500 Lattice="23.7500022649765 0.0 0.0 0.0 23.7500022649765 0.0 0.0 0.0 23.7500022649765" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1195.1661987911543 stress="0.06603917925787932 9.775831528627934e-05 0.00011279937735458088 9.775831528627934e-05 0.06626666558512369 8.567624709082918e-06 0.00011279937735458088 8.567624709082918e-06 0.06611418828191637" free_energy=-1195.1661987911543 pbc="F F F" Al 0.07102722 0.08630271 0.05827580 0.48318385 0.47737227 0.49191062 Al 2.23806882 2.28722844 0.05841207 0.09973656 0.15541856 0.93787477 Al 2.34130606 0.00019214 2.34557160 0.06518987 0.94350947 0.08471732 Al 0.04695089 2.43983812 2.28245802 0.90190023 0.08707748 0.11451043 Al 4.89298971 0.03191576 0.04452308 0.00925783 0.77112090 0.78611671 Al 7.03519793 2.31241683 0.02166470 -0.01253817 0.01697212 0.90032236 Al 7.20389457 0.07554832 2.27421669 0.00150642 0.91355140 -0.01113635 Al 4.74809295 2.32191425 2.36044084 0.04394068 0.00777714 -0.02725454 Al 9.56243834 0.05502355 0.04765652 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