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=-6.40675519862 stress="-1.6914579401965404 0.010630863783252825 -0.40508039113760524 0.010630863783252825 -1.6744143593159988 -0.4650423114506242 -0.40508039113760524 -0.4650423114506242 -2.14400700039246" pbc="F F F" Fe 0.24624097 0.14302402 -0.14501107 -3.33632312 -3.74393209 -6.14799005 Fe 1.61042859 1.70947124 0.01001633 2.14357100 2.63187976 -0.76530008 Fe 1.55280714 -0.08666117 1.34655491 3.41814433 -1.91998778 3.33105956 Fe -0.12758765 1.32230844 1.41049160 -2.22539221 3.03204011 3.58223058