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=-6.281755836058276 stress="-14.967194301299521 -2.77155577043559 5.169395337818758 -2.77155577043559 -9.714330263573183 -2.051882828792091 5.169395337818758 -2.051882828792091 -11.262960652566647" pbc="F F F" Fe 0.20288723 0.08343331 -0.20414597 -2.62787349 -4.54406167 -3.78800226 Fe 1.44809454 1.72094491 0.23171545 9.03963075 4.03705031 -4.72275459 Fe 1.50893269 -0.10782073 1.62780321 1.21729841 -1.33480891 1.94288839 Fe -0.07514625 1.62990665 1.28220450 -7.62905567 1.84182026 6.56786846