 Etot  =    -9601.626113
 Ekin  =    10188.064688
 Ecoul =     3711.957564
 Eenuc =   -23301.830073
 Exc   =     -199.818292
 1s      -1585.408073
 2s       -256.955995
 2p       -230.098416
 3s        -55.929177
 3p        -47.427501
 3d        -35.558798
 4s        -11.278946
 4p         -8.485965
 4d         -4.501637
 4f         -0.295057
 5s         -1.707745
 5p         -1.034395
 6s         -0.309862
