32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-12.952720413831232 stress="-0.004015348286264398 0.0005435723395694065 -0.0005238267787491786 0.0005435723395694065 -0.003936394312720791 -0.0003596817259467264 -0.0005238267787491786 -0.0003596817259467264 -0.00406748577921711" pbc="F F F" Fe 20.88909689 21.11115480 21.11044915 -5.87390506 -4.84725585 -8.96036533 Fe 22.70960170 22.31143450 20.86432452 -9.51453674 18.11551678 -5.95879094 Fe 22.01159245 20.83509776 22.60416852 9.44585509 -8.06745996 -1.11574291 Fe 21.07687608 22.51878885 22.32834452 -6.44851547 4.99687440 2.42348448 Fe 23.64970377 20.95894820 21.08349577 11.23015624 -18.80817191 1.99660501 Fe 25.42640788 22.26701478 20.84743642 2.20036414 1.52072897 -2.88523802 Fe 25.20804484 21.22277084 22.68584377 1.54555860 -28.04402102 -32.74552284 Fe 24.18362810 22.69581920 22.84755212 -11.01517099 -8.67682851 -9.12130977 Fe 20.97302364 24.17626233 20.85402479 -2.83012403 -4.89971203 -8.22294604 Fe 22.70996341 25.49207130 21.15300231 -6.36218141 8.28876657 -14.47137019 Fe 22.53848316 23.95774659 22.31937324 -1.92942690 -7.84689202 -0.00503315 Fe 20.95789336 25.38825682 22.26835150 -5.78101278 10.89450574 1.76584798 Fe 24.19178619 24.17895518 21.29140871 -14.09288404 -12.31633267 -38.60321049 Fe 25.61455359 25.53253581 21.43091928 6.99241989 11.67909112 -8.64130727 Fe 25.28091226 24.11610486 22.46603997 30.26325705 -13.05929569 16.21956011 Fe 23.80598025 25.32157598 22.51361598 1.62651102 22.21827856 17.54757051 Fe 20.85198705 20.97567541 24.04783266 -16.14188097 -2.23089252 -5.73057340 Fe 22.53915563 22.27846858 23.87244793 1.58347484 4.25906315 2.13663463 Fe 22.06031206 20.84140700 25.31668137 13.75638026 -10.01539072 10.44925989 Fe 20.92068996 22.24396547 25.59073906 -5.48634883 9.23914739 3.89303267 Fe 24.27219963 20.93381326 24.13132919 -11.28031381 -9.97099066 8.01851503 Fe 25.75978669 22.22592512 23.78504734 20.07302158 22.92612194 22.75467028 Fe 25.53864610 21.31331582 25.58343331 9.70757116 -5.27105870 5.26362630 Fe 24.00532527 22.30322305 25.63428374 -8.39078337 6.29691080 3.76629101 Fe 21.23171545 24.18190327 23.66838988 -8.58804679 -6.52143865 6.14567983 Fe 22.58460488 25.42485375 24.12990665 1.43759993 12.08683840 -7.17963244 Fe 22.28220450 24.28278197 25.56210000 21.93353440 -36.50766449 7.82346708 Fe 21.13362859 25.32702941 25.57034430 -32.15407547 27.24125026 3.55139704 Fe 24.04852473 24.05473499 23.91561068 -7.45086519 2.08132718 9.99799419 Fe 25.63661615 25.40480033 23.69950348 5.71752038 9.73752321 5.72126280 Fe 25.29869006 24.11041876 25.26735611 10.33910071 -4.54757038 6.76153366 Fe 23.83533445 25.24148635 25.58611608 5.48774658 10.04903130 7.40461028