108 Lattice="10.730028469937752 0.0 0.0 0.0 10.730028469937752 0.0 0.0 0.0 10.730028469937752" Properties=species:S:1:pos:R:3:forces:R:3 energy=-363.15940141181136 stress="-0.005842023759050764 0.00038947242525694893 0.00030519131434410414 0.00038947242525694893 -0.006164637183350572 -0.0005962880423447387 0.00030519131434410414 -0.0005962880423447387 -0.006237486707377833" free_energy=-363.15940141181136 pbc="F F F" Fe 0.01049644 0.00059898 0.00478138 0.30214519 0.34969417 0.35692415 Fe 1.79987781 1.75606513 0.01046235 -0.12145804 0.08330856 -0.17470131 Fe 1.75968405 0.00736486 1.81192009 -0.02512408 -0.19581508 -0.27370271 Fe 0.00724681 1.82045964 1.78062903 -0.09519301 -0.30071783 -0.08671520 Fe 3.61057162 0.02809805 0.00356685 -0.11257633 -0.07256575 0.18878173 Fe 5.34772145 1.77940191 0.02469559 0.22179088 0.06824559 -0.33408643 Fe 5.39225592 0.00752327 1.81308062 -0.15571732 -0.16721193 -0.12898901 Fe 3.58340032 1.80785524 1.76994165 -0.06031273 -0.26808194 0.09636199 Fe 7.15947383 0.00363870 0.01368084 -0.06213134 0.11963455 0.11512573 Fe 8.93256913 1.76655461 0.01324885 -0.17503729 0.04748809 0.15720402 Fe 8.91168334 0.00074656 1.79788327 -0.11146825 0.08713673 -0.06089918 Fe 7.13606103 1.79799421 1.77606995 0.11584396 0.04859840 0.07240234 Fe 0.02839323 3.58333908 0.01661217 0.13410128 -0.06289148 -0.00242587 Fe 1.80916126 5.36721343 0.00433631 -0.14298009 0.24446420 -0.25833329 Fe 1.83174065 3.60679880 1.77662388 -0.30979620 -0.17363666 0.11165598 Fe 0.00169884 5.36758359 1.75684985 -0.10073277 0.01259166 0.12013138 Fe 3.59790233 3.60461073 0.01914845 -0.18357159 -0.28115135 -0.47922561 Fe 5.35040396 5.33471609 0.02567220 0.13944112 0.30995393 -0.42554035 Fe 5.34600489 3.58958446 1.77961733 0.24681758 -0.05915624 0.20425499 Fe 3.57267822 5.37777248 1.76021059 -0.01055475 0.13718258 0.33804057 Fe 7.14095515 3.61192423 0.02886217 0.22092441 -0.17526359 -0.30367593 Fe 8.97254487 5.39797084 0.02598940 -0.05972170 -0.11554773 -0.07445603 Fe 8.96051302 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