Subject: Re: CCL:G:A (silly) problem with G94

From: [email-masked] (Per-Ola Norrby)
Date: Thu, 30 Jan 1997 11:46:50 +0100

>  QPERR --- A SYNTAX ERROR WAS DETECTED IN THE INPUT LINE.
> #P UB3PW91/6-31G* OPT=ADDREDUNDANT SCF=D
>                       '
> Last state="OPT1"
> TCursr= 4052 LCursr=  22
>
>What is wrong about using AddRedundant? Isn't it a perfectly legitimate
>keyword?

        Hi,

        I experienced EXACTLY the same problem.  I guess it's a bug, but
there's a very easy workaround: truncate it.  I always use OPT=AddR , that
works perfectly.

        Regards,

        Per-Ola Norrby

^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^^
 *  Per-Ola Norrby, Associate Professor
 *  The Royal Danish School of Pharmacy, Dept. of Med. Chem.
 *  Universitetsparken 2, DK 2100 Copenhagen, Denmark
 *  tel. +45-35376777-506, +45-35370850    fax +45-35372209
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