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number of atoms ( comparing Macmolplt and Chemcraft )

Masoud Nahali
masoudnahali@gmail.com



Dear FF Users

Enclosed you can see input and output file of a FF calculation. If you open these file using Macmolplt it will show 40 and 39 atoms respectively. The exact number of atoms is 39 !
But Chemcraft shows the number of atoms for both input and output files correctly.

Is there something wrong in the input file that makes Macmolplt read the file incorrectly or a bug in Macmolplt inherently ?

Sincerely Yours
Masoud Nahali
SUT

This message contains the 1291 kb attachment
[ BC.zip ] input and output files


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