 Etot  =   -24353.613380
 Ekin  =    24346.641384
 Ecoul =     9465.142776
 Eenuc =   -57755.780448
 Exc   =     -409.617093
 1s      -3524.646974
 2s       -608.558437
 2p       -588.425608
 3s       -152.287294
 3p       -142.463362
 3d       -124.053913
 4s        -38.021620
 4p        -33.532776
 4d        -25.162699
 4f        -13.604909
 5s         -8.494260
 5p         -6.789967
 5d         -3.832740
 6s         -1.539654
 6p         -1.052152
 6d         -0.369420
 7s         -0.304886
