 Etot  =    -7769.226699
 Ekin  =     8162.016491
 Ecoul =     3030.174906
 Eenuc =   -18787.188866
 Exc   =     -174.229230
 1s      -1307.989649
 2s       -205.618939
 2p       -184.774638
 3s        -42.908994
 3p        -36.173245
 3d        -26.219085
 4s         -8.246218
 4p         -6.084588
 4d         -2.926880
 5s         -1.180083
 5p         -0.691810
