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=-1.33751110765 stress="-7.223777843831797 -2.6510175349605216 -0.48577639266402944 -2.6510175349605216 -7.824377415675686 -2.6748007604860025 -0.48577639266402944 -2.6748007604860025 -7.225483393516782" pbc="F F F" Fe 0.11042859 0.20947124 -0.14487149 -16.60489887 -23.53030574 -21.12232706 Fe 1.55280714 1.41333883 0.00144273 17.36716680 15.84467005 -1.94047224 Fe 1.37241235 -0.17769156 1.41049160 4.80253261 -4.64774263 8.47162171 Fe -0.27713580 1.43858073 1.25205420 -5.56480054 12.33337832 14.59117759