 Etot  =   -16285.988430
 Ekin  =    16280.221710
 Ecoul =     6516.155659
 Eenuc =   -38770.156644
 Exc   =     -312.209155
 1s      -2475.518489
 2s       -409.800873
 2p       -393.432631
 3s        -94.780096
 3p        -87.115816
 3d        -72.775827
 4s        -19.641394
 4p        -16.398525
 4d        -10.454889
 4f         -2.599967
 5s         -3.017495
 5p         -2.036775
 5d         -0.571223
 6s         -0.427041
