500 Lattice="21.19633113826076 0.0 0.0 0.0 21.19633113826076 0.0 0.0 0.0 21.19633113826076" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1469.24138849026 stress="0.05493250218250231 -9.920970953990646e-05 0.00015032246426898533 -9.920970953990646e-05 0.05496602448963789 -5.910505727809688e-05 0.00015032246426898533 -5.910505727809688e-05 0.05516638789606218" free_energy=-1469.24138849026 pbc="F F F" Al 0.01107883 0.05941618 0.00151894 0.49526862 0.41282184 0.43156138 Al 2.04323941 2.17032450 0.02379357 0.35494637 -0.24262516 0.49907282 Al 2.10622265 0.02225066 2.18706998 0.08417305 0.55232096 -0.09267310 Al 0.04198196 2.07582419 2.07708847 0.50929639 0.12282051 0.25701933 Al 4.13799424 0.01011086 0.01605446 0.01586812 0.71264348 0.68728406 Al 6.38781529 2.08969294 0.00846332 -0.11996333 -0.01015343 0.62596558 Al 6.32690641 0.04175921 2.19668728 0.10337594 0.52934369 -0.19109717 Al 4.24838248 2.05590087 2.15074444 -0.09324041 0.09266653 -0.13129779 Al 8.40333144 0.04821716 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