 Etot  =   -20090.112070
 Ekin  =    20083.717848
 Ecoul =     7965.697619
 Eenuc =   -47778.832411
 Exc   =     -360.695126
 1s      -2975.848322
 2s       -503.247222
 2p       -485.012951
 3s       -120.910218
 3p       -112.179641
 3d        -95.828713
 4s        -27.366348
 4p        -23.514648
 4d        -16.380804
 4f         -6.678701
 5s         -4.907088
 5p         -3.588638
 5d         -1.433137
 6s         -0.695853
 6p         -0.430506
