Fix bond calc for atoms starting with L, M or R.

ChemCryst / crystals

Refinement and analysis of structures against single crystal diffraction data

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Fix bond calc for atoms starting with L, M or R. #242

Closed richardicooper closed 3 years ago

richardicooper commented 3 years ago

Revert bug from March where L, M, R are ignored in bonding calc (but also accidentally ignored bonds from Li, Mg, Mn, Ru, Re, etc). Effect was sometimes missed because reverse direction bonds were allowed, so effect depended on atom order).