Structure Checker : Coordination System Error

  • Checker searches for errors in the use of coordinative bonds:
    • 2 multicenters connected with a bond;
    • coordinated atom is connected to an atom of the same multicenter with a coordinative bond;
    • multicenter merged with one of its atoms.
  • Fixer offers deleting the wrong bond (removebond).


Example :

Coordination System Error Checker (coordsystem) Warning: Fix
Delete bond (removebond)
Detect coordinative bond ex_coord_ch ex_coord_f
Detect coordinative bond ex_coord_ch ex_coord_f