Ni 1.0000000000000000 2.4858362020615683 0.0000000000000000 -0.0000000000000000 -1.2429181010307842 2.1527973006323444 0.0000000000000000 0.0000000000000000 0.0000000000000000 4.0775287880919224 Ni 2 Selective dynamics Cartesian -0.0000000124291811 1.4351982075975538 1.0193821970229806 T T T 1.2429180886016029 0.7175991073867728 3.0581465910689412 T T T