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=27.837186296250973 stress="-466.29878056305654 27.153597939793315 -39.45871896939508 27.153597939793315 -442.8837331578122 -28.349706960397725 -39.45871896939508 -28.349706960397725 -501.7461078067725" pbc="F F F" Fe -0.11090311 0.11115480 0.11044915 -9.49544959 -8.48901952 -16.41312657 Fe 1.70960170 1.31143450 -0.13567548 -9.41234895 12.87811134 -6.16035338 Fe 1.01159245 -0.16490224 1.60416852 18.71097894 -16.89931058 -4.64533928 Fe 0.07687608 1.51878885 1.32834452 -14.37130425 10.44824506 -2.46695692 Fe 2.87679405 -0.04105180 -0.02449638 2.29217328 -20.39345868 -0.67461495 Fe 4.44594316 1.07002603 -0.07614254 12.17863109 7.46926834 -11.39793313 Fe 4.28802619 0.22277084 1.68584377 2.74582515 -42.09152687 -38.99201429 Fe 3.18362810 1.69581920 1.39330646 -12.74112790 -9.84149925 7.55216131 Fe 0.26959405 3.17626233 -0.14597521 -6.86982133 -12.64609766 -18.14604840 Fe 1.70996341 4.49207130 0.15300231 -7.23346235 17.10404738 -22.45390516 Fe 1.53848316 2.95774659 1.40045588 5.61112155 -14.47897569 -4.29392999 Fe -0.04210664 4.38825682 1.19043468 -11.76998147 21.66361952 2.68734466 Fe 3.19178619 3.17895518 0.29140871 -16.87361739 -18.18997490 -58.95228728 Fe 4.61455359 4.53253581 0.14904689 9.18529299 15.37079429 -12.10136535 Fe 4.28091226 3.30679497 1.46603997 47.99643702 -18.30890303 21.24378148 Fe 2.80598025 4.32157598 1.51361598 1.77482005 41.09353522 21.64177170 Fe -0.14801295 -0.02432459 3.06329927 -24.80044260 -13.68636484 0.61030848 Fe 1.14088401 1.27846858 2.89536594 19.32408800 16.23346102 6.20479260 Fe 1.34126820 -0.15859300 4.31668137 8.65264555 -10.77402703 9.12347268 Fe -0.08013605 1.24396547 4.59073906 -6.43253904 9.12579932 9.21346037 Fe 3.27219963 -0.06618674 3.13132919 -16.41758285 -10.34947983 9.93674756 Fe 4.75978669 1.22592512 2.78504734 22.96860539 39.12726090 27.70143239 Fe 4.68159264 0.48475961 4.58343331 5.54852954 -3.89414872 10.40879494 Fe 2.80586595 1.43262793 4.59887856 -2.90161689 3.90888673 3.24417057 Fe 0.23171545 3.18190327 2.54087884 -19.65530436 -4.87126728 23.76504612 Fe 1.71219253 4.42485375 3.12990665 -9.33936118 20.28105408 -11.94646577 Fe 1.28220450 3.28278197 4.56210000 22.96849412 -49.87338591 9.89041810 Fe 0.13362859 4.32702941 4.57034430 -40.85803238 34.86222992 3.08048870 Fe 3.04852473 3.05473499 2.91561068 -8.81413249 -17.89331793 5.09949441 Fe 4.63661615 4.40480033 2.87802106 8.90162259 18.15890909 5.31937024 Fe 4.29869006 3.11041876 4.26735611 17.74591121 -11.93591116 14.77605979 Fe 2.83533445 4.24148635 4.58611608 11.38094857 16.89144666 17.14522437