256 Lattice="14.812955106709978 0.0 0.0 0.0 14.812955106709978 0.0 0.0 0.0 14.812955106709978" Properties=species:S:1:pos:R:3:forces:R:3 energy=-737.6092561199237 stress="-0.0052953330922509536 -0.0008034358412725925 0.00013583380777733815 -0.0008034358412725925 -0.005694725211370026 0.000248400370776432 0.00013583380777733815 0.000248400370776432 -0.005312017066995219" free_energy=-737.6092561199237 pbc="F F F" Fe 0.00794940 0.03288803 0.01022685 -0.57740862 -0.51465762 -0.48435903 Fe 1.83171402 1.83594445 0.02144918 0.93486889 1.00465102 -0.89072460 Fe 1.82272756 0.00626418 1.83843967 0.92524631 -0.94511586 0.76388348 Fe 0.03258353 1.87555312 1.83286031 -1.06017726 0.62093107 0.66978738 Fe 3.70144080 0.03413709 0.00610900 0.01410480 -0.54774906 -0.57855688 Fe 5.55099641 1.88510892 0.00814306 0.32463935 0.36715199 -0.80441363 Fe 5.54677769 0.03533806 1.82271979 0.14670561 -0.85081325 0.80318217 Fe 3.72415144 1.84039927 1.87857273 -0.33262425 1.01868902 0.64548888 Fe 7.38462318 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