4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2.3072660884735745 stress="-1.439014763841033 -0.04191937379490097 -0.21875222927930127 -0.04191937379490097 -1.8882178698147523 -0.4268023686130167 -0.21875222927930127 -0.4268023686130167 -1.7483667311202569" pbc="F T F" Fe 0.07034430 0.04852473 0.05473499 -18.36017085 3.48113291 -17.39998864 Fe 1.41561068 1.63661615 0.11041876 10.78917134 -15.45712433 -20.96345591 Fe 1.26735611 -0.16466555 1.24148635 20.50360674 18.40175552 28.36229903 Fe 0.08611608 1.53369179 1.52598936 -12.93260723 -6.42576410 10.00114552