500 Lattice="18.319947923789034 0.0 0.0 0.0 18.319947923789034 0.0 0.0 0.0 18.319947923789034" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1492.6903997806896 stress="-0.006092854736062788 -0.0006270188995913471 0.0004809377717083569 -0.0006270188995913471 -0.006473532787631998 -0.0002501317545826827 0.0004809377717083569 -0.0002501317545826827 -0.006067305649893804" free_energy=-1492.6903997806896 pbc="F F F" Cr 0.00762156 0.02784800 0.01338462 -0.38283568 -0.49332773 -0.42818110 Cr 1.81181064 1.84625733 0.02246033 0.66453724 0.36087334 -1.01257808 Cr 1.85123732 0.01873672 1.82045273 0.33228115 -0.99681043 0.48954561 Cr 0.01383633 1.80050421 1.84512436 -0.86577062 1.10464407 0.35658249 Cr 3.67468126 0.01868976 0.00252442 -0.16186574 -0.52177660 -0.64106004 Cr 5.48085736 1.83584884 0.00151808 0.21020601 0.61183888 -0.47828423 Cr 5.46532881 0.03173344 1.83646524 0.47768261 -0.71713537 0.56083715 Cr 3.64582110 1.82539076 1.83923358 0.17993986 0.69476062 0.81536719 Cr 7.36221798 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