 Etot  =   -20826.937914
 Ekin  =    23456.695435
 Ecoul =     8004.624000
 Eenuc =   -51955.883807
 Exc   =     -332.373541
 1s      -3216.149825
 2s       -576.071304
 2p       -494.971135
 3s       -138.583105
 3p       -115.287794
 3d        -91.458233
 4s        -31.568084
 4p        -23.918281
 4d        -15.041903
 4f         -5.199117
 5s         -5.567634
 5p         -3.436175
 5d         -1.068883
 6s         -0.717507
 6p         -0.372662
