 Etot  =    -7228.388753
 Ekin  =     7224.656455
 Ecoul =     2861.406715
 Eenuc =   -17139.064033
 Exc   =     -175.387889
 1s      -1209.061750
 2s       -183.698356
 2p       -172.970726
 3s        -37.785274
 3p        -33.236929
 3d        -24.748179
 4s         -7.045852
 4p         -5.431089
 4d         -2.652978
 5s         -1.010265
 5p         -0.630708
