 Etot  =    -3751.036938
 Ekin  =     3748.367646
 Ecoul =     1542.552647
 Eenuc =    -8929.288689
 Exc   =     -112.668541
 1sD      -673.983456
 1su      -673.983647
 2sD       -92.965082
 2su       -92.952210
 2pD       -85.495051
 2pu       -85.485336
 3sD       -15.617537
 3su       -15.608590
 3pD       -12.777058
 3pu       -12.767245
 3dD        -7.565454
 3du        -7.552119
 4sD        -2.294127
 4su        -2.221396
 4pD        -1.511094
 4pu        -1.432504
 4dD        -0.382983
 4du        -0.300046
