 Etot  =   -27129.338419
 Ekin  =    31664.960646
 Ecoul =    10129.726035
 Eenuc =   -68535.999440
 Exc   =     -388.025659
 1s      -4123.294750
 2s       -768.341688
 2p       -641.548753
 3s       -193.379441
 3p       -158.044242
 3d       -126.877024
 4s        -48.883171
 4p        -37.319404
 4d        -25.500768
 4f        -12.851259
 5s        -10.779842
 5p         -7.214495
 5d         -3.423649
 5f         -0.096740
 6s         -1.678553
 6p         -0.825890
 6d         -0.092540
 7s         -0.157960
