 Etot  =    -1939.453568
 Ekin  =     1973.731946
 Ecoul =      838.823760
 Eenuc =    -4681.147880
 Exc   =      -70.861393
 1sP      -373.967124
 2sP       -46.182210
 2pM       -40.966245
 2pP       -39.956917
 3sP        -5.403079
 3pM        -3.710005
 3pP        -3.576816
 3dM        -0.724702
 3dP        -0.707694
 4sP        -0.336354
 4pM        -0.103490
 4pP        -0.099023
