If you check the log (see History at that link)...on May 16 2013: "Changed cifformat.cpp to output fractional coordinates" by Ronald Cohen. It would have been nice to have a option to support both maybe?
So it's in the dev version if you want to compile it yourself... - Noel On 13 August 2013 16:02, Patrick Fuller <patrickful...@gmail.com> wrote: > :-( > > > On Fri, Aug 9, 2013 at 5:29 PM, Patrick Fuller <patrickful...@gmail.com> > wrote: >> >> Hi all, >> >> I've noticed that cycling cif files through obabel does not preserve >> fractional coordinates. Namely, if I run >> >> obabel CoMOF74.cif -O cycled.cif >> >> the output coordinates are cartesian. The source reads like it should >> output fractional, but I can't figure out how to get that behavior working. >> Can anyone help? >> >> Thanks! >> Pat > > > > ------------------------------------------------------------------------------ > Get 100% visibility into Java/.NET code with AppDynamics Lite! > It's a free troubleshooting tool designed for production. > Get down to code-level detail for bottlenecks, with <2% overhead. > Download for free and get started troubleshooting in minutes. > http://pubads.g.doubleclick.net/gampad/clk?id=48897031&iu=/4140/ostg.clktrk > _______________________________________________ > OpenBabel-discuss mailing list > OpenBabel-discuss@lists.sourceforge.net > https://lists.sourceforge.net/lists/listinfo/openbabel-discuss > ------------------------------------------------------------------------------ Get 100% visibility into Java/.NET code with AppDynamics Lite! It's a free troubleshooting tool designed for production. Get down to code-level detail for bottlenecks, with <2% overhead. Download for free and get started troubleshooting in minutes. http://pubads.g.doubleclick.net/gampad/clk?id=48897031&iu=/4140/ostg.clktrk _______________________________________________ OpenBabel-discuss mailing list OpenBabel-discuss@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-discuss
