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

ch3cn-och3-ts_6311+Gd_aq

-1 1
 C	-0.573221000	 0.004500000	-0.045850000
 H	-0.508771000	-0.726987000	-0.833012000
 H	-0.564840000	 1.052457000	-0.285893000
 H	-0.728275000	-0.312060000	 0.971372000
 O	-2.536452000	 0.074239000	-0.302419000
 C	 1.409822000	-0.025224000	 0.201094000
 N	 2.566500000	-0.056750000	 0.344101000
 C	-3.048562000	-1.184094000	-0.067683000
 H	-2.851309000	-1.562796000	 0.962457000
 H	-4.148338000	-1.216663000	-0.192560000
 H	-2.644784000	-1.966422000	-0.752095000




