%mem=40000MB
%nprocshared=20 
#p opt=(maxstep=4) freq=noraman b3lyp/6-311+G(d) scrf=(smd,solvent=dichloromethane) empiricaldispersion=gd3 scf=(maxcyc=1000,conver=8,nosym)

ch3cf3_6311+Gd_ch2cl2

0 1
 C	 0.075137000	 0.033155000	-1.504975000
 H	 0.036268000	 1.084253000	-1.790378000
 H	 0.883621000	-0.464352000	-2.040315000
 H	-0.873951000	-0.448332000	-1.740461000
 C	 0.324553000	-0.067791000	-0.036506000
 F	-0.645342000	 0.537245000	 0.701505000
 F	 1.499007000	 0.509561000	 0.336121000
 F	 0.381831000	-1.356199000	 0.396885000




