(no subject)

[Sahasranaman Mahalakshmi]

    Dear Molpro users,

     I need your expert advise on this problem as I am stuck with it.
     I have a problem running a geometry optimization using MCSCF for B2Nanion.
     Its a singlet Sigma_{g}^{+} with configuration 1piu4 4sigmag2 3sigmau2
4sigmau0
     2piu0 as CAS. The error message is in MCSCF and its enclosed as an
attachment
     file named as b2n1.out and the input file is B2N.avdz.optgeom. Both files
are enclosed
     as an attachment.

     It writes

     Iter. MIC NCI NEG ENERGY(VAR) ENERGY CHANGE

     Extra symmetr y of MOS in symmetry 1 :
     Extra symmetry of MOS in Symmetry 5 :

     Extra symmetry of MOS in Symmetry 1 :
     Extra symmetry of MOS in Symmetry 5 :
    1  201  3  0  -103,80046484  NaN   NaN
    Not enough symmetry adapted P-space configurations found Last threhols tried

    1.60
    Eigenvalues of symmetry matrix
    Error Exit

   Please do help me as I am stuck with it. I am sorry to have disturbed you but
I have
   sent it to the mailing list last mid week itself but it has not been posted
to the
   mailing list still.

   Thanking You,
    Mahalakshmi