Ah, sure. I missed that. This means you are up late on a Friday night.
Hmm....
2010/12/17 Angel Herráez <angel.herr...@uah.es>
> (Sorry I sent this to the wrong thread: localizations)
>
> Bob, the month is wrong (zero-based)
> __Jmol-12_11181000533D 1 1.00000 0.00000 0
> should be
> __Jmol-12_12181000533D 1 1.00000 0.00000 0
>
> That's why I added one
> 1+ c.get(Calendar.MONTH)
>
>
> Also, I think the position of the decimal point in XYZ for MOL2000 and
> SDF is wrong by one
>
> xxxxx.xxxxyyyyy.yyyyzzzzz.zzzz aaaddcccssshhhbbbvvvHHHrrriiimmm...
> 2.03475 -1.57247 -0.91833 C 0 0 0 0 0 0
>
>
> V3000 support is a great thing! (not that I need it :-)
>
>
>
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--
Robert M. Hanson
Professor of Chemistry
St. Olaf College
1520 St. Olaf Ave.
Northfield, MN 55057
http://www.stolaf.edu/people/hansonr
phone: 507-786-3107
If nature does not answer first what we want,
it is better to take what answer we get.
-- Josiah Willard Gibbs, Lecture XXX, Monday, February 5, 1900
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