2916 Lattice="32.30171918703682 0.0 0.0 0.0 32.30171918703682 0.0 0.0 0.0 32.30171918703682" Properties=species:S:1:pos:R:3:forces:R:3 energy=-11610.035961375634 stress="-0.004891629323834893 -3.569303522369123e-05 9.323041343204988e-05 -3.569303522369123e-05 -0.00484985415393881 6.0639809418631384e-05 9.323041343204988e-05 6.0639809418631384e-05 -0.004860999852068354" pbc="F F F" Fe 0.02264985 0.01312970 0.01526330 1.16700533 1.15935737 1.15283405 Fe 1.80282448 1.81253873 0.03227796 -0.51888722 -0.55387864 -0.24660170 Fe 1.81040993 0.03536282 1.80044870 -0.71411971 -0.18092677 -0.44501625 Fe 0.02438193 1.82675226 1.76755788 -0.12677763 -0.67657663 -0.18385175 Fe 3.57546878 0.02581003 0.00041013 0.00115139 0.69015755 0.70812062 Fe 5.40589644 1.78000188 0.02273424 -0.08188084 -0.20081466 -0.07958434 Fe 5.40903484 0.02197313 1.76795461 -0.09019182 -0.11948141 -0.27647462 Fe 3.56491391 1.73982844 1.77225154 0.29963443 0.26158088 -0.23198657 Fe 7.17890000 0.02971723 0.00485892 0.01326004 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