[cclib-devel] broken gaussian file

[Adam T. <a-t...@st...>]

One of my labmates has a Gaussian 98 frequency calculation that cclib  
chokes on. The issue is the assert nbasis == self.nbasis found on  
line 532 of the gaussian parser. For some reason, it says it uses 290  
basis functions at one point and then says there are 292 basis  
functions. It has the following route section:

#P UBP86/LanL2DZ 5D 7F SCF(MaxCycle=500,conver=8) Pop=(NPA) Freq IOP 
(7/33=1) guess=read geom=check

Have we seen this before? I have no idea what's going on and the 7/33  
IOP doesn't exist in the Gaussian 03 Documentation.

Adam