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=28.195561978518512 stress="-4.611967967095612 1.0872273592501789 0.45857685108046686 1.0872273592501789 -5.4136598206277595 0.3754367801032942 0.45857685108046686 0.3754367801032942 -6.140576778631102" pbc="F T T" Fe 0.21219253 -0.07514625 0.12990665 -64.32707873 72.38137313 -28.35428519 Fe 1.28220450 1.78278197 0.06210000 65.51065741 -84.21774367 -40.75351626 Fe 1.63362859 -0.17297059 1.47514463 34.21367844 39.55329971 26.83476976 Fe 0.04852473 1.55473499 1.41561068 -35.39725712 -27.71692917 42.27303169