 Etot  =   -23555.874800
 Ekin  =    27839.097311
 Ecoul =     8951.318617
 Eenuc =   -59987.996223
 Exc   =     -358.294505
 1sP     -3591.262329
 2sP      -654.293231
 2pM      -629.734142
 2pP      -530.095111
 3sP      -160.800822
 3pM      -149.639944
 3pP      -127.075780
 3dM      -108.959739
 3dP      -104.207744
 4sP       -38.564411
 4pM       -33.640710
 4pP       -27.955826
 4dM       -19.978867
 4dP       -18.914099
 4fM        -8.450449
 4fP        -8.191939
 5sP        -7.696701
 5pM        -5.905405
 5pP        -4.706453
 5dM        -2.138982
 5dP        -1.976010
 6sP        -1.132076
 6pM        -0.700457
 6pP        -0.553814
