Re: [cclib-devel] problem of parsing clusters with large spin multiplicity

[Noel O'B. <bao...@gm...>]

Yes. It just took me some time to make the example test files.

On 30/10/2007, Karol Langner <kar...@kn...> wrote:
> Is this the bug you added to the tracker recently?
>
> On Wednesday 24 October 2007 11:12, Noel O'Boyle wrote:
> > Thanks for reporting this problem. I will fix this in cclib...
> >
> > In the meanwhile, just change the line:
> >  Charge =3D  0 Multiplicity =3D18
> > to...
> >  Charge =3D  0 Multiplicity =3D 18
> > by adding a space after the equals sign. It should work then.
> >
> > Noel
> >
> > On 24/10/2007, su...@yo... <su...@yo...> wrote:
> > > Dear Mr. O=B4Boyle.
> > >
> > >  I am having problem with parsing the output G03 file of rh_13 cluste=
rs
> > > by Gausssum, one of them is rh_13 with 2s+1=3D10, the other is Rh_13 =
with
> > > 2s+1=3D18, I attached the zipped output file and if you could take a =
look
> > > and give me some suggestion, I will greatly appreciate. Thank you for
> > > your help.
> > >
> > > All the best,
> > >
> > > Yan
>
> --
> written by Karol Langner
> Mon Oct 29 20:51:10 EDT 2007
>