 Etot  =   -13387.827982
 Ekin  =    13382.607422
 Ecoul =     5376.930340
 Eenuc =   -31875.082432
 Exc   =     -272.283312
 1sD     -2084.307451
 1su     -2084.307105
 2sD      -338.216276
 2su      -338.216071
 2pD      -323.415621
 2pu      -323.415422
 3sD       -75.713141
 3su       -75.713103
 3pD       -68.935205
 3pu       -68.935153
 3dD       -56.262967
 3du       -56.262880
 4sD       -14.549097
 4su       -14.548944
 4pD       -11.795321
 4pu       -11.795135
 4dD        -6.812157
 4du        -6.811889
 5sD        -1.922781
 5su        -1.920517
 5pD        -1.204685
 5pu        -1.200792
 4fD        -0.523957
 4fu        -0.523063
 6sD        -0.333456
 6su        -0.304908
