 Etot  =   -11244.450581
 Ekin  =    12036.249338
 Ecoul =     4348.405888
 Eenuc =   -27407.118473
 Exc   =     -221.987333
 1s      -1829.831855
 2s       -302.721627
 2p       -269.847692
 3s        -67.312298
 3p        -57.094515
 3d        -43.528024
 4s        -13.724606
 4p        -10.346487
 4d         -5.656606
 4f         -0.569032
 5s         -2.061685
 5p         -1.239219
 5d         -0.318230
 6s         -0.349965
