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:Z:I:1:forces:R:3 energy=-3.985803305943881 pbc="T F T" H -0.13842715 0.28460712 -0.01643439 1 -0.15184163 -5.16080656 -0.91945143 Al 1.26772449 1.27715687 -0.16418421 13 -1.34418392 3.69323322 -9.67665539 Ni 1.22500719 -0.17256882 1.29546282 28 -0.32450379 -6.23615088 0.73707425 Al -0.29059379 1.61893942 0.96198923 13 1.82052934 7.70372421 9.85903258