q2m -s SAXYZ -n 'FM-complx' -m B -i /loclib/q2m/test/SAXYZ-B.dat -o SAXYZ-B.MOL
q2m -s SCXYZ -n 'FM-complx' -m B -i /loclib/q2m/test/SCXYZ-B.dat -o SCXYZ-B.MOL
q2m -s SCXYZSSS -n HCOOH -m B < /loclib/q2m/test/SCXYZSSS-B.dat >SCXYZSSS-B.MOL
q2m -s SXYZM -n Propanal -m B -i /loclib/q2m/test/SXYZM-B.dat > SXYZM-B.MOL