 Etot  =   -14527.703165
 Ekin  =    15821.307395
 Ecoul =     5681.854107
 Eenuc =   -35766.152630
 Exc   =     -264.712037
 1s      -2309.064571
 2s       -393.805118
 2p       -347.042320
 3s        -89.521821
 3p        -75.452119
 3d        -58.481347
 4s        -18.052193
 4p        -13.423489
 4d         -7.366286
 4f         -0.696705
 5s         -2.569851
 5p         -1.491257
 6s         -0.414003
