Partial Charges And Other Electronic Properties
===============================================

The script *print_atom_elec_props.py* demonstrates how to iterate over the atoms of molecules
read from a specified input file and calculate the following electronic atom properties:

 - Sigma charge
 - Pi charge
 - Total partial charge
 - Lone-pair electronegativity
 - Pi electronegativity
 - Sigma electronegativity
 - Exerted inductive effect
 - Free valence electron count
 - Valence electron count

**Synopsis**

  :program:`python` *print_atom_elec_props.py* <file>

**Code**

.. literalinclude:: /downloads/print_atom_elec_props.py
   :language: python
   :linenos:
   :lines: 21-

:download:`Download source file</downloads/print_atom_elec_props.py>`