 Etot  =   -19518.993145
 Ekin  =    19512.662684
 Ecoul =     7781.994459
 Eenuc =   -46459.627742
 Exc   =     -354.022546
 1s      -2901.078061
 2s       -488.843335
 2p       -470.877785
 3s       -116.526852
 3p       -107.950391
 3d        -91.889924
 4s        -25.753330
 4p        -21.990564
 4d        -15.030026
 4f         -5.592532
 5s         -4.206797
 5p         -2.941657
 5d         -0.902393
 6s         -0.357187
 6p         -0.141831
