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=7.292289870214332 stress="-151.37210260763905 -67.2919344895806 -36.202184138071445 -67.2919344895806 -109.66062169764734 9.078882482376791 -36.202184138071445 9.078882482376791 -83.77464114648292" pbc="F F F" Fe -0.00792870 0.15300231 0.07101897 -100.83605652 -60.22651782 -42.88148950 Fe 1.45774659 1.41852158 -0.04210664 73.08188499 61.09687408 -9.50446304 Fe 1.16916908 -0.12349103 1.65782616 37.67034458 -19.03830167 42.51912593 Fe 0.00053116 1.64339576 1.61455359 -9.91617304 18.16794541 9.86682661