 Etot  =    -3129.453161
 Ekin  =     3126.990706
 Ecoul =     1308.954372
 Eenuc =    -7465.641817
 Exc   =      -99.756422
 1sD      -572.870169
 1su      -572.870169
 2sD       -76.491823
 2su       -76.491823
 2pD       -69.745941
 2pu       -69.745941
 3sD       -11.771585
 3su       -11.771585
 3pD        -9.301863
 3pu        -9.301863
 3dD        -4.813498
 3du        -4.813498
 4sD        -1.455317
 4su        -1.455317
 4pD        -0.844489
 4pu        -0.844489
 5sD        -0.131793
 5su        -0.131793
