108 Lattice="11.210763125619632 0.0 0.0 0.0 11.210763125619632 0.0 0.0 0.0 11.210763125619632" Properties=species:S:1:pos:R:3:forces:R:3 energy=-270.71009377973365 stress="-0.0058985502893429 0.0011289296228596953 0.0010247605098942765 0.0011289296228596953 -0.006037131209348714 0.0010729249513066047 0.0010247605098942765 0.0010729249513066047 -0.005940646520032371" free_energy=-270.71009377973365 pbc="F F F" Fe 0.01215622 0.03313101 0.01248602 -0.46446508 -0.46936656 -0.44605621 Fe 1.85787934 1.84105200 0.01689445 0.63699600 0.95692813 -0.95032108 Fe 1.84912374 0.00970799 1.84928525 0.73906638 -0.70976011 0.99043878 Fe 0.02604623 1.87065875 1.84053276 -0.72818481 0.63449806 1.04512894 Fe 3.70428269 0.03076467 0.00073603 0.29112624 -0.50595926 -0.49661581 Fe 5.60908654 1.89838781 0.01491283 -0.16795320 0.42518014 -0.55836946 Fe 5.55068078 0.00467010 1.89038716 0.15148619 -0.32846481 0.37790147 Fe 3.71817971 1.88086252 1.83425899 0.10817337 0.81921951 1.21228494 Fe 7.47252494 0.01308064 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