#918 Segfault upon reading GAMESS output with vibrations

[Michael Schmuker]

I'm getting a segmentation fault when loading a GAMESS output file with vibrational frequencies (mol1test_freq.log, attached). Output from a mere optimization run reads in fine (except for that it complains not being able to assign all charges) (mol1opt.log, attached).

System: OSX 10.9 Mavericks, openbabel compiled from github commit 5f0837 Sat Mar 15 15:59:37 2014.

Attached is the gamess output file.

This is the code I'm using to read it in (python):

>>> import pybel
>>> mols  = pybel.readfile(format='gamess', filename='mol1test_freq.log')
>>> m = mols.next()
Segmentation fault: 11

[Michael Kausch]

Confirmed with latest version 2.4.1 (64bit) on Win10pro 64bit used from the command-line.
Crashes also with GAMESS/Firefly Raman calculations.