 Etot  =   -10402.785325
 Ekin  =    11085.536719
 Ecoul =     4027.550621
 Eenuc =   -25304.962699
 Exc   =     -210.909966
 1s      -1704.921317
 2s       -279.157230
 2p       -249.443172
 3s        -61.350724
 3p        -52.029193
 3d        -39.333564
 4s        -12.350353
 4p         -9.278037
 4d         -4.952484
 4f         -0.329243
 5s         -1.817427
 5p         -1.083723
 6s         -0.318163
