64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-82.74829667373588 stress="-0.00014350149799622882 7.151586512148549e-05 -0.00022049777335608916 7.151586512148549e-05 -0.0004121374421565817 0.0002541502793145985 -0.00022049777335608916 0.0002541502793145985 -0.0011441025158663006" pbc="F F F" Cu 35.06370892 35.04500902 35.01919699 0.54177679 0.36816185 0.14152853 Cu 37.04790086 35.83605788 35.61377069 -29.47915220 -52.05966941 48.93745437 Cu 37.55259552 36.72813370 34.78600541 29.21792919 51.98276568 -48.44194470 Cu 38.58011841 38.45391593 36.18525893 -0.29144807 -0.14347600 -0.93253353 Cu 36.79790524 35.05846903 38.08185862 1.31457627 0.27730393 -0.91786340 Cu 39.03588274 35.45859239 38.87957522 -66.55948436 39.34708311 -262.13508806 Cu 34.91597288 37.84327934 37.74925930 0.85104257 0.03966977 0.41865667 Cu 36.55604684 39.07636534 38.99475015 -24.17447869 58.45123506 -33.62229281 Cu 40.88499006 35.03620971 34.91076815 0.24891411 0.50027620 0.12276910 Cu 41.79729920 35.80778337 36.77532619 -1.03428664 1.42833322 -2.11637279 Cu 42.40513757 37.66058214 35.11733759 -2.64198923 -2.01894936 -0.96440822 Cu 43.51505611 38.45844813 35.77826181 2.05750280 1.48042910 1.32552627 Cu 42.41987058 35.36500318 38.21105730 -0.19303541 -1.56376799 1.77109842 Cu 43.88510867 36.35219691 39.13819686 2.60549194 -0.26356825 0.16625649 Cu 39.89773111 37.84077848 37.90033123 -0.60805134 -1.26085634 0.19728235 Cu 41.26837714 38.91726306 38.71506015 1.02655191 1.04287204 0.26848814 Cu 34.80084162 39.62743926 35.11872414 0.38678846 -0.06672116 0.77420024 Cu 36.15805272 40.73658530 36.67376922 0.34241010 0.10217370 0.02990259 Cu 37.61363197 42.55593552 34.77520588 -0.29011861 -0.65879417 0.26809474 Cu 38.61643991 43.32327578 36.40123177 -16.54109556 10.06687923 -10.90995113 Cu 38.31027764 39.78087390 37.80440478 -0.37361797 -1.42705921 -0.39792488 Cu 38.87510485 41.23418069 38.46428709 1.38732805 1.38713505 0.84139792 Cu 35.25603358 43.19718185 37.40996722 0.53875953 -0.62713848 -0.10450646 Cu 35.94119039 43.57310438 39.51556685 0.18804821 0.85695130 -0.43441532 Cu 40.38624477 40.74886162 35.02484260 -1.37812509 0.06521681 -1.13830106 Cu 41.21537689 41.21128805 36.45749618 1.48695498 0.31004537 2.14699438 Cu 41.78955913 43.34759965 35.42075215 -0.16561268 -0.74609990 0.77626709 Cu 43.96107175 43.10585605 36.52182787 -1.16464676 -0.50596719 0.28740972 Cu 42.91875667 39.86213989 37.61866461 0.14642161 -0.20473442 -0.49859560 Cu 43.95988970 40.97790229 39.02834847 -0.05776110 0.42969801 0.69586240 Cu 39.66448343 42.68403127 37.11226018 17.36047166 -9.49203657 10.70045730 Cu 41.17426133 43.78926313 39.16846967 -3.74861527 3.17966262 -0.67615832 Cu 35.38501276 35.28866353 39.13808314 -1.56401896 0.72494896 0.49044605 Cu 36.45728100 36.28136614 40.74253845 0.25129532 0.08481733 0.10207253 Cu 37.00297454 37.99791377 39.62151619 24.23439394 -57.53092090 33.10470717 Cu 38.63354400 38.98155677 41.53109462 0.00549664 -2.16125101 0.54419701 Cu 36.87432696 35.43353967 42.64808674 -0.16931878 0.13129050 0.28734476 Cu 38.88675380 35.67312151 43.42903809 -0.45262180 -0.50409027 -0.15418463 Cu 34.93971441 38.30799785 42.39689011 0.02308130 -0.54035895 -0.75142415 Cu 36.66718888 38.72644850 43.40138151 0.69845676 -0.43678819 0.22562065 Cu 39.32594504 35.28940135 40.01988805 66.38589939 -38.51505680 262.35868046 Cu 41.14587698 36.31829147 41.67865158 -1.00312125 0.77228921 -2.08854882 Cu 42.50274218 37.18164099 39.64737597 -2.23063526 1.09439888 1.11719545 Cu 43.95066619 38.87146700 40.57697763 -0.71828955 0.22372726 -0.57213594 Cu 42.48850221 35.33418514 41.69111865 2.25385572 -0.80652804 0.27370679 Cu 43.44291475 35.89158883 44.05716205 -0.92559530 0.04635990 -1.16072227 Cu 40.39566135 36.85685179 43.05585270 -0.08931482 1.01690579 1.76483254 Cu 41.24050602 38.88933161 43.35637329 -0.75974937 0.18619913 0.09996684 Cu 34.78315429 39.50959042 40.43036294 0.48951292 -0.07242324 -0.00152327 Cu 35.80726161 41.99601827 40.77972059 -0.79468230 -1.22589566 0.74562638 Cu 37.58264280 41.90871137 40.02016825 0.39814041 -2.52240651 -1.02210338 Cu 38.23940195 43.25828986 40.90834746 0.73186404 1.13079799 1.34862341 Cu 37.81545551 40.27619585 42.44604683 -1.04709756 2.52901321 -0.46153298 Cu 39.09775119 40.72218372 44.06082348 0.89306255 -0.15923059 -0.59521135 Cu 34.82317285 42.59462510 42.42857401 0.15133203 0.47812012 0.68770660 Cu 36.50547386 43.46642497 43.72889286 -0.12456885 -0.49046921 -0.72464929 Cu 39.84423945 39.60672203 40.23977120 -0.30592272 -0.28812950 -1.46549634 Cu 40.61083299 41.22892384 41.12165250 -0.47953028 -34.70742102 -41.66029292 Cu 42.19474472 42.71630150 39.33489678 3.98830554 -4.04190277 0.98702505 Cu 43.91349408 43.67361795 41.44587432 -1.16643017 -0.86254277 -0.52790434 Cu 42.18098279 40.39437182 42.35439740 1.29724554 0.05718362 -0.53326316 Cu 43.64757145 41.08586328 43.75864263 -0.28400613 0.16081294 -0.28717231 Cu 40.60615151 42.11536967 42.13716159 -0.94961999 35.92603020 41.18646452 Cu 40.94353050 43.71498423 43.36781104 0.26313181 0.02546679 0.10265853