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=-12.952720413831356 stress="-297.48912383275666 40.272187494018226 -38.80927838396923 40.272187494018226 -291.6395818408588 -26.648099711940404 -38.80927838396923 -26.648099711940404 -301.3518864106376" pbc="F F F" Fe -0.11090311 0.11115480 0.11044915 -5.87390506 -4.84725585 -8.96036533 Fe 1.70960170 1.31143450 -0.13567548 -9.51453674 18.11551678 -5.95879094 Fe 1.01159245 -0.16490224 1.60416852 9.44585509 -8.06745996 -1.11574291 Fe 0.07687608 1.51878885 1.32834452 -6.44851547 4.99687440 2.42348448 Fe 2.64970377 -0.04105180 0.08349577 11.23015624 -18.80817191 1.99660501 Fe 4.42640788 1.26701478 -0.15256358 2.20036414 1.52072897 -2.88523802 Fe 4.20804484 0.22277084 1.68584377 1.54555860 -28.04402102 -32.74552284 Fe 3.18362810 1.69581920 1.84755212 -11.01517099 -8.67682851 -9.12130977 Fe -0.02697636 3.17626233 -0.14597521 -2.83012403 -4.89971203 -8.22294604 Fe 1.70996341 4.49207130 0.15300231 -6.36218141 8.28876657 -14.47137019 Fe 1.53848316 2.95774659 1.31937324 -1.92942690 -7.84689202 -0.00503315 Fe -0.04210664 4.38825682 1.26835150 -5.78101278 10.89450574 1.76584798 Fe 3.19178619 3.17895518 0.29140871 -14.09288404 -12.31633267 -38.60321049 Fe 4.61455359 4.53253581 0.43091928 6.99241989 11.67909112 -8.64130727 Fe 4.28091226 3.11610486 1.46603997 30.26325705 -13.05929569 16.21956011 Fe 2.80598025 4.32157598 1.51361598 1.62651102 22.21827856 17.54757051 Fe -0.14801295 -0.02432459 3.04783266 -16.14188097 -2.23089252 -5.73057340 Fe 1.53915563 1.27846858 2.87244793 1.58347484 4.25906315 2.13663463 Fe 1.06031206 -0.15859300 4.31668137 13.75638026 -10.01539072 10.44925989 Fe -0.07931004 1.24396547 4.59073906 -5.48634883 9.23914739 3.89303267 Fe 3.27219963 -0.06618674 3.13132919 -11.28031381 -9.97099066 8.01851503 Fe 4.75978669 1.22592512 2.78504734 20.07302158 22.92612194 22.75467028 Fe 4.53864610 0.31331582 4.58343331 9.70757116 -5.27105870 5.26362630 Fe 3.00532527 1.30322305 4.63428374 -8.39078337 6.29691080 3.76629101 Fe 0.23171545 3.18190327 2.66838988 -8.58804679 -6.52143865 6.14567983 Fe 1.58460488 4.42485375 3.12990665 1.43759993 12.08683840 -7.17963244 Fe 1.28220450 3.28278197 4.56210000 21.93353440 -36.50766449 7.82346708 Fe 0.13362859 4.32702941 4.57034430 -32.15407547 27.24125026 3.55139704 Fe 3.04852473 3.05473499 2.91561068 -7.45086519 2.08132718 9.99799419 Fe 4.63661615 4.40480033 2.69950348 5.71752038 9.73752321 5.72126280 Fe 4.29869006 3.11041876 4.26735611 10.33910071 -4.54757038 6.76153366 Fe 2.83533445 4.24148635 4.58611608 5.48774658 10.04903130 7.40461028