 Etot  =   -24353.832231
 Ekin  =    24346.845656
 Ecoul =     9483.654939
 Eenuc =   -57774.567583
 Exc   =     -409.765243
 1s      -3524.439052
 2s       -608.350958
 2p       -588.218112
 3s       -152.079741
 3p       -142.255810
 3d       -123.846396
 4s        -37.814094
 4p        -33.325252
 4d        -24.955184
 4f        -13.397389
 5s         -8.287057
 5p         -6.582810
 5d         -3.625729
 6s         -1.333769
 6p         -0.846921
 6d         -0.172896
 7s         -0.135872
