32 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-4.056197825948799 stress="-328.01105303320566 1.1843562059200181 -3.6718384124020282 1.1843562059200181 -300.7481056669385 -29.116163642168672 -3.6718384124020282 -29.116163642168672 -399.3642929533077" pbc="F F F" Fe 0.27559981 -0.21422910 0.21736445 -6.37197375 -2.30661737 -9.28060920 Fe 1.29734010 1.71642913 -0.03864038 0.46289313 -3.26859323 -5.25300064 Fe 1.23214964 -0.19504875 1.75551247 12.21993139 -3.04930120 -1.67852486 Fe -0.14555376 1.61554629 1.52071435 -4.34944918 -3.58574783 1.53403134 Fe 2.79917573 -0.13496742 -0.24687444 -0.05845739 -0.26478489 0.04864813 Fe 4.46963223 1.65586213 -0.06365670 10.67966082 -7.55312488 -2.73185205 Fe 4.33226600 -0.02545438 1.62036030 7.85587405 -4.77440728 -9.79346740 Fe 2.82441938 1.74843919 1.64432661 2.52569814 -22.79063848 -6.68591830 Fe -0.11038833 3.24849743 0.25911890 -5.17352745 -7.54788498 -17.67140024 Fe 1.69019325 4.45695800 0.10881314 -9.77764664 6.68171849 -16.14465653 Fe 1.63250256 3.19150797 1.55442580 -30.35488268 -2.23084209 -21.09764720 Fe -0.14568130 4.28011711 1.63572127 -8.24579690 31.96700081 -14.20010815 Fe 3.05791531 2.73387496 0.08501927 -3.34220869 9.57962980 -11.64909333 Fe 4.36244266 4.72149598 0.44415386 27.13164755 3.70237965 -16.45290460 Fe 4.72580078 2.78129995 1.87375698 6.66595662 8.86128546 -9.14875263 Fe 2.99955875 4.54313966 1.28010356 -10.07785273 7.23977196 23.15658544 Fe 0.25980354 -0.03332758 3.27143892 -28.00893169 -8.47442637 -9.34428378 Fe 1.28619118 1.60338854 3.24759167 -1.81275257 -26.26746243 -34.23505451 Fe 1.61018303 -0.07481803 4.24663523 15.33955306 -14.26471533 16.40128114 Fe -0.01297511 1.21050297 4.68843096 -8.47586670 3.91252140 9.69602796 Fe 3.17061300 0.29169807 2.96863002 -20.35144548 -7.97093159 -4.28882529 Fe 4.44630638 1.53851086 3.11473960 9.90834796 1.42178741 9.40295133 Fe 4.24795387 -0.17070544 4.28747849 9.50554894 -6.63467656 12.52992466 Fe 2.65737122 1.37993804 4.78095696 8.84808636 4.33517636 8.90477480 Fe -0.17535412 3.26008946 2.87675974 -8.82516477 -26.93178792 15.95401339 Fe 1.32230465 4.78460712 2.75346517 5.44768933 10.40353971 4.91157580 Fe 1.39035549 2.77715687 4.24014891 3.05738094 36.84787144 33.13467484 Fe -0.02270625 4.32743118 4.29546282 -2.05479739 8.80698591 12.71983259 Fe 2.70940621 3.11893942 2.72956938 25.75765104 9.34952098 36.47621572 Fe 4.33885520 4.49132826 3.23010044 26.42172849 -0.19859280 -23.06687831 Fe 4.72159979 2.96529690 4.62033173 1.00618631 -1.07029632 3.84654134 Fe 3.17828948 4.71182891 4.29301824 -25.55308013 6.07564215 24.00589853