32 Lattice="7.256884002685551 0.0 0.0 0.0 7.256884002685551 0.0 0.0 0.0 7.256884002685551" Properties=species:S:1:pos:R:3:forces:R:3 energy=-96.33217082398026 stress="2.8699728808373877 3.8360005123525216 -9.531715594362765 3.8360005123525216 1.0979008503098129 -2.4591489310151715 -9.531715594362765 -2.4591489310151715 -0.32145389737694785" pbc="F F F" Fe -0.12049575 0.09262900 0.09204096 1.02520550 0.39030337 0.75367101 Fe 1.98888908 1.68515958 -0.13472070 -0.89723153 0.42036076 1.03333762 Fe 1.65945876 -0.13741853 1.70064655 0.07227991 1.17469115 0.35623677 Fe -0.18489349 1.79967368 1.59270429 1.24879336 0.20434197 0.42916915 Fe 3.52577038 -0.03420984 0.16882826 0.34333425 0.35536763 -0.07993204 Fe 5.49686408 1.36776816 -0.11208157 -1.57627132 0.64600118 1.44529852 Fe 5.01750543 0.18564236 1.96909081 2.46506354 -4.51236500 -5.70762593 Fe 3.78146542 1.97740367 1.93659608 -3.44287718 0.20474898 -2.09305124 Fe 0.22466171 3.77532728 -0.12164601 -0.19286586 -1.26592297 0.00405513 Fe 1.98919051 5.24681385 0.12750193 -1.17923956 1.90609411 -1.95589168 Fe 1.84629030 3.59323082 1.64707387 -1.16434741 -1.85488104 1.49967243 Fe -0.03508886 5.34954368 1.50737319 0.96858876 -0.43581431 0.84700429 Fe 3.78826382 3.77757132 0.24284059 -0.47436241 -2.15966579 -4.13201062 Fe 5.53812433 5.46977618 0.12420575 -1.01854605 -0.66658045 0.94609732 Fe 5.26008988 3.76548224 1.78592098 3.79938935 -0.18349450 1.77771406 Fe 3.46675888 5.29397632 1.82556765 1.52709061 2.69093247 1.76445086 Fe -0.12334412 -0.02027049 3.46990503 1.18773563 1.20597646 -0.01892147 Fe 1.74704494 1.62961148 3.62387057 -0.39647298 0.23983837 0.36864302 Fe 1.61529337 -0.13216084 5.28989748 -0.27757706 1.41337739 -0.89698680 Fe -0.06678005 1.76811058 5.51827889 1.69417636 -0.22515345 -1.69001127 Fe 3.85527502 -0.05515562 3.73788300 -3.09958393 -0.68730392 3.34009430 Fe 5.41200990 1.58582527 3.44931478 2.38365520 3.69168849 4.90585051 Fe 5.59571064 0.16907269 5.51219076 -1.38392849 0.97933779 -1.13899067 Fe 3.45832036 1.68834284 5.62678376 0.29156612 -0.20792294 -1.56379532 Fe 0.19137577 3.78002806 3.47997115 -0.14984905 -0.54693178 0.26116248 Fe 1.99104811 5.38004112 3.73669755 -1.96666052 0.97860465 -1.49904419 Fe 1.63272475 3.86409365 5.50275627 1.49110449 -4.02889302 0.21106865 Fe 0.11135716 5.29852085 5.50128325 -1.33420434 1.46407627 -0.74267713 Fe 3.65599044 3.67405449 3.55811757 -2.89698437 -0.99126395 -1.18578327 Fe 5.55650979 5.36332995 3.61085554 -0.69036891 0.85943548 -1.16140681 Fe 5.17318276 3.72045764 5.01466297 2.69733600 -2.14300820 2.88491067 Fe 3.49122071 5.22792331 5.39358385 0.94605191 1.08402481 1.03769163