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=9.097624649844848 pbc="T T T" H 0.09995250 0.26120756 0.01193751 1 10.96813947 -15.09721102 -44.97798543 H 1.00226748 0.71431997 0.04396501 1 5.96739647 8.41474534 -13.57430140 Ni 0.82236142 0.20379337 0.98854596 28 5.29224631 -10.60538620 20.58447311 Ni -0.23077820 0.53229695 0.77031036 28 -22.22778225 17.28785188 37.96781373