 Etot  =     -241.315573
 Ekin  =      240.663489
 Ecoul =      112.670733
 Eenuc =     -577.205757
 Exc   =      -17.444038
 1s        -55.156044
 2s         -3.934827
 2p         -2.564018
 3s         -0.286883
 3p         -0.102545
