1.ATOM Np1 21 CORE STATES :1S 001: 1S -8740.976681409 Ry :2S 001: 2S -1638.418701227 Ry :2PP001: 2P* -1579.875887733 Ry :2P 001: 2P -1282.783548570 Ry :3S 001: 3S -414.434864089 Ry :3PP001: 3P* -387.931881061 Ry :3P 001: 3P -319.276571074 Ry :3DD001: 3D* -277.697404329 Ry :3D 001: 3D -263.862555365 Ry :4S 001: 4S -105.687412037 Ry :4PP001: 4P* -93.727825100 Ry :4P 001: 4P -75.729568814 Ry :4DD001: 4D* -56.801474206 Ry :4D 001: 4D -53.504845978 Ry :5S 001: 5S -22.951013091 Ry :5PP001: 5P* -18.276180787 Ry :5P 001: 5P -13.956027631 Ry :4FF001: 4F* -28.621418568 Ry :4F 001: 4F -27.754159053 Ry :5DD001: 5D* -7.128862341 Ry :5D 001: 5D -6.484668577 Ry 2.ATOM Co1 4 CORE STATES :1S 002: 1S -556.814667378 Ry :2S 002: 2S -64.901157749 Ry :2PP002: 2P* -56.147906119 Ry :2P 002: 2P -55.058254371 Ry 3.ATOM Ga1 5 CORE STATES :1S 003: 1S -750.738805125 Ry :2S 003: 2S -91.795647930 Ry :2PP003: 2P* -81.149917751 Ry :2P 003: 2P -79.117227972 Ry :3S 003: 3S -9.931695178 Ry 4.ATOM Ga2 5 CORE STATES CORE-FORCE in mRy/a.u. = |F| Fx Fy Fz :FCO004: 4.ATOM 152.409 0.000 0.000 152.409 :1S 004: 1S -750.751869067 Ry :2S 004: 2S -91.808603012 Ry :2PP004: 2P* -81.162865826 Ry :2P 004: 2P -79.130176618 Ry :3S 004: 3S -9.945362512 Ry