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removed excess print statement
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IsabeltheCat committed Jun 27, 2022
1 parent 40a88c4 commit a8144b6
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion molSimplify/Classes/mol3D.py
Original file line number Diff line number Diff line change
Expand Up @@ -2577,7 +2577,7 @@ def readfromxyz(self, filename, fictitious_element=False, read_final_optim_step=
# If the split line has more than 4 elements, only elements 0 through 3 will be used.
# this means that it should work with any XYZ file that also stores something like mulliken charge
# Next, this looks for unique atom IDs in files
print(line_split, 'linesplit')
#print(line_split, 'linesplit')
if len(line_split) > 0:
current_atom_counter += 1
lm = re.search(r'\d+$', line_split[0])
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