 Etot  =   -10409.955229
 Ekin  =    11251.853950
 Ecoul =     4036.598960
 Eenuc =   -25486.885407
 Exc   =     -211.522732
 1sP     -1703.102666
 2sP      -278.741959
 2pM      -264.518287
 2pP      -242.605435
 3sP       -61.259667
 3pM       -55.083730
 3pP       -50.644335
 3dM       -39.850314
 3dP       -38.880918
 4sP       -12.332265
 4pM        -9.957796
 4pP        -8.976896
 4dM        -5.050003
 4dP        -4.874058
 4fM        -0.340271
 4fP        -0.320206
 5sP        -1.814749
 5pM        -1.175196
 5pP        -1.044439
 6sP        -0.318063
