864 Lattice="24.759849036154854 0.0 0.0 0.0 24.759849036154854 0.0 0.0 0.0 24.759849036154854" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1939.6869175403228 stress="-0.0018249003015760672 7.905033286173405e-05 0.00011193905979498872 7.905033286173405e-05 -0.001871237912651791 4.735476973044203e-05 0.00011193905979498872 4.735476973044203e-05 -0.0019541037269345117" pbc="F F F" Al 0.01290566 0.01148843 0.02540969 -0.33572828 -0.40188121 -0.42797239 Al 2.06809842 2.06311217 0.02125563 0.35115263 0.51385458 -0.76264034 Al 2.06546026 0.01259523 2.05622254 0.36524032 -0.75683005 0.51555097 Al 0.01313569 2.02241112 2.04259426 -0.81253307 0.59212026 0.41687112 Al 4.08796997 0.02034182 0.01420500 0.27242728 -0.38723468 -0.38634321 Al 6.20926576 2.08209441 0.04027506 -0.06270536 0.12939963 -0.66562143 Al 6.20197427 0.02167809 2.09143230 -0.07181673 -0.50312663 0.25488196 Al 4.12129562 2.10140331 2.10088562 0.16161548 0.31254576 0.39493778 Al 8.27404475 0.03687540 0.04103522 -0.10021154 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