%mem=3000MB
%nprocshared=12
#p opt=(ts,calcfc,noeigentest,maxstep=4) freq b3lyp/6-311+G(d) scrf=(smd,solvent=water) empiricaldispersion=gd3 nosymm

ch3cooch3-OTf-ts_6311+Gd_aq_new

-1 1
 C	 1.363257000	 0.368137000	 1.153297000
 H	 0.864267000	 0.325142000	 0.202420000
 H	 1.889272000	 1.266870000	 1.424331000
 H	 1.570450000	-0.536691000	 1.697622000
 O	 4.371634000	-1.416046000	-1.260070000
 O	 3.174320000	-0.064350000	 0.045164000
 S	-1.097300000	-0.157592000	 2.677806000
 O	-2.129417000	 0.489452000	 3.489081000
 O	-0.136536000	 0.876190000	 2.097474000
 O	-0.419459000	-1.336049000	 3.225273000
 C	-1.996857000	-0.792819000	 1.144223000
 F	-2.532897000	 0.225996000	 0.468064000
 F	-1.139293000	-1.439909000	 0.348091000
 F	-2.969411000	-1.633141000	 1.508589000
 C	 3.319614000	-1.144559000	-0.626137000
 C	 2.161331000	-2.129357000	-0.653952000
 H	 1.903126000	-2.440869000	 0.361294000
 H	 1.274710000	-1.652339000	-1.079540000
 H	 2.409681000	-3.010246000	-1.245032000




