Thanks Rasmus.
My second question was about downloading a chemComp file with the coords already in so that e.g. the Molecule->Residue Information can display it. Whichever page we got the xml from (not the nicely formatted one at http://www.ebi.ac.uk/msd/NMR/chemCompXml/other_O.3.html) had links to two other files also that contain the coords. I guess these are the corina and cactvs files from the nice page above. Any way of combining one of these coord files into the main ChemComp for a compound?
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