 Etot  =   -16650.577607
 Ekin  =    18337.336418
 Ecoul =     6503.419447
 Eenuc =   -41202.161483
 Exc   =     -289.171990
 1s      -2615.689247
 2s       -454.034449
 2p       -396.870146
 3s       -105.159090
 3p        -88.264454
 3d        -69.032405
 4s        -21.914597
 4p        -16.359352
 4d         -9.367961
 4f         -1.575737
 5s         -3.127489
 5p         -1.730506
 5d         -0.205868
 6s         -0.225105
