 Etot  =   -15566.119096
 Ekin  =    17045.050226
 Ecoul =     6096.568291
 Eenuc =   -38430.737576
 Exc   =     -277.000037
 1s      -2459.123938
 2s       -423.002342
 2p       -371.295553
 3s        -96.934771
 3p        -81.517705
 3d        -63.446841
 4s        -19.731564
 4p        -14.661077
 4d         -8.149694
 4f         -0.924736
 5s         -2.677212
 5p         -1.450266
 5d         -0.139951
 6s         -0.205362
