 Etot  =   -18403.943001
 Ekin  =    18397.797336
 Ecoul =     7350.679007
 Eenuc =   -43812.305927
 Exc   =     -340.113417
 1s      -2755.329777
 2s       -461.584280
 2p       -444.154385
 3s       -108.903989
 3p       -100.634090
 3d        -85.151394
 4s        -23.529187
 4p        -19.942443
 4d        -13.325438
 4f         -4.416525
 5s         -3.730550
 5p         -2.569262
 5d         -0.756766
 6s         -0.462613
