1.ATOM      Ni1                   5 CORE STATES
:1S 001: 1S                -602.470812550 Ry
:2S 001: 2S                 -71.147859502 Ry
:2PP001: 2P*                -61.932540239 Ry
:2P 001: 2P                 -60.647346347 Ry
:3S 001: 3S                  -7.183102550 Ry

        2.ATOM      O 1                   1 CORE STATES
:1S 002: 1S                 -36.665438440 Ry