 Etot  =   -19572.039277
 Ekin  =    21893.543019
 Ecoul =     7594.228549
 Eenuc =   -48739.415505
 Exc   =     -320.395340
 1s      -3035.505153
 2s       -538.563629
 2p       -465.159286
 3s       -127.870661
 3p       -106.622314
 3d        -84.195815
 4s        -28.086349
 4p        -21.105095
 4d        -12.800533
 4f         -3.554327
 5s         -4.334810
 5p         -2.446106
 5d         -0.371655
 6s         -0.260552
