 Etot  =    -9216.171403
 Ekin  =     9758.787593
 Ecoul =     3574.336016
 Eenuc =   -22354.745678
 Exc   =     -194.549335
 1s      -1527.326295
 2s       -246.039228
 2p       -220.506156
 3s        -53.090791
 3p        -44.972935
 3d        -33.503301
 4s        -10.535271
 4p         -7.874737
 4d         -4.056262
 4f         -0.056593
 5s         -1.433017
 5p         -0.790223
 6s         -0.131564
