 Etot  =   -12936.786494
 Ekin  =    12931.649735
 Ecoul =     5196.611124
 Eenuc =   -30799.515253
 Exc   =     -265.532099
 1s      -2022.471608
 2s       -327.057120
 2p       -312.510608
 3s        -72.873753
 3p        -66.239338
 3d        -53.835494
 4s        -13.865665
 4p        -11.187151
 4d         -6.350307
 4f         -0.283120
 5s         -1.649990
 5p         -0.950748
 6s         -0.135953
