 Etot  =    -8839.998524
 Ekin  =     9341.545144
 Ecoul =     3407.680347
 Eenuc =   -21400.358030
 Exc   =     -188.865985
 1s      -1471.069068
 2s       -235.981513
 2p       -211.705165
 3s        -50.941808
 3p        -43.190697
 3d        -32.107343
 4s        -10.409939
 4p         -7.871310
 4d         -4.203837
 4f         -0.356886
 5s         -1.638153
 5p         -1.005114
 5d         -0.272521
