108 Lattice="11.852258609331203 0.0 0.0 0.0 11.852258609331203 0.0 0.0 0.0 11.852258609331203" Properties=species:S:1:pos:R:3:forces:R:3 energy=-332.82885542503226 stress="-0.003158533542545301 -3.2498216867816815e-05 0.00017272601051332868 -3.2498216867816815e-05 -0.0030467671034959272 0.00035268189386988846 0.00017272601051332868 0.00035268189386988846 -0.003145419758548028" free_energy=-332.82885542503226 pbc="F F F" Al 0.01324400 0.03738506 0.03890861 0.45667533 0.46247978 0.45941561 Al 1.93790657 1.96403424 0.00771311 -0.01358468 -0.01066469 -0.34807689 Al 1.94952480 0.01986426 1.94559360 -0.11225105 -0.30129398 0.01546507 Al 0.01320809 2.01060601 1.94022877 -0.38647506 -0.16883252 -0.02958863 Al 3.89124958 0.01314322 0.03810170 0.03186651 0.22233490 0.16881369 Al 5.93135109 1.98106113 0.02847774 0.04618456 -0.10539956 -0.27038135 Al 5.90227968 0.01621207 1.97186658 0.05281638 -0.29269526 -0.15069543 Al 3.89747233 2.00441992 1.97171593 0.16119821 -0.20358919 -0.10561409 Al 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