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=-1.6540126325211955 stress="-40.90689767472186 -14.644433258075564 14.427392406569869 -14.644433258075564 -27.930258284781903 -4.7730486890198645 14.427392406569869 -4.7730486890198645 -25.95876943309478" pbc="F F F" Fe 0.48566920 0.08343331 -0.20414597 -9.31742051 -15.43498089 -9.22697599 Fe 1.44809454 1.72094491 0.23171545 27.72679830 16.81515210 -10.31441568 Fe 1.50893269 -0.10782073 1.62780321 2.46052180 -1.46010185 4.07718133 Fe -0.07514625 1.53470699 1.28220450 -20.86989959 0.07993064 15.46421033