%mem=16000MB %nprocshared=12 #p opt freq b3lyp/6-311+g(d) scrf=(smd,solvent=dichloromethane) empiricaldispersion=gd3 scf=(maxcyc=1000,conver=8,nosym) ch3och3-sh -1 1 C 0.80157400 0.47270000 0.00013100 H 0.44937200 -0.06296300 0.89444400 H 0.38459300 1.48331800 0.00001200 H 0.44941600 -0.06315100 -0.89416400 O 2.22086500 0.60104400 0.00012500 C 2.87231700 -0.66073100 0.00004100 H 3.95036700 -0.47109300 0.00024900 H 2.60955400 -1.24844000 0.89475200 H 2.60984100 -1.24816200 -0.89493800 H -4.22722500 -0.25364400 0.00798200 S -2.87726100 -0.11350200 -0.00064800