#!/bin/sh
### Job name
#PBS -N water
#PBS -l nodes=10:ppn=1
#PBS -l walltime=06:00:00

# This job's working directory
cd $PBS_O_WORKDIR    

# Define number of processors
NPROCS=`wc -l < $PBS_NODEFILE`

/u1/local/gamess/rungms water.inp 00 $NPROCS