SA-CASSCF for states with different symmetry

Subject:

if B is 1s22s22p1, what is Li?

Passfield:

Comments:
: Hello, : Does anyone know if does exist a way to calculate SA-CASSCF function for two states belonging to different spatial symmetries without decreasing symmetry of the whole molecule and use such wavefunction for geometry optimization? For now the only solution seems to be decrease of molecule symmetry and define coordinates in slapaf to enforce higher symmetry. : Thanks in advance, : Mariusz