Ni 1.0000000000000000 2.4919121596827170 0.0000000000000000 0.0000000000000000 -1.2459560798413585 2.1580592342845772 -0.0000000000000000 0.0000000000000000 0.0000000000000000 4.1117982006786740 Ni 2 Selective dynamics Cartesian -0.0000000124595610 1.4387061633832487 1.0279495501696683 T T T 1.2459560673817971 0.7193530852883899 3.0838486505090050 T T T