%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-och3-ts_6311+Gd_aq_new

-1 1
 O	 0.974558000	 2.048509000	 0.045604000
 O	 1.208127000	-0.186308000	 0.053276000
 C	 1.321068000	-0.147729000	 1.904093000
 H	 2.184821000	 0.492649000	 1.930244000
 H	 0.343508000	 0.274810000	 2.052630000
 H	 1.448480000	-1.215840000	 1.928909000
 O	 1.454540000	-0.200239000	 3.988656000
 C	 2.714151000	-0.748485000	 4.269501000
 H	 2.894262000	-0.833689000	 5.355122000
 H	 2.841775000	-1.766640000	 3.851773000
 H	 3.546690000	-0.141829000	 3.862022000
 C	 1.067503000	 0.954945000	-0.541780000
 C	 1.058071000	 0.894180000	-2.055908000
 H	 2.083817000	 1.033580000	-2.412340000
 H	 0.700858000	-0.069163000	-2.420764000
 H	 0.447124000	 1.699470000	-2.465725000




