#
# Do gaussian 03 calculation to obtain SCF orbitals
setenv g03root /usr/local/g03
source $g03root/g03/bsd/g03.login
cd $TMPDIR
#
g03 <<eoi
%Mem=800MB
%NProc=4
# ROHF/cc-pVTZ SCF=tight 6D 10F Gfinput PUNCH=MO

NO2

0 2
N
O N RNO
O N RNO O AONO
       Variables:
RNO 1.19455
AONO 133.851

eoi
#
cat fort.7
time
date
#
exit