 Etot  =    -8917.458395
 Ekin  =     8913.309005
 Ecoul =     3495.795333
 Eenuc =   -21124.288658
 Exc   =     -202.274074
 1s      -1457.552000
 2s       -227.639668
 2p       -215.631707
 3s        -49.137596
 3p        -43.905181
 3d        -34.126712
 4s         -9.790245
 4p         -7.825942
 4d         -4.367138
 4f         -0.367585
 5s         -1.508969
 5p         -0.989774
 6s         -0.290789
