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=6.039788484270411 stress="-0.5419886913403185 0.013790811877026585 -0.06263231902963468 0.013790811877026585 -0.7856473867186972 0.007985655725929698 -0.06263231902963468 0.007985655725929698 -0.45707829429273633" pbc="F T F" Al 0.00082602 0.24624097 0.14302402 -5.99879871 0.60086394 -5.42614780 Al 1.35498893 1.42468589 0.20947124 5.87535521 -0.39051609 -5.35138628 Al 1.35512851 0.08558427 1.41333883 5.54762781 0.15736598 6.06321314 Al 0.15488783 1.45960515 1.20245745 -5.42418431 -0.36771384 4.71432094