 Etot  =   -10826.504319
 Ekin  =    11734.604740
 Ecoul =     4202.648384
 Eenuc =   -26546.523611
 Exc   =     -217.233832
 1sP     -1764.658770
 2sP      -290.223959
 2pM      -275.652782
 2pP      -252.100937
 3sP       -64.056481
 3pM       -57.707247
 3pP       -52.903596
 3dM       -41.832014
 3dP       -40.781123
 4sP       -12.877544
 4pM       -10.418206
 4pP        -9.351633
 4dM        -5.282970
 4dP        -5.090810
 4fM        -0.354369
 4fP        -0.331519
 5sP        -1.868894
 5pM        -1.205724
 5pP        -1.065153
 6sP        -0.322088
