%mem=16000MB
%nprocshared=12
#p opt=(ts,calcfc,noeigentest,maxstep=4) freq b3lyp/6-311+G(d) scrf=(smd,solvent=water) empiricaldispersion=gd3 nosymm

ch3och3-sh-ts_6311+Gd_new

-1 1
 C	-0.069316000	 0.265107000	-0.042467000
 H	 0.104160000	-0.349123000	-0.908923000
 H	 0.088290000	-0.148993000	 0.936861000
 H	-0.181882000	 1.326075000	-0.166092000
 O	 1.982057000	 0.684601000	-0.058476000
 C	 2.640838000	-0.516808000	 0.058660000
 H	 3.744479000	-0.397828000	 0.052565000
 H	 2.416587000	-1.237221000	-0.764200000
 H	 2.408744000	-1.070153000	 1.000206000
 H	-2.590587000	 0.609302000	 1.025545000
 S	-2.331657000	-0.170058000	-0.050841000




