Ni 1.0000000000000000 2.4865046835907867 0.0000000000000000 0.0000000000000000 -1.2432523417953933 2.1533762226186077 0.0000000000000000 0.0000000000000000 -0.0000000000000000 4.0831453744082866 Ni 2 Selective dynamics Cartesian -0.0000000124325235 1.4355841555903259 1.0207863436020717 T T T 1.2432523293628699 0.7177920813841234 3.0623590308062152 T T T