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WebCocon found different constitutions with up different assignments each, totalizing candidates.

 

         
  You can reprocess the Output of Cocon in 4 different ways: "MD" uses a fast simple MD, "long MD" uses a longer MD run, "Normal DG" uses Distance Geometry with a small number of candidates, "Long DG" uses more structures and ConArch+ uses "ConArch+" and additional input files (if available).          You can request a simple 13C chemical shift calculation (with DFT optimization).   updating...   Reference

Results
ConArch+
13C Data
13C Opt Data


  
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