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=15.860365151643233 stress="-212.5149702303383 -13.743358708811748 -22.72211235538994 -13.743358708811748 -215.5024860607895 13.6598604547749 -22.72211235538994 13.6598604547749 -99.8737436977247" pbc="F F F" Fe -0.02432459 0.06329927 -0.06254558 -93.50490970 -74.51241791 -35.80310881 Fe 1.27846858 1.49451428 -0.02740261 67.00329904 97.78050884 -28.23185027 Fe 1.34140700 0.07646806 1.41986395 89.47404543 -81.17398881 44.26377410 Fe -0.07237737 1.38659309 1.72029417 -62.97243477 57.90589788 19.77118498