%mem=24GB
%nprocshared=12
%chk=THF-I-Prod-t1.chk
#P B3LYP/GenECP OPT Freq=NoRaman SCRF=(SMD,Solvent=THF) EmpiricalDispersion=GD3BJ 

rTHF---HI Optimization

0 2
 O                  1.12541000   -1.23972900    0.21877800
 C                  0.49489300   -0.34949400    1.03450700
 C                  0.97115300    1.04880800    0.77530500
 C                  1.39976000    0.93987100   -0.70080100
 C                  1.87603200   -0.51153700   -0.79358100
 H                 -0.26590132   -1.40616482   -0.63221219
 H                  1.83328900    1.29819000    1.41638900
 H                  0.20127300    1.80649300    0.95018000
 H                  2.18437600    1.64832800   -0.97733700
 H                  0.53739800    1.10009600   -1.35601900
 H                  2.93881400   -0.61574600   -0.54592900
 H                  1.68548800   -0.98854200   -1.75778800
 H                 -0.12446866   -0.68258771    1.86365950
 I                 -0.96173524   -1.83097419   -1.68847545

H C O 0
6-31G*
****
I 0
SDD
****

I 0
SDD


