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=-7.30108540599 stress="-0.8794675876333905 -0.19114752740369192 -0.32676631386545124 -0.19114752740369192 -0.6373785150164837 -0.05089021605724804 -0.32676631386545124 -0.05089021605724804 -0.9017681089787898" pbc="F F F" Fe 0.13362859 -0.17297059 0.07034430 -2.24461701 -1.47725125 -2.24731663 Fe 1.54852473 1.55473499 -0.08438932 0.97280108 1.10455179 -1.02726836 Fe 1.63661615 -0.09519967 1.37719504 1.77773881 -0.28362507 2.24023227 Fe -0.20130994 1.61041876 1.26735611 -0.50592288 0.65632452 1.03435272