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              grep rough audit - static analysis tool
                  v2.8 written by @Wireghoul
=================================[justanotherhacker.com]===
cclib-data-1.6.2/cclib/parser/qchemparser.py-187-                        msg = """ECPs are present, but the total charge \
cclib-data-1.6.2/cclib/parser/qchemparser.py:188:cannot be determined. Rerun without `$molecule read`."""
cclib-data-1.6.2/cclib/parser/qchemparser.py-189-                        self.logger.warning(msg)
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cclib-data-1.6.2/doc/sphinx/data_notes.rst-253-
cclib-data-1.6.2/doc/sphinx/data_notes.rst:254:    The standard MOLPRO convergence criterion requires the maximum component of the gradient to be less then :math:`3 \cdot 10^{-4}` [a.u.] and the maximum energy change to be less than :math:`1 \cdot 10^{-6}` [H] or the maximum component of the gradient to be less then $ 3 \cdot 10^{-4}$ [a.u.] and the maximum component of the step to be less then :math:`3 \cdot 10^{-4}` [a.u.].
cclib-data-1.6.2/doc/sphinx/data_notes.rst-255-
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cclib-data-1.6.2/doc/sphinx/data_notes.rst-414-
cclib-data-1.6.2/doc/sphinx/data_notes.rst:415:**GAMESS**: second-order corrections (MP2) are available in GAMESS-US, and MP2 through MP3 calculations in PC-GAMESS (use ``mplevl=n`` in the ``$contrl`` section).
cclib-data-1.6.2/doc/sphinx/data_notes.rst-416-