 Etot  =   -20090.414449
 Ekin  =    20083.999522
 Ecoul =     7989.999458
 Eenuc =   -47803.484105
 Exc   =     -360.929324
 1s      -2975.550959
 2s       -502.950758
 2p       -484.716359
 3s       -120.613998
 3p       -111.883393
 3d        -95.532476
 4s        -27.070340
 4p        -23.218641
 4d        -16.084817
 4f         -6.382744
 5s         -4.611934
 5p         -3.293637
 5d         -1.139408
 6s         -0.426129
 6p         -0.180198
