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=-33.50438866749357 stress="-2.241578086117204 -0.08226769265923949 0.12037030729381273 -0.08226769265923949 -2.1538697409716523 -0.2415021068907237 0.12037030729381273 -0.2415021068907237 -2.811376098897311" pbc="T F T" Fe 0.03848316 0.19178619 0.17895518 13.65788629 -22.05884713 -15.10677740 Fe 1.79140871 1.61455359 0.03253581 -19.51184108 17.02863628 -3.32357248 Fe 1.64904689 0.10609294 1.46603997 -19.22552603 -23.23653441 7.87604054 Fe -0.19401975 1.32157598 1.51361598 25.07948081 28.26674526 10.55430934