$contrl scftyp=rhf runtyp=energy nprint=9 mult=1 $end $contrl vbtyp=xmvb $end $system timlim=36000 mwords=50 $end $eldens ieden=1 $end $basis gbasis=n31 NGAUSS=6 $end $data O3 using 6-31G C1 1 O 8.0 0.000000 -1.083316 -0.217322 O 8.0 0.000000 0.000000 0.434645 O 8.0 0.000000 1.083316 -0.217322 $end