256 Lattice="14.471024239767821 0.0 0.0 0.0 14.471024239767821 0.0 0.0 0.0 14.471024239767821" Properties=species:S:1:pos:R:3:forces:R:3 energy=-743.7092751684445 stress="-0.005715327875618337 -0.0008671629338958326 0.00014655188684618 -0.0008671629338958326 -0.006145975435532348 0.0002680074816380611 0.00014655188684618 0.0002680074816380611 -0.005733197332358751" free_energy=-743.7092751684445 pbc="F F F" Ni 0.00776590 0.03212886 0.00999078 -0.59614678 -0.53143341 -0.50023719 Ni 1.78943215 1.79356492 0.02095406 0.96478228 1.03673388 -0.92009531 Ni 1.78065312 0.00611958 1.79600255 0.95487443 -0.97626603 0.78860835 Ni 0.03183139 1.83225928 1.79055198 -1.09469954 0.64132879 0.69156347 Ni 3.61599959 0.03334909 0.00596798 0.01479552 -0.56590601 -0.59769926 Ni 5.42286148 1.84159451 0.00795509 0.33464421 0.37997970 -0.83068484 Ni 5.41874014 0.03452234 1.78064553 0.15120918 -0.87849374 0.82924238 Ni 3.63818599 1.79791691 1.83520919 -0.34237483 1.05182442 0.66741128 Ni 7.21416222 0.01475445 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-1.02881555 Ni 9.06432781 3.64156933 12.66019625 -0.24323186 -0.41681512 0.73575504 Ni 7.26267108 5.42052526 12.66964127 -0.44902714 0.19551125 0.51278099 Ni 10.83630916 3.60411365 10.85373154 -0.76231569 0.52266326 -0.98536104 Ni 12.66075845 5.44542962 10.84327888 0.71852669 -0.24943619 -0.27851585 Ni 12.63040960 3.58458171 12.66709834 0.73368061 0.41780276 0.53787304 Ni 10.85194819 5.39651446 12.66360411 -0.45333308 0.36957372 0.58463952 Ni 0.00330514 7.22420749 10.82655917 -0.55015248 0.11962235 -0.26434287 Ni 1.81360862 9.06556016 10.85168147 0.83012722 -0.41293167 -0.79434711 Ni 1.83056009 7.24594589 12.68170273 0.35362305 -0.11463983 0.33693614 Ni 0.00257283 9.02620927 12.66216991 -0.42346947 0.14387423 0.31088384 Ni 3.63751646 7.18152488 10.85327672 -0.25722815 0.30441498 -1.00693582 Ni 5.42867497 9.01167226 10.85999053 -0.53904297 0.44361157 -1.11557395 Ni 5.39374604 7.21571223 12.69387736 0.50329049 -0.11741791 0.42014835 Ni 3.64641684 9.02474063 12.64011508 -0.18691817 0.23761707 0.52246224 Ni 7.20761760 7.26770431 10.85801666 0.23729354 -0.60442229 -0.95317704 Ni 9.08379481 9.01700990 10.85828872 -0.49521039 0.14462748 -0.94530520 Ni 9.03097001 7.22088968 12.63321776 0.20197079 0.15694920 0.59807302 Ni 7.20178516 9.03738153 12.64474368 0.28401966 -0.00077330 0.67554131 Ni 10.87776488 7.20101732 10.83880261 -1.07617338 0.17990158 -0.51502939 Ni 12.64636682 9.01556351 10.85110642 0.60970588 0.35624268 -0.66999802 Ni 12.65430254 7.25558039 12.68685915 0.44614368 -0.22581002 0.47485934 Ni 10.86918475 9.05615560 12.69154945 -0.92706212 -0.27812924 0.54046745 Ni 0.00074105 10.87007532 10.80531325 -0.95546659 -0.91980479 -0.01017005 Ni 1.78516487 12.62796535 10.83280780 0.95155312 1.15867539 -0.48039371 Ni 1.80675275 10.88797373 12.62718313 0.51227237 -0.98810242 1.08019731 Ni 0.01128916 12.68000472 12.66956261 -0.36722667 0.27720610 0.23582802 Ni 3.60770150 10.88191569 10.87238709 0.45103125 -1.19869621 -1.22264851 Ni 5.40189568 12.65729253 10.82877855 -0.02974123 0.70828415 -0.27438230 Ni 5.42947474 10.87519191 12.67832912 -0.14911404 -0.66947409 0.54907711 Ni 3.61126376 12.69382627 12.68905733 0.04878286 0.50099992 0.34213238 Ni 7.20259322 10.84873888 10.85308468 0.43442612 -0.79553549 -0.81384921 Ni 9.07881116 12.64081508 10.86222798 -0.47507827 0.77043552 -0.85230379 Ni 9.03054196 10.86633575 12.63641221 -0.26604168 -0.89061873 0.85230871 Ni 7.22000791 12.68407919 12.66404895 0.05421170 0.48616903 0.28795346 Ni 10.82522334 10.85026957 10.86546332 -0.26340383 -0.86334039 -0.90354407 Ni 12.65444657 12.64525689 10.85957298 0.52135791 0.53218256 -0.29060502 Ni 12.65929117 10.82741172 12.68316927 0.57329085 -0.27487430 0.42223903 Ni 10.84010394 12.66481069 12.69040068 -0.24031996 0.50631134 0.58929297