864 Lattice="21.442540850595144 0.0 0.0 0.0 21.442540850595144 0.0 0.0 0.0 21.442540850595144" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2772.887133546053 stress="-25.590406117741367 1.998010483672104 0.5346168016187107 1.998010483672104 -26.27928681221661 -1.247516811294986 0.5346168016187107 -1.247516811294986 -26.39044716112821" pbc="F F F" Cu -0.00733061 -0.00515458 0.01158768 0.65439478 0.65171476 0.59420315 Cu 1.80077330 1.78350174 -0.02815258 -0.16343961 0.08534464 0.22156603 Cu 1.75416021 -0.00842456 1.79476534 0.23304426 0.17202396 -0.09212254 Cu -0.03368247 1.75672576 1.78998540 0.21778965 0.21315343 -0.08607244 Cu 3.58925145 -0.00499655 -0.02948937 -0.18145578 0.42437451 0.56524000 Cu 5.34755321 1.76488589 0.03417479 0.13805123 0.11775786 -0.37957420 Cu 5.37902428 0.02169709 1.76538108 -0.22118165 -0.31638403 0.18978357 Cu 3.56645852 1.81476278 1.76826978 -0.33317432 -0.36158128 0.20857948 Cu 7.17883945 -0.01784560 0.01553221 -0.02635795 0.47924580 0.30924385 Cu 8.96299954 1.80163714 -0.00966582 -0.15011490 -0.10333749 -0.05655106 Cu 8.91715926 -0.01025779 1.79771459 0.13320257 -0.15096584 -0.04765077 Cu 7.14606919 1.76014442 1.81673770 0.13623853 0.20088269 -0.28724810 Cu 10.73245571 0.00823745 -0.01459975 -0.16297987 0.27470226 0.33386776 Cu 12.50332691 1.76852222 0.02429927 0.04367367 0.12437121 -0.26472074 Cu 12.47506352 -0.00874087 1.75650936 0.15437636 -0.11668565 0.25169822 Cu 10.68815813 1.78035206 1.75560320 0.18617611 0.13562658 0.42034576 Cu 14.31638329 -0.02059575 0.03345690 -0.08350859 0.36165092 0.25831718 Cu 16.06546361 1.79272528 -0.00823182 0.19536037 0.08285240 0.10002162 Cu 16.07177406 -0.02118326 1.77872697 0.20251797 0.06317113 0.12249000 Cu 14.27062439 1.78294281 1.77217450 0.24555088 0.14283960 0.12406530 Cu 17.86891369 -0.00178865 -0.00855358 -0.07984726 0.60437865 0.57650967 Cu 19.65589711 1.80337760 -0.00665537 -0.54447809 0.00037255 0.57132125 Cu 19.67003577 0.00355848 1.77588822 -0.56056562 0.53394478 0.08297949 Cu 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