 Etot  =   -13054.819994
 Ekin  =    14107.792222
 Ecoul =     5097.746242
 Eenuc =   -32014.028561
 Exc   =     -246.329898
 1s      -2095.004265
 2s       -352.593466
 2p       -312.380888
 3s        -79.209531
 3p        -66.941770
 3d        -51.507857
 4s        -15.790620
 4p        -11.745091
 4d         -6.308156
 4f         -0.373129
 5s         -2.150054
 5p         -1.219006
 6s         -0.342062
