4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1.1821886710479705 stress="-25.956684195511045 0.5259894679897037 -2.2208908492678745 0.5259894679897037 -24.990934217297088 0.48732513162881297 -2.2208908492678745 0.48732513162881297 -25.75304431014848" pbc="F F F" Al -0.14801295 -0.02432459 0.06329927 -10.67437131 -7.55967958 -10.32267495 Al 1.43745442 1.27846858 -0.00548572 7.07154374 9.38510832 -7.88487206 Al 1.34126820 -0.15859300 1.31668137 10.20148464 -10.75124689 9.48795988 Al -0.08013605 1.24396547 1.59073906 -6.59865706 8.92581815 8.71958714