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=45.94211336327381 stress="-4.1565547351871475 0.3937272261531564 0.8852809495409204 0.3937272261531564 -4.651170166092834 0.700897131305184 0.8852809495409204 0.700897131305184 -5.982772141794423" pbc="F F T" Fe 0.29874826 0.05835534 -0.25354363 -37.37338381 -49.65321039 -0.93467310 Fe 1.48193431 1.42001865 0.20070203 41.70974083 41.84374229 -30.91678575 Fe 1.20342959 0.28187239 1.36500085 56.29529850 -53.18982006 17.20384124 Fe 0.10170120 1.37793365 1.21904386 -60.63165551 60.99928816 14.64761761