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=-72.48936239579457 stress="-0.0002850105003897144 -7.119931963522274e-05 -0.00014322085937655974 -7.119931963522274e-05 -0.0003081535979798564 -5.981128565067196e-06 -0.00014322085937655974 -5.981128565067196e-06 -0.00027576033682438696" pbc="F F F" Cu 35.39654165 35.77255950 35.15294860 -2.44232032 -1.24318346 -4.71883520 Cu 36.35812759 36.22795740 36.74255735 9.10544906 1.96536341 -1.14775621 Cu 37.22774481 37.49963516 34.64154555 -1.04177165 -0.26240529 0.01071542 Cu 38.20036232 38.43306106 36.40626236 0.39943702 -0.28703340 1.03021512 Cu 36.86577925 34.63331684 37.55570428 1.14897573 -6.06248382 2.93557671 Cu 38.47660143 36.03350693 38.34286276 0.11649191 0.55875945 0.21434674 Cu 35.21285177 37.12535749 37.17842105 -8.62006330 2.70182750 1.39394607 Cu 35.84367107 38.79676508 38.06887988 1.49328723 3.15498772 2.22425247 Cu 40.45889567 34.72786666 35.02208238 0.23169578 -0.98726009 -0.49617273 Cu 40.80983116 36.32806262 36.32105454 0.91260329 1.17005576 0.95808794 Cu 42.78510316 37.42778050 34.86909926 -1.65381076 -1.50561643 -1.01800667 Cu 43.75758157 38.43246311 36.35464511 1.13425812 0.16876862 1.72909023 Cu 42.85256427 34.60056382 36.89977083 -0.94883977 1.31747576 0.01826005 Cu 43.57736200 36.32995544 39.01574532 0.49266099 -0.72427487 -0.81340333 Cu 40.43167485 37.30014156 38.42143299 -3.34842400 -9.41248194 0.65839705 Cu 40.77624372 38.96308230 38.14148716 2.23492127 9.45255864 -2.59514376 Cu 35.19861374 39.96235194 34.56094126 -0.68393615 -0.80387832 -1.45513766 Cu 36.28106554 40.31781721 36.28238171 -1.72648072 0.47255146 -1.38006206 Cu 37.99028470 42.84013519 35.03091681 -4.60650312 -7.33876565 -4.61604231 Cu 38.68145323 43.81152306 35.76128550 4.83333700 6.49517951 5.04929452 Cu 37.72410193 40.37628871 37.63731649 2.12260921 -0.61703937 2.24453133 Cu 38.90607387 41.70590173 38.80456606 3.92315849 -5.98874186 2.50192941 Cu 35.12793321 42.31339034 37.99163138 -4.94040129 -8.51711487 -1.94155988 Cu 35.90999668 43.43522116 38.30556638 5.66533666 7.57377704 2.07429728 Cu 39.93746173 40.68254861 35.09292154 -6.89783767 -2.66947222 -1.84773015 Cu 41.51981643 41.39143806 35.71251737 0.77567138 -3.72815445 6.09998396 Cu 42.19229536 42.51326362 35.11036650 3.69063159 7.03219535 -4.63822676 Cu 43.54958745 43.60613970 36.39868322 0.33943595 -0.21034695 1.28764411 Cu 42.72675371 40.24993016 37.09152891 0.25437945 0.00271307 1.38110941 Cu 44.10482246 41.49263778 38.54743610 -0.51809563 0.62749589 0.00570491 Cu 39.76222898 42.80601395 37.71531894 2.62602338 4.42263078 -8.48702591 Cu 41.16769245 43.53292570 38.99321425 -3.66442531 5.40218234 -2.49170231 Cu 34.91405985 35.63108124 39.78215686 -1.37338521 -0.09629013 -4.52196976 Cu 35.79703522 35.86938827 41.50256714 -2.66764451 -2.75199342 -8.39354828 Cu 37.14956136 37.99685027 40.12455400 -4.62093267 -2.93727179 -4.64894236 Cu 38.35402650 38.74303602 41.34877031 6.24125109 -1.45167917 3.44045170 Cu 37.04590751 35.39525894 42.54506684 4.84832815 -4.45640031 3.47951648 Cu 38.38682156 36.22761206 43.72814922 2.40755263 1.98041933 2.13893722 Cu 35.34116750 37.12489633 42.71249788 -1.91234446 7.03645142 5.98594385 Cu 36.16962489 39.25868713 43.91897550 -0.46474909 -0.61736807 0.78194182 Cu 40.26933011 34.76883187 39.79339190 0.39737504 1.36719557 -0.18440093 Cu 41.67032358 36.45618254 41.38208278 -1.96406384 -3.11990221 7.35214766 Cu 41.92696810 37.34783946 39.92857288 1.78823531 6.09017958 -5.82114531 Cu 43.95777673 38.11338380 41.34270260 -1.12047929 -0.61415313 -0.05709996 Cu 42.30641413 34.69289684 42.36103326 -3.84146189 -4.34295340 -1.93586297 Cu 43.71600062 35.60472024 43.19767137 3.99956818 3.30852981 1.99565127 Cu 39.82715979 37.95683445 42.89101828 -6.75036528 -5.20521475 -3.90667485 Cu 40.87318784 38.66025204 43.45835245 4.59922693 3.28550694 5.32768123 Cu 34.71427543 40.55542516 40.29968003 -0.90269641 -0.54729302 -2.03904289 Cu 36.14810616 41.14377634 41.66177341 -3.46612860 7.75808889 -0.96090829 Cu 37.40019835 42.08038615 39.74235299 -7.32394412 1.51269245 4.81538627 Cu 38.82988335 44.20675865 41.70634352 0.35375964 -1.02233145 0.24404967 Cu 37.04922158 39.96135882 42.10296040 3.09594883 -3.59889376 3.32276726 Cu 39.10239068 41.26240128 43.70234021 -2.85663204 -5.19309089 7.45977087 Cu 35.04105231 42.94141190 42.46394257 -1.11086737 0.15798167 -1.56650968 Cu 36.10047782 43.10699211 44.22212270 1.26251713 -0.29379828 1.08601939 Cu 39.54471943 39.77293335 39.92458714 0.91721913 0.72268957 -0.42795864 Cu 41.52479808 40.94067933 41.65822129 -5.53749540 6.12016213 -6.43173921 Cu 42.40028003 42.61586036 39.93980610 4.69231860 -5.58358007 3.59127603 Cu 43.93950711 43.52203637 41.04300994 0.88890376 0.20818579 0.75795008 Cu 42.39076477 39.72175198 42.66230082 3.77778770 -13.08235901 -0.17894311 Cu 43.04166581 41.16466484 43.28286971 4.23636483 8.79142559 4.22965548 Cu 39.53706234 42.01661553 42.52469746 2.57126335 5.30960757 -8.19458217 Cu 40.96351989 43.64311133 43.74153867 -0.57188399 -0.89481276 -0.91039567