Ni 1.0000000000000000 1.2469311005714501 -2.1597480197275201 0.0000000000000000 1.2469311005714501 2.1597480197275201 0.0000000000000000 0.0000000000000000 0.0000000000000000 4.0737334884824401 Ni 2 Cartesian 1.2469311005714503 0.7199160065758545 1.0184333721206100 1.2469311005714503 -0.7199160065758544 3.0553001163618303