 Etot  =    -5462.390982
 Ekin  =     5459.099922
 Ecoul =     2233.419308
 Eenuc =   -13008.902423
 Exc   =     -146.007788
 1sD      -941.476646
 1su      -941.476646
 2sD      -136.832490
 2su      -136.832490
 2pD      -127.635120
 2pu      -127.635120
 3sD       -25.379908
 3su       -25.379908
 3pD       -21.637522
 3pu       -21.637522
 3dD       -14.685252
 3du       -14.685252
 4sD        -3.596069
 4su        -3.596069
 4pD        -2.395260
 4pu        -2.395260
 4dD        -0.470530
 4du        -0.470530
 5sD        -0.204228
 5su        -0.204228
