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=-5.62911299338 stress="-2.053879013805875 0.6052974804876916 -0.2280387203377591 0.6052974804876916 -2.6011695185409867 0.27246027380182103 -0.2280387203377591 0.27246027380182103 -2.0352301217490387" pbc="F F F" Cr -0.11820765 -0.05142115 0.18843096 -0.77195363 -3.92867980 -3.21967909 Fe 1.55055104 1.61634395 0.22871948 1.24351081 3.50596322 -3.53827975 Fe 1.44630638 0.32311799 1.64982991 4.05998184 -4.97911471 4.59974335 Cr -0.25204613 1.32929456 1.28747849 -4.53153902 5.40183129 2.15821549