864 Lattice="21.057458549598245 0.0 0.0 0.0 21.057458549598245 0.0 0.0 0.0 21.057458549598245" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2507.8649619662506 stress="-22.999645936781974 2.5814599695786598 8.009826696392906 2.5814599695786598 -30.17060034645489 26.31608596807761 8.009826696392906 26.31608596807761 -1.2234127013415446" pbc="F F F" H -0.03228780 0.00002813 0.02515509 0.48840790 0.36151143 0.42567204 Al 1.76601025 1.76952437 0.01407990 -0.90442503 0.65497119 -1.29528405 Ni 1.77904580 0.01608817 1.72727955 -0.68529053 0.54446507 0.58623235 Al 0.00031207 1.81566350 1.73873430 0.09008603 -0.20207326 0.89109183 Al 3.51902523 0.02254478 0.01013434 -0.64863747 -1.74388952 -1.39971078 Al 5.28619364 1.76786056 -0.01993758 1.15889631 1.26350662 -0.52116489 Al 5.26390264 0.00056574 1.73553873 2.36304160 -1.22220781 0.56234217 Al 3.51566592 1.74782509 1.74665433 -0.47779952 2.06775086 0.70214845 H 6.98534886 -0.02054632 -0.00254605 0.01531051 0.01560891 0.00056745 Al 8.74158896 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