 Etot  =   -21860.912366
 Ekin  =    21854.264276
 Ecoul =     8603.130249
 Eenuc =   -51936.694235
 Exc   =     -381.612655
 1sD     -3205.099181
 1su     -3205.098338
 2sD      -546.919586
 2su      -546.919164
 2pD      -527.874920
 2pu      -527.874276
 3sD      -133.710381
 3su      -133.709849
 3pD      -124.514178
 3pu      -124.513571
 3dD      -107.286323
 3du      -107.285757
 4sD       -31.571784
 4su       -31.570847
 4pD       -27.449988
 4pu       -27.449002
 4dD       -19.790996
 4du       -19.789974
 4fD        -9.294310
 4fu        -9.293252
 5sD        -6.229753
 5su        -6.227190
 5pD        -4.748647
 5pu        -4.745792
 5dD        -2.250891
 5du        -2.246258
 6sD        -0.949459
 6su        -0.929994
 6pD        -0.599678
 6pu        -0.580343
