
VERSION="7.9"
echo "runit  $VERSION" | sed -e 's/\$//g' | sed -e 's/: /  /g'

if [ -z "$1" ]; then
 echo "usage:  ./runit <Project name> "
 exit
fi
MPROJ=`echo $1| sed -e 's/\.input$//'`
echo "Project name=" $MPROJ
echo "creating temporary directory " `pwd` "/CTMP"
CURRDIR=`pwd`
CTMP=`pwd`/CTMP
export WorkDir=$CTMP/WORK
export ThisDir=$CTMP
export Project=$MPROJ
 if [ -d $CTMP ];
  then
  rm -rf $CTMP
  fi
 mkdir $CTMP
 cd $CTMP
 cp ../$Project.input .
 molcas $Project.input
 cd $CURRDIR



