500 Lattice="18.267908781283005 0.0 0.0 0.0 18.267908781283005 0.0 0.0 0.0 18.267908781283005" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-1762.2332134081487 pbc="F F F" Fe -0.00759441 -0.00979022 0.03462846 26 0.34880939 0.31178038 0.28995825 Fe 1.83994010 1.84991811 0.02761144 26 -0.05108784 -0.14903594 -0.22563980 Fe 1.85547995 0.01824829 1.81437274 26 -0.18105020 -0.24055185 -0.12841282 Fe 0.01487918 1.81477048 1.80340405 26 -0.23395978 -0.06374570 -0.00023232 Fe 3.68246119 0.00604651 -0.00555799 26 -0.07193814 0.14831473 0.15130420 Fe 5.50349795 1.77379812 -0.02574475 26 -0.10066974 0.16289896 -0.04640763 Fe 5.44525187 0.02475079 1.86138571 26 0.12424890 -0.21485479 -0.11091275 Fe 3.66302331 1.86365625 1.85762237 26 -0.08372936 -0.05206757 -0.16513796 Fe 7.27629090 -0.02398966 0.00958966 26 0.10602116 0.14903374 0.23389218 Fe 9.11719333 1.85840164 -0.01107150 26 -0.01109462 -0.20382379 -0.10157844 Fe 9.15142650 -0.00617169 1.85892430 26 -0.09312005 -0.09393980 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