[Wien] cif2struct

eagle ying leithron at gmail.com
Mon Apr 7 03:50:41 CEST 2014


after delete the corresponding line, it turns out to be recond 48,component
1. it seemed to be a whole format problem.
2014-4-4 下午1:43于 "Rocquefelte" <Xavier.Rocquefelte at cnrs-imn.fr>写道:

>  Another way to proceed is to remove this line.
> In many cases it works!
>
> Cheers
>
> Xavier
>
>
> Le 04/04/2014 05:11, Laurence Marks a écrit :
>
> It is a bad cif file. Probably you want to go back to wherever you found
> it and try for a better copy. Or download a standard cif reader and edit it.
>
> ______________________________
> Laurence Marks
> Dept Mat Sci & Eng
> Northwestern University
> www.numis.northwestern.edu
> 847 491 3996
> On Apr 3, 2014 9:51 PM, "leithron at gmail.com" <leithron at gmail.com> wrote:
>
>>  dear users:
>>       while I try to convert a cif file to structfile, an error came out:
>> wrong syntax in _symmetry_equiv_pos_as_xyz: record 49 component 2. Is there
>> any means to fix this?
>>
>>
>>
>
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