 Etot  =   -22864.676809
 Ekin  =    26888.768880
 Ecoul =     8717.226249
 Eenuc =   -58118.575457
 Exc   =     -352.096481
 1sP     -3493.058681
 2sP      -633.611229
 2pM      -609.596073
 2pP      -515.406573
 3sP      -154.914897
 3pM      -144.004598
 3pP      -122.745389
 3dM      -104.962720
 3dP      -100.465737
 4sP       -36.706499
 4pM       -31.912644
 4pP       -26.590779
 4dM       -18.805883
 4dP       -17.808159
 4fM        -7.614084
 4fP        -7.375613
 5sP        -7.133569
 5pM        -5.413091
 5pP        -4.318979
 5dM        -1.871103
 5dP        -1.726635
 6sP        -1.026983
 6pM        -0.630623
 6pP        -0.506089
