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=-5.65414335781 stress="-1.6356358638879347 -0.5401102142441563 0.1854046323996202 -0.5401102142441563 -1.319901472552481 0.007976277610038275 0.1854046323996202 0.007976277610038275 -0.5492370788822528" pbc="F F F" Cr -0.27948471 0.19273990 -0.19277068 -3.87395055 -3.71583398 -0.39560643 Cr 1.26172667 1.55332204 -0.11563527 4.60460796 3.95225660 -1.38492055 Fe 1.73110688 -0.00183978 1.60225619 1.74720132 -1.87351028 0.13832643 Fe 0.20071341 1.32858036 1.64720807 -2.47785873 1.63708766 1.64220056