#!/bin/bash -l

#Give the name to the job
#$ -N orca

#Send an email when the job is finished (or aborted)
#$ -m ae

#Request enough time (12 hours is the default time)
#$ -l h_rt=12:00:00

#Join the error and output file
#$ -j y

#Sepcify the version of orca
module load orca/3.0.3

#Run the program
orca example.inp > example.out