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=-0.9525666476869116 stress="-1.4436503057977574 0.05832879460264306 0.006299943702776447 0.05832879460264306 -1.403944396085188 -0.0434775678145269 0.006299943702776447 -0.0434775678145269 -1.0558612201060515" pbc="T F F" Fe -0.14801295 0.06329927 0.09073906 9.32893206 -17.52480959 -10.26505494 Fe 1.77219963 1.43381326 0.13132919 -11.48958468 14.68915504 -9.29483616 Fe 1.75978669 0.18365717 1.70288723 -10.34766126 -12.83918985 9.16747743 Fe 0.08343331 1.29585403 1.44809454 12.50831387 15.67484440 10.39241368