864 Lattice="21.582331905136357 0.0 0.0 0.0 21.582331905136357 0.0 0.0 0.0 21.582331905136357" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-3372.990637920477 pbc="F F F" Fe 0.00673228 -0.00516045 -0.02293287 26 0.34971616 0.32519563 0.35882959 Fe 1.81551668 1.79757517 0.02481651 26 -0.10662133 -0.21179587 -0.21940634 Fe 1.79411980 -0.02478285 1.82573411 26 -0.16518100 0.01210551 -0.35194918 Fe -0.00887901 1.81705241 1.76266064 26 -0.00707233 -0.09425436 0.12491896 Fe 3.63094298 -0.02071481 0.02220063 26 -0.15096084 0.07723780 0.03338649 Fe 5.43270977 1.76923125 -0.01618540 26 -0.15321302 0.15312469 -0.07372563 Fe 5.36678043 0.03578712 1.83295642 26 0.46840714 -0.35378608 -0.15224266 Fe 3.63044058 1.77874843 1.77125279 26 -0.22728523 0.23362568 0.05555717 Fe 7.20853996 -0.02637465 0.01358055 26 -0.11187841 0.05027713 0.14786049 Fe 8.96932158 1.77600655 0.02907785 26 0.14647369 0.32363428 -0.25704753 Fe 9.00068051 0.00284177 1.79056075 26 -0.14521355 -0.21323517 0.12734923 Fe 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