 Etot  =    -3329.525142
 Ekin  =     3326.989782
 Ecoul =     1384.663406
 Eenuc =    -7937.250826
 Exc   =     -103.927504
 1sD      -605.630296
 1su      -605.630355
 2sD       -81.788453
 2su       -81.786362
 2pD       -74.802287
 2pu       -74.800732
 3sD       -12.991310
 3su       -12.989836
 3pD       -10.399089
 3pu       -10.397473
 3dD        -5.670962
 3du        -5.668732
 4sD        -1.702817
 4su        -1.688259
 4pD        -1.031230
 4pu        -1.014616
 4dD        -0.116558
 4du        -0.098390
 5sD        -0.155925
 5su        -0.144191
