108 Lattice="10.730030568665645 0.0 0.0 0.0 10.730030568665645 0.0 0.0 0.0 10.730030568665645" Properties=species:S:1:pos:R:3:forces:R:3 energy=-363.159406141287 stress="-0.005841708867893619 0.00038948308203711314 0.00030520405555354863 0.00038948308203711314 -0.0061643130455228835 -0.0005962917640346681 0.00030520405555354863 -0.0005962917640346681 -0.00623715650012819" free_energy=-363.159406141287 pbc="F F F" Fe 0.01049644 0.00059898 0.00478138 0.30214818 0.34969532 0.35692538 Fe 1.79987816 1.75606549 0.01046235 -0.12145971 0.08330562 -0.17469763 Fe 1.75968440 0.00736485 1.81192044 -0.02512491 -0.19581112 -0.27370288 Fe 0.00724681 1.82045999 1.78062938 -0.09518959 -0.30071508 -0.08671414 Fe 3.61057231 0.02809804 0.00356685 -0.11257718 -0.07256225 0.18878385 Fe 5.34772250 1.77940226 0.02469559 0.22179006 0.06824415 -0.33408194 Fe 5.39225697 0.00752327 1.81308096 -0.15571658 -0.16721028 -0.12898919 Fe 3.58340102 1.80785559 1.76994201 -0.06031316 -0.26808186 0.09636017 Fe 7.15947522 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3.55217793 1.79228228 8.97151351 0.10294661 0.03394706 0.09574887 Fe 7.13242897 0.02869611 7.16849689 0.23525061 -0.46099616 0.11513850 Fe 8.91259147 1.80931732 7.14641720 0.38922919 -0.30069124 0.11204785 Fe 8.97679295 0.00451198 8.96570689 -0.43260555 0.44232198 -0.46697956 Fe 7.15261700 1.75509833 8.90803954 0.17507957 0.07773377 0.45899275 Fe 0.02062297 3.58724717 7.17435568 -0.15479045 -0.29787719 -0.04063186 Fe 1.76138215 5.38508101 7.13460976 0.31538847 -0.07342081 0.23392296 Fe 1.81716322 3.60627356 8.94228581 -0.12863340 -0.11140943 0.15250709 Fe 0.01613288 5.33246986 8.92693617 -0.00094431 0.19260919 -0.03670893 Fe 3.54541081 3.54449537 7.13763173 0.11269742 0.11133691 0.20132848 Fe 5.33252725 5.34011764 7.13060866 0.09740635 0.14534195 0.16719678 Fe 5.37754779 3.59504964 8.93580342 -0.11733221 -0.09981951 0.17404038 Fe 3.58305066 5.40646745 8.93818109 0.03202265 -0.07849400 0.05339759 Fe 7.14247062 3.56190440 7.14516317 0.16571412 0.09329286 0.24397453 Fe 8.93065934 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