 Etot  =   -10816.420381
 Ekin  =    10811.808161
 Ecoul =     4259.301541
 Eenuc =   -25655.441102
 Exc   =     -232.088981
 1s      -1728.854049
 2s       -275.591167
 2p       -262.309723
 3s        -60.992235
 3p        -55.064763
 3d        -43.982393
 4s        -12.214348
 4p         -9.897725
 4d         -5.759667
 4f         -0.716631
 5s         -1.835634
 5p         -1.205229
 5d         -0.340887
 6s         -0.327016
