1.ATOM      U                    21 CORE STATES
:1S 001: 1S               -8512.697009793 Ry
:2S 001: 2S               -1588.897009395 Ry
:2PP001: 2P*              -1531.627300207 Ry
:2P 001: 2P               -1250.140864546 Ry
:3S 001: 3S                -400.291706504 Ry
:3PP001: 3P*               -374.362583769 Ry
:3P 001: 3P                -309.501725813 Ry
:3DD001: 3D*               -268.634346478 Ry
:3D 001: 3D                -255.484566315 Ry
:4S 001: 4S                -101.220674038 Ry
:4PP001: 4P*                -89.557252458 Ry
:4P 001: 4P                 -72.647718542 Ry
:4DD001: 4D*                -54.129697881 Ry
:4D 001: 4D                 -51.022001537 Ry
:5S 001: 5S                 -21.665802720 Ry
:5PP001: 5P*                -17.146322169 Ry
:5P 001: 5P                 -13.145112658 Ry
:4FF001: 4F*                -26.694350171 Ry
:4F 001: 4F                 -25.884776576 Ry
:5DD001: 5D*                 -6.542576215 Ry
:5D 001: 5D                  -5.947730291 Ry

        2.ATOM      O                     1 CORE STATES
:1S 002: 1S                 -36.368838445 Ry