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=7.365250518449616 stress="-1.5462008922313357 0.06090101694168867 -0.004585591553745819 0.06090101694168867 -1.4462542823030586 0.1085866664502875 -0.004585591553745819 0.1085866664502875 -1.8630529081725402" pbc="F F T" Fe 0.03369179 0.02598936 -0.27670350 -12.78409798 -15.59008499 6.47026337 Fe 1.46375436 1.40583543 -0.24440284 12.90822679 13.84980410 3.92669179 Fe 1.20178472 0.29874826 1.27290972 20.36935033 -18.79725652 -4.57848838 Fe 0.05835534 1.24645637 1.48193431 -20.49347914 20.53753742 -5.81846677