Ni 1.0000000000000000 2.4693467521057539 0.0000000000000000 0.0000000000000000 -1.2346733760528770 2.1385170180761786 0.0000000000000000 0.0000000000000000 -0.0000000000000000 4.0145325769236342 Ni 2 Selective dynamics Cartesian -0.0000000123467339 1.4256780191791760 1.0036331442309083 T T T 1.2346733637061436 0.7128390131537830 3.0108994326927245 T T T