32 Lattice="7.080895194036602 0.0 0.0 0.0 7.080895194036602 0.0 0.0 0.0 7.080895194036602" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.98578596818604 stress="-0.009168339164371323 0.0007134197302854043 -0.0003812295307478235 0.0007134197302854043 -0.009075631474387143 -0.001015825141955771 -0.0003812295307478235 -0.001015825141955771 -0.006391503085932792" pbc="F F F" Fe 0.00889009 0.01255185 0.02714529 0.24467256 0.07839508 0.23886085 Fe 1.73736883 1.78455552 0.03534615 0.27457705 -0.16615872 -0.53112628 Fe 1.81898108 0.01027466 1.80183455 -0.24504672 -0.57718870 -0.37339131 Fe 0.03108317 1.74265960 1.75462525 -0.68614114 0.16180115 0.12335307 Fe 3.57281198 0.02829789 0.02028389 -0.30966967 -0.15460560 -0.16563112 Fe 5.28192819 1.74678186 0.01836311 0.35168484 0.22359557 -0.10537140 Fe 5.31654458 0.01353011 1.75329216 0.12871548 -0.15655383 0.18156384 Fe 3.55702947 1.75180319 1.75859097 -0.09576214 0.37761174 0.24857165 Fe 0.01973620 3.56923930 0.03005954 -0.12970157 -0.11027150 -0.12622672 Fe 1.74540529 5.34050858 0.00054783 0.27618558 -0.17359072 0.07156816 Fe 1.75264536 3.52133234 1.80156142 0.41340408 0.20707847 -0.13350766 Fe 0.04007304 5.28362749 1.77574096 -0.15324011 0.20387209 0.13595771 Fe 3.56684200 3.50653126 0.00852765 -0.19573879 0.30028686 -0.26779895 Fe 5.29216244 5.32939664 0.01771121 -0.19892068 -0.28062017 0.27306883 Fe 5.31934641 3.55959127 1.80306453 0.41447565 -0.10919886 -0.37499260 Fe 3.54603343 5.30357275 1.75583007 -0.23247453 0.28517314 -0.07393182 Fe 0.02479312 0.00981295 3.51627265 -0.21096236 -0.12481344 -0.02534401 Fe 1.75642490 1.75223310 3.52246809 0.18622820 0.35133131 0.20055049 Fe 1.74137084 0.00539257 5.27144746 0.18726143 -0.22713164 0.05998867 Fe 0.03340226 1.74410445 5.32849186 -0.05492363 0.15922096 -0.05571001 Fe 3.54797197 0.00940817 3.51447660 0.18583585 -0.45820865 0.24879923 Fe 5.32335928 1.77082477 3.52999266 0.33335906 -0.07153908 0.21610512 Fe 5.29906892 0.00946515 5.30010395 -0.20749965 0.20099235 -0.25548998 Fe 3.51431741 1.73009863 5.29866198 0.21518717 0.16839183 0.30380119 Fe 0.00294083 3.55220052 3.56909312 -0.34116743 -0.10825075 0.10427984 Fe 1.78050332 5.31409307 3.54929014 0.08111883 0.26365629 0.13976431 Fe 1.79067371 3.53025762 5.33119562 -0.09528406 0.11323910 0.16876471 Fe 0.02205152 5.32840194 5.31493885 0.28451895 -0.27005751 -0.23431361 Fe 3.57565041 3.53777122 3.54599665 -0.33716440 -0.07625551 -0.01391054 Fe 5.31212805 5.33163204 3.48939560 0.00574487 0.07354359 0.17810877 Fe 5.29990655 3.58168140 5.31213724 0.05733594 -0.24887421 -0.10523388 Fe 3.57425101 5.29006201 5.30891558 -0.14660866 0.14512937 -0.05112654