 Etot  =   -18956.753577
 Ekin  =    18950.523271
 Ecoul =     7555.654594
 Eenuc =   -45115.952945
 Exc   =     -346.978498
 1s      -2827.835307
 2s       -475.218422
 2p       -457.521139
 3s       -112.787142
 3p       -104.364276
 3d        -88.593240
 4s        -24.736426
 4p        -21.061992
 4d        -14.273746
 4f         -5.100632
 5s         -4.076394
 5p         -2.863658
 5d         -0.938401
 6s         -0.522606
