500 Lattice="20.051237718844757 0.0 0.0 0.0 20.051237718844757 0.0 0.0 0.0 20.051237718844757" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1643.9405041586333 stress="-0.002362797467914502 7.082847115826317e-05 -9.083498960108568e-05 7.082847115826317e-05 -0.0024598386004493393 5.884884080912949e-05 -9.083498960108568e-05 5.884884080912949e-05 -0.002460489716291666" free_energy=-1643.9405041586333 pbc="F F F" Al 0.00440556 0.01711422 0.01978576 0.68975694 0.69761364 0.67246978 Al 2.04440371 2.01135502 0.00290548 -0.18516493 -0.15049609 0.01748708 Al 2.00085939 0.04170702 2.01370026 -0.08742957 -0.07072009 -0.14669257 Al 0.06698179 2.03577662 2.03655482 -0.15037710 -0.19100227 -0.21706173 Al 4.03449794 0.02753220 0.03351475 -0.09841056 0.34785689 0.34487297 Al 6.00606954 2.01776417 0.00821041 0.08013518 -0.14040256 -0.07473408 Al 5.98040207 0.01155110 2.02232288 0.12316891 -0.08417273 -0.15834154 Al 4.04171882 2.03176281 1.99658085 -0.13772885 -0.13425055 -0.03498331 Al 8.02154986 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