! File created by MacMolPlt 7.4.2 $CONTRL SCFTYP=RHF RUNTYP=SURFACE EXETYP=RUN MAXIT=30 MULT=1 COORD=UNIQUE $END $SURF IVEC1(1)=2,1 IGRP1=1 DISP1=0.1 ORIGI=-1.0 NDISP1=100 $END $SYSTEM TIMLIM=525600 MEMORY=1000000 $END $BASIS GBASIS=N21 NGAUSS=6 $END $GUESS GUESS=HUCKEL $END $SCF DIRSCF=.TRUE. $END $DATA carbonmonoxide C1 C 6.0 1.46369 -1.07458 -0.74106 O 8.0 0.35500 -0.92063 -0.58169 $END