 Etot  =    -6469.046105
 Ekin  =     6807.128871
 Ecoul =     2586.194473
 Eenuc =   -15706.488195
 Exc   =     -155.881254
 1sP     -1106.483205
 2sP      -168.555568
 2pM      -157.911924
 2pP      -148.744620
 3sP       -33.043537
 3pM       -28.655649
 3pP       -26.963213
 3dM       -19.149581
 3dP       -18.796069
 4sP        -5.435757
 4pM        -3.945024
 4pP        -3.628270
 4dM        -1.261711
 4dP        -1.215797
 5sP        -0.479158
 5pM        -0.199446
 5pP        -0.176336
