.24359647 -0.15169191 Cu 10.71414212 1.76430155 1.81392821 0.23112433 0.34521251 -0.19332803 Cu 14.25277621 0.02433467 0.00614202 0.17786179 0.31126473 0.31853278 Cu 16.10853022 1.78589567 0.01911112 -0.26982073 0.01897872 -0.26305727 Cu 16.10189600 0.02642956 1.75189924 -0.16798617 -0.32987289 0.20376222 Cu 14.28482713 1.75967639 1.81691020 0.18704642 0.46874311 -0.24825443 Cu 17.87409232 0.01723124 0.01535973 0.09234264 0.42356034 0.34641947 Cu 19.68960485 1.79750891 0.01362934 -0.63581237 0.08827322 0.55154009 Cu 19.67052250 0.01810438 1.77581227 -0.48375772 0.47316025 0.10188192 Cu 17.85413232 1.75187026 1.80406216 0.21207065 0.42585065 -0.04257000 Cu 0.00118278 3.55428538 0.01463309 0.48079417 0.08232942 0.36414637 Cu 1.78899461 5.38535209 0.01667135 -0.12438731 -0.35903741 -0.35450063 Cu 1.81853954 3.54883232 1.79721975 -0.21917528 0.20394916 0.15751152 Cu 0.02525030 5.33330202 1.82001916 -0.16693991 0.04979422 -0.11866159 Cu 3.55202643 3.55630933 0.03394698 0.01636272 -0.02089859 -0.47313603 Cu 5.36550967 5.32521659 0.01160410 -0.08408634 0.28673220 -0.21530423 Cu 5.32125242 3.58781069 1.80540827 0.12295897 -0.04708714 0.07225308 Cu 3.54759436 5.37908864 1.75597011 0.25774620 -0.10832900 0.59399835 Cu 7.12257075 3.58362502 0.02332609 0.17521524 -0.10088871 -0.38136978 Cu 8.96992377 5.35216060 0.01135723 -0.25299428 0.10450704 -0.24727161 Cu 8.91270946 3.53691655 1.77651583 0.25695901 0.22106629 0.12554645 Cu 7.13508752 5.36176109 1.78161587 0.21893087 0.08021961 0.10222547 Cu 10.70243010 3.57211371 0.02065018 0.12862666 -0.12971298 -0.20627329 Cu 12.49529556 5.39216903 0.00470648 0.04222367 -0.04442045 -0.08461532 Cu 12.48428682 3.59201390 1.77322189 0.13321509 -0.10168518 0.30079619 Cu 10.68718228 5.39016926 1.79312218 0.20878151 -0.08971781 0.16221027 Cu 14.31510160 3.60772262 0.02020860 -0.24169262 -0.34382605 -0.21209095 Cu 16.05967426 5.36244757 0.02055076 0.28976994 0.15638471 -0.30338915 Cu 16.08197489 3.59320621 1.76412733 0.05310646 -0.35464819 0.40291405 Cu 14.30876795 5.34606074 1.81948843 -0.21450499 0.16878045 -0.02537082 Cu 17.84563446 3.55204916 0.03564249 0.31737795 0.09879009 -0.18119144 Cu 19.65540120 5.37114027 0.02944661 -0.37689206 -0.18796672 0.36850163 Cu 19.65751097 3.56153511 1.80887633 0.08464703 -0.00687387 -0.22930784 Cu 17.85646543 5.37088467 1.81442329 -0.04019733 0.00768985 -0.19513275 Cu 0.00701680 7.10479134 0.02384625 0.25662588 0.09324006 0.33262982 Cu 1.76657819 8.93585480 0.00849061 0.11626607 -0.01018960 -0.22235914 Cu 1.81397972 7.12692250 1.75249442 -0.21346758 0.23363963 0.44306793 Cu 0.02960872 8.94222546 1.76265410 -0.21482982 -0.07249453 0.08793608 Cu 3.58636218 7.13162545 0.01466290 0.07393316 0.22173633 -0.32630509 Cu 5.38449081 8.90401714 0.03357877 -0.17870000 0.19476769 -0.43505553 Cu 5.38310311 7.18015092 1.81145206 -0.40999876 -0.44169659 -0.18894892 Cu 3.53677861 8.95417203 1.79594146 0.05636028 -0.24911735 -0.12736456 Cu 7.14740665 7.17251412 0.02815066 0.04023066 -0.29785554 -0.45358278 Cu 8.92095441 8.97640193 0.00477599 -0.03931580 -0.20208808 -0.20277101 Cu 8.89973066 7.16393102 1.76480926 0.24021170 -0.15440121 0.25790108 Cu 7.13113899 8.91298659 1.80992055 0.23926413 0.33342947 -0.11145504 Cu 10.73268727 7.19805162 0.01644910 -0.18901227 -0.18469850 -0.21492541 Cu 12.49155207 8.92226960 0.01449775 0.21589919 0.21822200 -0.29736330 Cu 12.53595226 7.17988649 