 Etot  =     -761.577231
 Ekin  =      766.839303
 Ecoul =      314.430672
 Eenuc =    -1806.414445
 Exc   =      -36.432761
 1sP      -161.044031
 2sP       -17.612099
 2pM       -14.620256
 2pP       -14.450635
 3sP        -2.268098
 3pM        -1.505682
 3pP        -1.486731
 3dM        -0.377331
 3dP        -0.376103
 4sP        -0.365454
