 Etot  =    -6466.717310
 Ekin  =     6744.724295
 Ecoul =     2566.629662
 Eenuc =   -15622.758079
 Exc   =     -155.313188
 1s      -1107.603947
 2s       -169.041791
 2p       -152.046010
 3s        -33.391386
 3p        -27.826720
 3d        -19.274990
 4s         -5.755573
 4p         -4.043412
 4d         -1.549107
 5s         -0.768573
 5p         -0.449293
