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=2.6087591829746937 stress="-1.333324307347192 0.4348014248656973 -0.9120096592909321 0.4348014248656973 -1.2516003954561283 1.292983027188063 -0.9120096592909321 1.292983027188063 -2.167095877987393" pbc="T T F" C 0.23520322 0.01943412 0.09176916 -19.13600810 7.81462353 -29.36447375 C 1.37192919 1.27746560 0.29553441 -5.67079844 30.30415096 -26.57647639 Fe 1.34125301 0.00601457 1.20763472 31.78569640 -43.44098685 50.41898797 Fe -0.05055051 1.28901754 1.48006896 -6.97888986 5.32221236 5.52196218