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=-6.580511127530942 stress="-13.074299590668558 -3.00273263456417 -0.2150492225192977 -3.00273263456417 -14.198465198771652 0.22757839438079186 -0.2150492225192977 0.22757839438079186 -12.657572026676977" pbc="F F F" Fe 0.10609294 -0.03396003 -0.19401975 -5.32135578 -6.42182218 -4.12903490 Fe 1.32157598 1.51361598 -0.14801295 5.57768868 6.58090476 -3.95086346 Fe 1.47567541 0.06329927 1.43745442 3.65938468 -2.97451360 4.51590704 Fe -0.22153142 1.49451428 1.34126820 -3.91571758 2.81543102 3.56399133