 Etot  =    -5870.165899
 Ekin  =     6151.216822
 Ecoul =     2369.191647
 Eenuc =   -14243.954925
 Exc   =     -146.619443
 1sP     -1013.478020
 2sP      -151.913035
 2pM      -141.873435
 2pP      -134.194416
 3sP       -28.820727
 3pM       -24.735818
 3pP       -23.347867
 3dM       -16.062048
 3dP       -15.776264
 4sP        -4.373328
 4pM        -3.032017
 4pP        -2.786227
 4dM        -0.708225
 4dP        -0.676442
 5sP        -0.310718
 5pM        -0.107222
 5pP        -0.095610
