256 Lattice="14.599545823364943 0.0 0.0 0.0 14.599545823364943 0.0 0.0 0.0 14.599545823364943" Properties=species:S:1:pos:R:3:forces:R:3 energy=-889.453555954192 stress="-0.006886127295886144 -0.0007988714264316264 -0.00035484195465286745 -0.0007988714264316264 -0.0064795817140413025 -0.0005673552423469461 -0.00035484195465286745 -0.0005673552423469461 -0.004444774638051609" free_energy=-889.453555954192 pbc="F F F" Fe 0.01597885 0.01452204 0.02332284 0.30994363 0.45211884 0.50524372 Al 1.83230497 1.86895370 0.00280837 0.35312529 -0.24577602 -0.05959639 Fe 1.81503459 0.02219005 1.76108583 0.07521132 0.00578489 0.04972481 Fe 0.01798542 1.84085962 1.81426593 0.04297611 -0.19675979 0.03269294 Fe 3.65132673 0.04925333 0.02757833 -0.15801900 0.04149405 0.17272529 Al 5.46659616 1.85478858 0.00297909 -0.15150379 -0.36974132 -0.72693481 Al 5.49212969 0.03188794 1.83871112 0.41333596 -0.42441900 0.23663405 Al 3.64886503 1.81169445 1.85584808 -0.57874216 0.48055494 0.14839961 Fe 7.30296631 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