 Etot  =   -11222.941975
 Ekin  =    11218.204349
 Ecoul =     4461.481521
 Eenuc =   -26663.609136
 Exc   =     -239.018708
 1s      -1785.331942
 2s       -285.121013
 2p       -271.590585
 3s        -62.851563
 3p        -56.785113
 3d        -45.443863
 4s        -12.120486
 4p         -9.735637
 4d         -5.467662
 4f         -0.256311
 5s         -1.513669
 5p         -0.887230
 6s         -0.131677
