On 29/11/10 12:37, Mirek Gilski wrote:
Hi All,
I found a small but significant bug in Coot and WinCoot.
It is giving a wrong translation for symmetry related atoms.
I tested it on SO4 anion (S is on two fold axis); two symmetry related O atoms
should be generated by
symmetry: -y, -x, -z+1/2 plus translation (110) - space group P 43 21 2 .
Everything is ok, oxygen atoms have correct coordinates, except labels that
showing (100) translation
instead (110) - both on status bar and in the atom label. I don't know how it
is in different space groups.
What does
(origin-pre-shift imol)
(where imol is 0 typically/for example)
give you?
