PC-GAMESS v.6.2 build 2068
Windows XP
Intel Celeron
Original input file created using GaussView with C2h symmetry and saved as Cartesian coordinates.
After GeoOpt of this, the final coordinates were used as the input for a single point energy calculations (unrestricted, no sym) and an IR calculation. For the Raman calculation, the $GRAD and $HESS sections were cut from the PUNCH file of the IR calc and pasted into the Raman calc input file.
