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=-4.267416364082142 stress="-32.08774595226525 -11.370314116523287 11.517950376337968 -11.370314116523287 -21.496574361148948 -4.215532203906168 11.517950376337968 -4.215532203906168 -21.044270478606702" pbc="F F F" Fe 0.48566920 0.08343331 -0.20414597 -7.18091896 -12.14196032 -7.64468508 Fe 1.44809454 1.72094491 0.23171545 21.74587011 12.87081106 -8.14216863 Fe 1.50893269 -0.10782073 1.62780321 1.88798657 -0.89997495 3.26485660 Fe -0.07514625 1.53470699 1.28220450 -16.45293773 0.17112421 12.52199710