32 Lattice="6.8855119468037245 0.0 0.0 0.0 6.8855119468037245 0.0 0.0 0.0 6.8855119468037245" Properties=species:S:1:pos:R:3:forces:R:3 energy=-104.06400742498636 stress="-0.011208865367287806 -0.0025289678159470374 0.0034698822422457873 -0.0025289678159470374 -0.014426119458246862 0.0013738491463345637 0.0034698822422457873 0.0013738491463345637 -0.014728921739469724" free_energy=-104.06400742498636 pbc="F F F" Fe 0.02088994 0.03167310 0.01720600 0.49246970 0.24175917 0.46149396 Fe 1.68699790 1.69589868 0.01045770 0.08920113 0.29689260 -1.20023936 Fe 1.72361871 0.00459152 1.71717796 -0.18937242 -1.15226847 0.13654639 Fe 0.02685127 1.69930950 1.69928611 -1.26014488 0.21183674 0.10799521 Fe 3.41363899 0.00183223 0.04732218 0.17898645 0.02696487 -0.15081647 Fe 5.16318203 1.69421801 0.00280550 -0.22933790 0.10006019 0.24706126 Fe 5.16180807 0.00743254 1.70330188 -0.19807233 0.25592809 0.09636769 Fe 3.41794184 1.73465027 1.72928674 0.27677774 -0.50212341 -0.10096545 Fe 0.00016481 3.50262584 0.01901228 0.04778172 -0.37343905 0.04483089 Fe 1.70403021 5.15815305 0.03793776 0.14546923 0.15159278 -0.14910244 Fe 1.72799390 3.44758487 1.73075525 -0.38806272 0.10930077 -0.20836522 Fe 0.00234492 5.15638442 1.71541141 0.05358724 0.15796282 0.17804816 Fe 3.44046973 3.43731851 0.02952494 0.28411432 0.20562167 -1.12011199 Fe 5.15824090 5.14393261 0.02283819 -0.75499655 -0.80467403 0.83827282 Fe 5.13769725 3.40931148 1.75275151 1.07524371 0.68935840 -0.58794285 Fe 3.42987214 5.17261543 1.72048413 0.60055121 0.91389514 -0.17585716 Fe 0.02895930 0.00921329 3.45076892 0.03908224 -0.11656274 0.08036050 Fe 1.67610912 1.72791137 3.45613692 0.27556599 -0.37146310 -0.12039723 Fe 1.76579806 0.00965079 5.18858696 -0.20217608 0.18658350 -0.15509587 Fe 0.01997231 1.73111817 5.14188168 -0.16326749 -0.14572274 0.19141317 Fe 3.45469224 0.03435757 3.46235005 0.37485473 -0.95818562 0.09400065 Fe 5.19003048 1.75372393 3.42346404 0.89407832 -0.81325320 0.56282609 Fe 5.18873884 0.00636407 5.19052357 -1.05160057 0.98890780 -0.95540862 Fe 3.42740736 1.74326226 5.13184935 0.73839094 -0.44783406 1.13355848 Fe 0.01744602 3.47633893 3.44447276 -1.04806030 0.23968000 0.21345014 Fe 1.75143291 5.17529516 3.45461564 -0.44227854 0.93535912 0.44920394 Fe 1.72020260 3.41004514 5.16502405 -0.18613225 0.88091790 1.06408544 Fe 0.02200300 5.15070933 5.19653500 0.85215676 -0.84429347 -0.79663571 Fe 3.42391721 3.43584093 3.44149859 0.23153533 0.48807065 0.27564311 Fe 5.18484755 5.15207606 3.45783977 -0.34899039 -0.02885419 -0.25736704 Fe 5.17103509 3.47764137 5.10535840 -0.05143666 -0.12256406 0.15578208 Fe 3.47137096 5.18620379 5.18892956 -0.13591769 -0.39945409 -0.35263459