32 Lattice="7.080895788574708 0.0 0.0 0.0 7.080895788574708 0.0 0.0 0.0 7.080895788574708" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.94941042186049 stress="-0.006092918172708438 0.0020844017517162167 0.0016863834429716952 0.0020844017517162167 -0.008380595717490646 0.0004410701089201323 0.0016863834429716952 0.0004410701089201323 -0.006582353415399435" pbc="F F F" Fe 0.00701878 0.01522602 0.02207554 0.29695624 0.21369179 0.22251459 Fe 1.80036380 1.76595046 0.00361417 -0.21532438 -0.12162197 -0.25621247 Fe 1.77477191 0.03256262 1.80190101 0.02890122 -0.61107084 -0.38152713 Fe 0.01224022 1.73871483 1.77654621 -0.41443968 0.25450863 -0.17408587 Fe 3.52240207 0.00077021 0.00169889 0.16586641 0.08903081 0.20023600 Fe 5.29594700 1.79868162 0.03291943 -0.01879996 -0.26753644 -0.16418990 Fe 5.34528804 0.01820987 1.79291739 -0.19650543 0.06704175 -0.06349716 Fe 3.55668625 1.77168482 1.80414170 -0.09407666 -0.11993780 -0.15799734 Fe 0.02954442 3.51046937 0.02876874 -0.03405228 -0.03099085 -0.06590188 Fe 1.80012339 5.27878856 0.00634524 -0.09370495 0.18145675 -0.21058881 Fe 1.78497650 3.57102633 1.76152182 -0.05222440 -0.55000443 0.13835668 Fe 0.04102602 5.28297832 1.76989907 -0.15576313 0.21516742 -0.08216814 Fe 3.50612313 3.51139073 0.00542270 0.30213960 0.16024987 -0.51563945 Fe 5.28122564 5.33275825 0.02293974 -0.27965425 -0.31562805 0.14187103 Fe 5.28892872 3.52380225 1.73530129 0.53034934 0.25041479 0.28869330 Fe 3.53878101 5.28552062 1.74974547 0.15606070 0.60085581 0.19009447 Fe 0.01224098 0.00165707 3.51163010 -0.15280630 -0.12777968 0.18579961 Fe 1.74985199 1.75046851 3.53638183 0.21878370 0.43946342 0.14300572 Fe 1.76631041 0.01528880 5.29113900 0.09612298 -0.10574639 0.08802734 Fe 0.03615190 1.73978524 5.33789030 -0.12602778 0.14961409 -0.11811488 Fe 3.51600477 0.02167837 3.54743660 0.37510518 -0.51927192 0.11378832 Fe 5.32207845 1.74822668 3.58342040 0.40046984 0.08820666 -0.20092578 Fe 5.30576602 0.02274582 5.34544060 -0.22615691 0.11705366 -0.23975343 Fe 3.57405019 1.76952071 5.31218857 -0.20766846 0.10147077 0.31647080 Fe 0.03086736 3.53917711 3.51390803 -0.47654589 -0.07880499 0.32635774 Fe 1.75680751 5.29865225 3.55252218 0.13089689 0.47358937 0.17995071 Fe 1.77950335 3.52101126 5.31375884 -0.01853815 0.08336327 0.26077731 Fe 0.00826907 5.29771727 5.33447375 0.30445054 -0.33153191 -0.30552691 Fe 3.54552686 3.55543528 3.50747170 0.06659343 -0.05397605 0.48502135 Fe 5.33233556 5.31660992 3.57566595 -0.20179454 -0.09735872 -0.18565689 Fe 5.34028822 3.54069074 5.28848949 -0.15643189 0.05346839 0.02934832 Fe 3.52877463 5.31929340 5.33953421 0.04781897 -0.20738717 -0.18852726