1.78847962 -0.22822548 -0.24201365 0.18413402 Cu 10.72314138 8.95429275 1.79740762 -0.10608260 -0.23138922 0.24036499 Cu 14.31691734 7.16253589 0.01093567 -0.24394723 -0.11183628 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0.14336431 0.35908604 Cu 3.59787192 12.48183928 1.76379211 -0.34586477 0.32691520 0.27172718 Cu 7.16469073 10.75668955 0.03286606 -0.26165349 -0.49727478 -0.53805058 Cu 8.90276734 12.48673695 0.01166479 0.46206148 0.27749251 -0.50417108 Cu 8.92504017 10.75189590 1.77024781 0.22861583 -0.41824276 0.42981303 Cu 7.17867123 12.47354941 1.75410653 -0.35858181 0.38037842 0.51854017 Cu 10.69432747 10.70410242 0.02732593 0.18182860 0.19909269 -0.39490687 Cu 12.51941533 12.49270396 0.02598253 -0.19242105 0.13973509 -0.42618953 Cu 12.47785133 10.73481053 1.78250491 0.19669809 -0.21602714 0.10816320 Cu 10.72854356 12.51753261 1.80500608 -0.11655885 0.08933769 -0.17391389 Cu 14.30442440 10.71857082 0.03008217 -0.10248394 -0.18335736 -0.41636288 Cu 16.05499405 12.51121631 0.02406746 0.41875891 0.03713759 -0.24564922 Cu 16.05862939 10.74783635 1.79465663 0.34620516 -0.26905630 -0.15001155 Cu 14.26936747 12.48666103 1.76411898 0.05694591 0.17348755 0.38643224 Cu 17.89098171 10.72378365 0.00432391 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1.75375124 0.06623381 -0.18736901 0.38438541 Cu 7.13299293 16.05058876 1.77805231 0.20865476 0.20587011 0.16736279 Cu 10.71642493 14.32620398 0.01379903 0.23777744 -0.43786726 -0.38618894 Cu 12.53496764 16.10136910 0.02419220 -0.18492871 -0.16194911 -0.32656113 Cu 12.53860893 14.28931302 1.78531981 -0.09733811 0.12634813 0.24121872 Cu 10.69514499 16.04773610 1.75246377 0.47638011 0.35103444 0.47840058 Cu 14.32880305 14.29624279 0.00099890 -0.17026791 0.03626429 -0.25042128 Cu 16.06769800 16.11400551 0.00968038 0.30698426 -0.22964204 -0.25099114 Cu 16.05439794 14.28483823 1.82091519 0.40348921 0.20435600 -0.32423226 Cu 14.30269254 16.10977814 1.75174068 0.00720158 -0.30780194 0.56654930 Cu 17.90137549 14.30574602 0.00539219 -0.25264863 -0.15239687 0.03483602 Cu 19.63557229 16.11510985 0.03205793 -0.11080096 -0.11270845 0.07955188 Cu 19.67520118 14.31085116 1.79095240 0.04742139 -0.13914611 0.09497702 Cu 17.89385576 16.09287631 1.76577386 -0.35322786 -0.30475036 0.39118591 Cu 0.02466472 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12.53223100 17.88577885 1.80064508 -0.24065305 -0.25989508 -0.12554736 Cu 10.72076422 19.62451280 1.79838042 -0.07882122 0.15029882 -0.05777019 Cu 14.28309560 17.83370250 0.00093819 0.19791369 0.50155312 -0.16578130 Cu 16.04609544 19.68579849 0.02925927 0.10916163 -0.62935534 0.51871920 Cu 16.11509009 17.83318410 1.81943456 -0.24599912 0.35771616 -0.31741025 Cu 14.27458410 19.66299566 1.81177626 0.36231462 0.05775865 -0.19244237 Cu 17.87254830 17.85838369 0.02741396 -0.15263507 0.35106035 -0.23796200 Cu 19.64728506 19.67488555 0.01992730 -0.66989051 -0.67814368 0.67691640 Cu 19.65235812 17.84649664 1.76955656 0.17955383 0.30467280 0.25344572 Cu 17.85972189 19.65356350 1.82032962 0.10802204 0.13640790 -0.27507158 Cu 0.02022236 0.03556796 3.59085463 0.14721584 0.22433314 -0.16901015 Cu 1.78786422 1.78607192 3.59762160 0.18149284 0.11709629 -0.23909053 Cu 1.77134269 0.01188555 5.33814727 0.24340681 -0.21638536 0.16225979 Cu 0.01402639 1.79458101 5.34885999 -0.35664143 -0.06514629 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