 Etot  =    -9997.190870
 Ekin  =    10630.290532
 Ecoul =     3867.227788
 Eenuc =   -24289.390719
 Exc   =     -205.318472
 1s      -1644.528283
 2s       -267.921201
 2p       -239.671082
 3s        -58.609785
 3p        -49.707171
 3d        -37.429896
 4s        -11.811529
 4p         -8.881333
 4d         -4.727968
 4f         -0.313831
 5s         -1.762908
 5p         -1.059587
 6s         -0.314071
