32 Lattice="7.080893919810842 0.0 0.0 0.0 7.080893919810842 0.0 0.0 0.0 7.080893919810842" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.94940844417148 stress="-0.006093325774243651 0.0020844177838644225 0.0016863758249097492 0.0020844177838644225 -0.008381051037417847 0.00044109619699401375 0.0016863758249097492 0.00044109619699401375 -0.006582817716298268" pbc="F F F" Fe 0.00701877 0.01522602 0.02207553 0.29695430 0.21369050 0.22251406 Fe 1.80036333 1.76595000 0.00361416 -0.21532530 -0.12161928 -0.25621696 Fe 1.77477144 0.03256261 1.80190054 0.02890031 -0.61107671 -0.38152570 Fe 0.01224022 1.73871437 1.77654574 -0.41444279 0.25450739 -0.17408787 Fe 3.52240114 0.00077021 0.00169889 0.16586825 0.08902639 0.20023232 Fe 5.29594560 1.79868115 0.03291942 -0.01879593 -0.26753572 -0.16419370 Fe 5.34528663 0.01820986 1.79291692 -0.19650211 0.06703762 -0.06349722 Fe 3.55668531 1.77168435 1.80414123 -0.09407873 -0.11993586 -0.15799745 Fe 0.02954442 3.51046844 0.02876873 -0.03405655 -0.03099251 -0.06590767 Fe 1.80012292 5.27878716 0.00634524 -0.09370392 0.18146163 -0.21059576 Fe 1.78497602 3.57102539 1.76152136 -0.05222281 -0.55000989 0.13835923 Fe 0.04102601 5.28297693 1.76989861 -0.15576887 0.21517347 -0.08217012 Fe 3.50612221 3.51138980 0.00542270 0.30213526 0.16025102 -0.51564416 Fe 5.28122425 5.33275684 0.02293973 -0.27965210 -0.31562563 0.14186868 Fe 5.28892732 3.52380132 1.73530083 0.53035571 0.25041323 0.28869522 Fe 3.53878008 5.28551922 1.74974501 0.15606215 0.60086186 0.19009596 Fe 0.01224097 0.00165707 3.51162917 -0.15280768 -0.12778318 0.18579996 Fe 1.74985152 1.75046804 3.53638090 0.21878602 0.43946595 0.14300600 Fe 1.76630995 0.01528879 5.29113760 0.09612302 -0.10575056 0.08802855 Fe 0.03615189 1.73978478 5.33788889 -0.12603428 0.14961464 -0.11810955 Fe 3.51600384 0.02167837 3.54743566 0.37510451 -0.51927840 0.11378898 Fe 5.32207705 1.74822621 3.58341945 0.40047422 0.08820865 -0.20092821 Fe 5.30576462 0.02274582 5.34543919 -0.22615441 0.11705007 -0.23975099 Fe 3.57404925 1.76952025 5.31218717 -0.20767013 0.10147354 0.31647637 Fe 0.03086736 3.53917618 3.51390710 -0.47655063 -0.07880726 0.32635652 Fe 1.75680704 5.29865086 3.55252124 0.13089666 0.47359876 0.17995373 Fe 1.77950288 3.52101033 5.31375744 -0.01853601 0.08336340 0.26078299 Fe 0.00826907 5.29771587 5.33447235 0.30444933 -0.33153018 -0.30552462 Fe 3.54552592 3.55543434 3.50747077 0.06659506 -0.05398017 0.48502153 Fe 5.33233416 5.31660852 3.57566501 -0.20179216 -0.09735583 -0.18565998 Fe 5.34028681 3.54068980 5.28848809 -0.15642823 0.05346741 0.02935299 Fe 3.52877370 5.31929200 5.33953280 0.04781785 -0.20738432 -0.18852312