| File Structure
|
|---|
| !CMNT
| Optional Comment record(s)
|
| NCLS
| Number of different molecule classes
|
| for icls = 1, NCLS
|
| !CMNT
| Optional comment record(s)
|
|
cls_id
NMOL
NVIB
| Class#, No. Mols, No.vib levels
|
| for imol = 1, NMOL
|
|
MOL_ID
molec
| Molec#, name
|
| for ivib = 1, NVIB
|
|
VIB_STR
VIB_IDX
vmol(1)
vmol(2) ...
| Vib String, Vib Index, relevant molecules
|
| End of file
|