32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=1.200466883222364 stress="-401.1498970854663 -30.968848275435036 -49.08738624243823 -30.968848275435036 -361.3983689784319 -1.469700705746618 -49.08738624243823 -1.469700705746618 -367.1411866878693" pbc="F F F" Ni -0.17538730 -0.01297511 -0.05142115 -0.54558172 -5.87216128 -6.15917525 Ni 1.68843096 1.67061300 0.29169807 -28.04695177 3.13486441 -58.86547704 Fe 1.73462515 -0.05369362 1.71769208 -11.85600459 -21.60813180 4.21191933 Fe 0.14982991 1.30753185 1.32929456 -18.74073197 -9.73206329 10.42358197 Ni 2.94940456 -0.10523254 -0.12006196 1.71471265 -5.11403821 -5.88515869 Fe 4.77604931 1.35563921 0.45054746 3.04776986 2.01073776 -5.46029232 Ni 4.37675974 -0.17769535 1.78460712 14.98175849 -16.46853760 -22.35753355 Ni 2.75346517 1.33939165 1.27715687 51.68450702 6.06587319 36.68686247 Ni -0.08605471 2.83609952 -0.13935934 -9.99449566 -2.54571711 -6.16167730 Ni 1.29546282 4.20940621 0.11893942 8.98613102 8.37246377 -16.51498507 Ni 1.17014143 2.83885520 1.53926819 12.23172970 15.49536598 11.82818136 Fe 0.23010044 4.65213498 1.62528982 -45.68018142 5.57972794 -31.63908375 Fe 3.12033173 3.17828948 0.24685018 -20.87430771 -21.59749329 -2.76823421 Fe 4.29301824 4.23241985 0.07255377 25.67753000 25.32292256 -10.45756570 Fe 4.51129231 3.18239579 1.63338953 6.81631784 -11.36324370 0.43748252 Fe 2.82638390 4.62365747 1.60608282 -12.97769232 4.62714343 -8.37729450 Ni -0.04702487 -0.01967525 3.01512997 -12.77320561 -4.23685142 -8.83506695 Ni 1.78191196 1.53238783 3.24404962 -14.72732919 -1.12388373 -17.13697170 Fe 1.36810690 0.12937675 4.25818085 17.63033748 -32.22774415 16.61547400 Ni 0.09119645 1.29640878 4.71456242 -17.55577518 14.67660345 9.41600301 Fe 3.27913633 -0.14736324 3.18492541 -26.85811412 -13.13218350 7.88801826 Ni 4.33178173 1.38323780 2.76192411 9.64724625 19.45075660 6.64402726 Ni 4.46490969 -0.20259279 4.62263099 13.48072741 -4.55922050 11.48679333 Fe 3.07840790 1.26511517 4.62593290 2.95451969 4.17871142 13.37335922 Ni -0.15999292 2.74373217 2.87882685 -9.69875442 -1.58741842 7.57431937 Fe 1.20122014 4.73212867 2.75294705 35.40608001 6.11509756 41.88855761 Ni 1.26067717 3.17871475 4.69104769 9.01574951 -10.57222597 6.76397137 Fe -0.03149010 4.45283623 4.28281455 -12.61995437 11.89701231 0.29516019 Fe 2.70072959 3.01229390 3.08585187 11.67439105 18.19591597 -5.15542408 Ni 4.29061752 4.74339277 2.71156333 13.20855094 11.66552632 17.30421153 Fe 4.14295455 3.06071874 4.62341440 9.09616080 -5.24418956 0.93735581 Fe 2.97319400 4.44116944 4.70071448 -4.30513967 10.19638088 1.99866147