 Etot  =   -10816.653877
 Ekin  =    10812.026730
 Ecoul =     4273.725204
 Eenuc =   -25670.165341
 Exc   =     -232.240470
 1s      -1728.625195
 2s       -275.363130
 2p       -262.081616
 3s        -60.764408
 3p        -54.836922
 3d        -43.754556
 4s        -11.986486
 4p         -9.669866
 4d         -5.531835
 4f         -0.489012
 5s         -1.608477
 5p         -0.978749
 5d         -0.127220
 6s         -0.143627
