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=-16.62662533068989 stress="-0.6413315207155176 -0.15713030494313504 0.2847702853708899 -0.15713030494313504 -0.5509964878488461 0.012740268784431618 0.2847702853708899 0.012740268784431618 -0.06504556249307712" free_energy=-16.62662533068989 pbc="T F T" Fe 0.19877714 0.10881314 0.13250256 -4.70238468 -7.43723250 -0.79406041 Fe 1.60031152 1.55442580 2.85431870 -1.32027047 9.81631933 2.98183576 C 1.28011711 0.13572127 1.56484887 1.67633548 -2.92360692 1.14736782 C 2.73387496 1.51368247 1.56603388 4.34631967 0.54452009 -3.33514317