[Wien] sgroup problem

[Victor Shaposhnikov]

> What is the possible reason? could you please take a look of the attached
> case.strut file and let me know how to fix it?
if you run sgroup from command line, you can see the error message. In
you case:
Error: duplicated atoms found! Atoms #1 and #6 coincide.

You  should  check  the  coordinates  of  Al  atoms, perhaps, they are
entered twice, or you didn't change z component.

-- 
Best regards,
Victor Shaposhnikov