108 Lattice="12.717798682956456 0.0 0.0 0.0 12.717798682956456 0.0 0.0 0.0 12.717798682956456" Properties=species:S:1:pos:R:3:forces:R:3 energy=-292.74843718204676 stress="0.05372064108944862 4.366616892333676e-05 -0.0007952232473215885 4.366616892333676e-05 0.053642591120475626 -0.00033541625523338895 -0.0007952232473215885 -0.00033541625523338895 0.054469948597469085" free_energy=-292.74843718204676 pbc="F F F" Al 0.03002756 0.01422675 0.02213867 0.44216153 0.50172047 0.44243757 Al 2.12692472 2.19344918 0.07003744 0.02286251 -0.01517914 0.53974514 Al 2.05776312 0.07099220 2.13054987 0.23296060 0.51205243 0.06492399 Al 0.04878572 2.13880955 2.19145840 0.43195210 0.01304124 -0.08487919 Al 4.20362723 0.08364614 0.07481816 -0.00541296 0.56069688 0.56612964 Al 6.44330135 2.01546423 0.01368610 -0.13095795 0.28093703 0.35373220 Al 6.41453347 0.05645268 2.03693948 -0.08290174 0.38828668 0.26797218 Al 4.28177512 2.19367913 2.05392717 -0.21036446 -0.18792402 0.12674978 Al 8.55361740 0.06559008 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