256 Lattice="14.379117454215343 0.0 0.0 0.0 14.379117454215343 0.0 0.0 0.0 14.379117454215343" Properties=species:S:1:pos:R:3:forces:R:3 energy=-900.4209516184594 stress="-0.0066212956361318825 1.7056231633041453e-05 -8.064814656390228e-05 1.7056231633041453e-05 -0.006253154634780716 -8.880360799058062e-05 -8.064814656390228e-05 -8.880360799058062e-05 -0.006466847562673542" free_energy=-900.4209516184594 pbc="F F F" Fe 0.01163983 0.00446640 0.00832850 0.35400300 0.38453301 0.41865852 Fe 1.77131467 1.78918901 0.01547186 -0.06436965 -0.05730808 -0.26885110 Fe 1.82355277 0.02826459 1.77593195 -0.43359785 -0.19674404 0.03991532 Fe 0.01656216 1.82445402 1.82058229 -0.07419717 -0.17647779 -0.07107153 Fe 3.57336942 0.03250212 0.00475620 0.06983308 0.09782609 0.09508071 Fe 5.38179863 1.77997706 0.00950757 0.03073176 0.16170977 -0.07211314 Fe 5.41573545 0.02773085 1.78015771 -0.09749269 -0.11277924 0.12446034 Fe 3.57408345 1.79078019 1.81738309 0.24010749 0.05100818 -0.22856035 Fe 7.16759726 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