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=5.85322515408404 stress="-2.397686460227019 -0.2087497196562006 -0.4859915063330084 -0.2087497196562006 -2.093648200310506 0.6634442224919804 -0.4859915063330084 0.6634442224919804 -2.8086578824775597" pbc="T F T" Fe 0.29391194 0.02103145 -0.04131534 -14.36627398 -13.34857542 -13.18150551 Fe 1.68220204 1.39362841 0.23573857 -0.98238531 30.28529221 -30.58254249 Fe 1.35549493 0.22083292 1.28984966 12.08954116 -32.19508841 31.01998090 Fe -0.01264569 1.42299150 1.40698366 3.25911812 15.25837163 12.74406710