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=21.589760550968887 stress="-3.8781617675875504 0.275042102523064 0.18355683953820326 0.275042102523064 -4.018913387675226 -0.46844273121895647 0.18355683953820326 -0.46844273121895647 -5.072361819647222" pbc="T F T" Fe 0.15300231 0.03848316 -0.04225341 -41.83588675 -24.95364176 27.76722186 Fe 1.41852158 1.45789336 -0.11174318 42.33223136 38.29124336 36.02172970 Fe 1.27041603 0.19178619 1.67895518 46.90201899 -52.84115956 -43.61515682 Fe 0.29140871 1.61455359 1.53253581 -47.39836360 39.50355796 -20.17379473