 Etot  =    -6914.378893
 Ekin  =     6910.730924
 Ecoul =     2747.899152
 Eenuc =   -16402.669722
 Exc   =     -170.339249
 1sD     -1162.139997
 1su     -1162.137277
 2sD      -175.424416
 2su      -175.422926
 2pD      -164.955025
 2pu      -164.952790
 3sD       -35.593716
 3su       -35.591179
 3pD       -31.181614
 3pu       -31.178865
 3dD       -22.951140
 3du       -22.948588
 4sD        -6.466010
 4su        -6.460394
 4pD        -4.922825
 4pu        -4.916595
 4dD        -2.289023
 4du        -2.279643
 5sD        -0.936498
 5su        -0.891289
 5pD        -0.589796
 5pu        -0.545300
