256 Lattice="14.168401336669927 0.0 0.0 0.0 14.168401336669927 0.0 0.0 0.0 14.168401336669927" Properties=species:S:1:pos:R:3:forces:R:3 energy=-952.3895259452124 stress="-0.006227684254481999 0.0006775617757618252 -4.726399416421763e-05 0.0006775617757618252 -0.006204869946232442 -0.00027784349322932414 -4.726399416421763e-05 -0.00027784349322932414 -0.006234556039519675" free_energy=-952.3895259452124 pbc="F F F" Fe 0.00856643 0.00133328 0.00148624 1.10994516 1.06547692 1.09849937 Fe 1.79101739 1.74797232 0.01460024 -0.60413434 -0.18631382 -0.32001319 Fe 1.76584179 0.00559313 1.77487420 -0.28380213 -0.32658412 -0.37716992 Fe 0.02881495 1.75547754 1.78632568 -0.34838305 -0.33516029 -0.70934898 Fe 3.51977040 0.01076757 0.02533339 0.03399571 0.40889384 0.41861115 Fe 5.34610814 1.75365098 0.02183415 -0.24937258 -0.09130172 -0.32898226 Fe 5.26014632 0.01447905 1.77639931 0.18741482 -0.35711671 -0.45219811 Fe 3.53644006 1.78591907 1.75215980 -0.22462371 -0.31812072 -0.19390033 Fe 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