Hi all, I am newbie in handling cif files. I have a very basic questions: Q1) I can convert .cif file to xyz using babel but i see that the molecules are broken. I saw earlier posts of using command
babel 1100654.cif -O file.xyz --fillUC keepconnect, so that atoms are connect outside of unit cell or by using "strict" atoms remain inside the unitcell. My Question is can I convert .cif to xyz without broken ends and translate it by 3*3*3. Could you suggest how to do this in babel. Thanks & Regards, Mohan -- View this message in context: http://forums.openbabel.org/CIF-file-to-xyz-without-broken-ends-tp4658902.html Sent from the openbabel-devel mailing list archive at Nabble.com. ------------------------------------------------------------------------------ _______________________________________________ OpenBabel-Devel mailing list OpenBabel-Devel@lists.sourceforge.net https://lists.sourceforge.net/lists/listinfo/openbabel-devel