32 Lattice="51.27563285827637 0.0 0.0 0.0 51.27563285827637 0.0 0.0 0.0 51.27563285827637" Properties=species:S:1:pos:R:3:forces:R:3 energy=-400.43607406190563 stress="1.3542145876904628e-05 1.7129684905921384e-05 -5.628256313190509e-05 1.7129684905921384e-05 1.1870265835170201e-05 -2.038781145643943e-05 -5.628256313190509e-05 -2.038781145643943e-05 1.1940383723279498e-06" pbc="F F F" Fe 25.51732067 25.73044543 25.72985739 0.72849905 -0.52121084 -0.51891786 Fe 27.64375711 27.31195112 25.50309573 -0.78273811 0.41879359 1.16362127 Fe 27.32074549 25.50039790 27.60775863 0.53017648 0.14916926 -0.63882705 Fe 25.45292294 27.25416015 27.29583810 1.02383750 1.40933116 1.04620106 Fe 29.19769001 25.52513612 25.80664468 0.16815242 0.53611757 0.25941512 Fe 31.18583531 27.22630523 25.52573486 -1.11937899 0.27474904 1.02251550 Fe 30.75132036 25.82345879 27.62395884 1.50186774 -2.35627815 -3.69830502 Fe 29.45338505 27.63227170 27.59146411 -2.96879067 -1.73293195 -1.33236511 Fe 25.61396541 29.44724691 25.76512730 0.36617649 -1.98275746 -1.13870341 Fe 27.64405854 30.93578508 25.76531835 -1.37549074 1.15306887 -1.52214223 Fe 27.50115833 29.26515046 27.30194190 -0.73178998 -1.66233472 1.19323498 Fe 25.60272756 30.92298708 27.32639851 0.45708595 1.68375005 1.35543891 Fe 29.46018346 29.44949095 25.88065702 -0.27982370 -1.50636377 -3.01942917 Fe 31.22709556 31.15874741 25.76202217 -0.73552865 -0.66397932 0.75792269 Fe 30.94906112 29.17748606 27.44078901 3.90381302 1.49071749 1.37254471 Fe 29.13867851 30.98294755 27.48043568 1.78748782 1.66363964 1.27802679 Fe 25.49941757 25.61754594 29.28645990 0.44873228 0.65146217 0.20221740 Fe 27.58421941 27.28447951 29.04864819 -1.15211590 1.03790169 2.12244906 Fe 27.25418891 25.50565559 30.97886871 0.39200305 1.01082659 -0.93114739 Fe 25.57103638 27.25572692 31.20725012 1.15362328 0.40617179 -1.39878623 Fe 29.52719465 25.58266081 29.40980263 -1.74788509 0.30020854 2.27462718 Fe 31.34640270 27.24069330 29.12123442 0.14039370 2.11105465 3.04560581 Fe 31.28468187 25.80688912 31.20116199 -0.97655919 0.78456209 -0.78958840 Fe 29.13023999 27.66072814 31.31575500 0.51940060 -0.31822518 -1.53215220 Fe 25.83091264 29.45194769 29.15189078 -0.14964670 -1.39244895 0.46467734 Fe 27.64591614 31.06901236 29.40861718 -1.14667637 0.64183997 -0.80357238 Fe 27.28759278 29.53601328 31.19172750 1.30608546 -3.50162162 -0.19351780 Fe 25.74917359 30.98749208 31.19025448 -1.23532554 1.48597709 -0.43901423 Fe 29.34079891 29.34597413 29.23003720 -2.45072467 -0.65068726 -1.06065892 Fe 31.24548102 31.03941234 29.28277517 -0.57040488 0.70052076 -0.98242906 Fe 30.86215399 29.39237727 30.70363421 2.47117387 -1.61180767 2.27092540 Fe 29.16314034 30.91620620 31.20408598 0.52437048 -0.00921511 0.17013322