**DALTON INPUT .RUN PROPERTIES .WALK .MAX IT 200 .PRINT 1 *WALK .NUMERI .DISPLACEMENT 0.001 **WAVE FUNCTIONS .HF *ORBITAL INPUT .AO DELETE 1.0D-07 **START .VROA *ABALNR .THRESH 1.0D-08 .FREQUE 1 0.08564539532 **EACH STEP .VROA *ABALNR .THRESH 1.0D-08 .FREQUE 1 0.08564539532 **PROPERTIES .VROA .RAMAN .VIBANA *RESPON .THRESH 1.0D-06 *ABALNR .THRESH 1.0D-08 .FREQUE 1 0.08564539532 *VIBANA .HESFIL **END OF DALTON INPUT