 Etot  =   -18366.632397
 Ekin  =    20412.559146
 Ecoul =     7152.388812
 Eenuc =   -45623.668053
 Exc   =     -307.912303
 1s      -2862.466310
 2s       -503.415250
 2p       -436.988473
 3s       -118.306156
 3p        -98.921767
 3d        -77.824850
 4s        -25.393016
 4p        -19.021554
 4d        -11.261688
 4f         -2.603179
 5s         -3.736270
 5p         -2.061800
 5d         -0.235132
 6s         -0.217611
