2916 Lattice="32.64196778246739 0.0 0.0 0.0 32.64196778246739 0.0 0.0 0.0 32.64196778246739" Properties=species:S:1:pos:R:3:forces:R:3 energy=-11027.25177907147 stress="-153.6074983949344 -0.5166292261774537 -0.2617404031536168 -0.5166292261774537 -150.25040577084255 -0.03785420570000042 -0.2617404031536168 -0.03785420570000042 -152.55924002565718" pbc="F F F" Fe 0.02070525 0.00672521 -0.02862513 0.44332930 0.45198380 0.47427920 Fe 1.81811512 1.79892783 -0.01535594 -0.16124399 -0.07692696 0.01436373 Fe 1.80319988 0.06482916 1.81640987 -0.09321766 -0.14822184 -0.12314027 Fe -0.01639389 1.79230572 1.81349365 0.02092268 -0.06089719 -0.23594001 Fe 3.63447758 -0.01591352 0.00051289 0.00089812 0.32880943 0.31650212 Fe 5.47265917 1.82802577 -0.01789051 -0.13615832 -0.20014008 0.01147119 Fe 5.46250010 -0.01259970 1.82772970 -0.02536494 0.09567133 -0.14796182 Fe 3.62131593 1.81063931 1.78173540 0.11664139 -0.05189637 0.01753160 Fe 7.27721331 0.02241824 0.00035352 -0.19418370 0.15013533 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