16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-30.117000781260526 stress="0.00017152678561026662 4.81258784839883e-05 -1.079727913375053e-05 4.81258784839883e-05 0.0001395797332373936 4.469253227198246e-05 -1.079727913375053e-05 4.469253227198246e-05 0.00015349334804498301" pbc="F F F" H 21.19883905 20.71743399 21.11353405 0.43489986 0.30398229 0.22966055 Al 22.24487798 22.50047313 22.27516603 0.46029232 -0.45607169 -0.54971337 Ni 23.70330445 20.77975412 20.74840012 -0.67723463 1.11614699 1.07186635 H 25.74217457 22.67041836 22.41002132 -0.30961755 0.16563355 -0.00673516 Ni 20.73324064 24.12324216 21.24667518 1.09629438 -0.22651669 0.55798195 Al 22.61478237 25.21621014 22.51898074 -1.23752632 1.13659957 -1.78283585 Ni 24.16613401 24.10869014 20.87889363 -0.62723566 -0.35296922 1.65356415 Al 25.57165922 25.59020594 22.63918523 -0.95420900 -0.81468698 0.40213950 Ni 20.95677659 21.15050642 23.83542991 1.34069767 0.74091606 0.01765341 H 22.01996094 22.01905762 25.38979497 -0.18947324 -0.27478156 -0.49530463 Al 24.00239915 21.04278917 24.23520322 -0.70217667 1.15146417 -0.60981098 H 25.74421963 22.59176916 25.56487656 -0.53233448 0.28478130 -0.42516095 H 21.04283024 24.08055670 23.98245851 -0.11785465 -0.01176792 -0.03404252 Al 22.22164374 25.20763472 25.39856145 0.60551272 -0.08791721 -0.36582317 Al 23.78901754 23.98006896 23.91147823 2.22263895 -2.10962627 1.41608891 Ni 25.27999011 25.40686888 25.33596086 -0.81267370 -0.56518640 -1.07952817