%mem=3000MB
%nprocshared=4
#p opt=(ts,calcfc,noeigentest,maxstep=8) freq=noraman b3lyp/6-311+G(d) scrf=(smd,solvent=dichloromethane) empiricaldispersion=gd3 nosymm

ch3ph3-OTf-ts_6311+Gd_aq_new

0 1
 C	 0.360438000	-0.649630000	 0.067773000
 H	 0.305592000	-0.987490000	-0.953893000
 H	 0.662317000	 0.364767000	 0.269682000
 H	-0.125363000	-1.224755000	 0.839144000
 S	 2.682316000	-1.591609000	 1.652631000
 O	 3.818033000	-2.514232000	 1.602500000
 O	 2.063539000	-1.402260000	 0.271439000
 O	 1.685805000	-1.775179000	 2.711678000
 C	 3.439834000	 0.102422000	 1.993259000
 F	 4.058078000	 0.090609000	 3.177354000
 F	 4.324781000	 0.415143000	 1.044021000
 F	 2.478714000	 1.032762000	 2.014031000
 H	-2.176147000	 1.360150000	-1.352102000
 H	-3.080301000	-0.469257000	-0.723972000
 H	-2.657238000	 1.058913000	 0.706379000
 P	-2.012945000	 0.377558000	-0.350215000




