500 Lattice="7.654792459536628 0.0 0.0 0.0 7.654792459536628 0.0 0.0 0.0 7.654792459536628" Properties=species:S:1:pos:R:3:forces:R:3 energy=-11536543.116027668 stress="-21576.61355169283 23.298025837832242 -89.71573325109068 23.298025837832242 -21887.923067844113 132.61901448714275 -89.71573325109068 132.61901448714275 -21929.131724964365" free_energy=-11536543.116027668 pbc="F F F" Cu 0.01986286 0.01250024 0.01034342 -193827.37032851 -197075.47037568 -193675.61178244 Cu 0.75534360 0.78578538 0.00786490 -409625.76387807 -355572.85623111 -1008721.44819400 Cu 0.76736734 0.00124018 0.75708388 -360207.31658417 -1004004.91399335 -374529.57935181 Cu 0.01298544 0.79113722 0.77431047 -1039500.98081951 -345654.67854729 -390964.59797787 Cu 1.52662850 0.00359126 0.00418841 11844.94607684 -642802.26755870 -626632.50606433 Cu 2.28113442 0.76454907 0.00492584 -79566.13199296 -418117.40850148 -1815855.45876822 Cu 2.29686951 0.01519183 0.75878342 -104331.43796945 -1825194.26406796 -476170.31779625 Cu 1.52790407 0.75157482 0.76906988 -163220.06734982 -422644.98536300 -348303.12288139 Cu 3.07980222 0.00799156 0.00920004 -16558.37535767 -920654.66022302 -911922.36529082 Cu 3.82173087 0.78803052 0.00016384 45009.17204052 -369246.90052902 -2095186.99617476 Cu 3.82177615 0.00273891 0.76099751 61122.21896048 -2060115.97284175 -464997.16532067 Cu 3.07066795 0.74389223 0.76249185 -212678.22007820 -327034.10749908 -329628.34363901 Cu 4.57852459 0.01129367 0.01460794 9878.08073501 -789439.76923740 -779265.61288936 Cu 5.34551139 0.76513837 0.00149885 99168.71860379 -359863.02628366 -1389641.74476108 Cu 5.35870012 0.00358388 0.74875905 103185.49001796 -1433082.39624159 -447421.74842951 Cu 4.58660214 0.74321602 0.74769448 248573.09943685 -314566.17332034 -297111.30192279 Cu 6.13329720 0.01190727 0.00748021 159957.02487485 -445272.38589765 -436792.75684136 Cu 6.89420318 0.77385268 0.00897142 430202.91566539 -143121.25505754 -427300.91452388 Cu 6.90413048 0.01273015 0.76453311 427880.61909950 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1.52181553 0.77403501 394889.46142731 1108983.46116652 1702248.44728028 Cu 3.04315686 2.30764772 0.77401704 -546544.17790113 116110.78272815 3071886.39644119 Cu 4.59911458 1.54942432 0.00000228 -8743.55741672 319765.64974925 -2238560.78633875 Cu 5.37408497 2.28160733 0.01069204 -181605.77619138 -46310.32257358 -2194423.99446946 Cu 5.38580117 1.51282769 0.76666366 -242138.88057165 480175.11622159 740342.52202172 Cu 4.56485919 2.29675906 0.75963206 -239486.79499663 14376.68512203 2674923.37172198 Cu 6.12085043 1.51455034 0.00634633 347494.31179689 -64616.40235928 -1352942.80604383 Cu 6.88898988 2.27632798 0.01419646 777130.44793532 15365.48252109 -753673.29215966 Cu 6.87908652 1.54255220 0.75911467 1409390.73413677 -51193.97044556 -413033.87704329 Cu 6.10421410 2.30125874 0.77833647 -28020.81448938 -317841.43856237 -83815.24828974 Cu 0.01256988 3.05132918 0.00149050 -919318.17690929 1710.38045887 -929651.52889129 Cu 0.76255185 3.83573899 0.00038856 -491784.31321498 108903.18192109 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