you mean
unitcell [10 10 10 90 90 90]
?
Also some odd single and double quotes there.
On Fri, Nov 19, 2010 at 8:57 AM, pieremanuele canepa <[email protected]>wrote:
> Dear Bob,,
>
> can you check if this command works when the molecule comes as a Gaussian
> output?
>
>
> load '' {1 1 1} spacegroup "P-1' unitcell [ 10 10 10 90 90 ];unitcell.
>
> It works smoothly with pdb fies and xyz ones.
>
>
> Thanks Piero
>
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experiences on the web. Be a part of the beta today
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