 Etot  =   -16801.430584
 Ekin  =    16795.582259
 Ecoul =     6719.261110
 Eenuc =   -39997.116139
 Exc   =     -319.157814
 1sD     -2544.042043
 1su     -2544.041241
 2sD      -422.442274
 2su      -422.434640
 2pD      -405.809026
 2pu      -405.802816
 3sD       -98.204603
 3su       -98.200482
 3pD       -90.389924
 3pu       -90.385829
 3dD       -75.767111
 3du       -75.761548
 4sD       -20.577881
 4su       -20.570262
 4pD       -17.250391
 4pu       -17.242309
 4dD       -11.141084
 4du       -11.131556
 4fD        -3.024638
 4fu        -3.011444
 5sD        -3.218332
 5su        -3.159393
 5pD        -2.195023
 5pu        -2.131068
 5dD        -0.646052
 5du        -0.574232
 6sD        -0.457865
 6su        -0.403312
