%nprocshared=24
%mem=90GB
#p b3lyp/gen EmpiricalDispersion=GD3 scrf=(smd,solvent=toluene) 

Cyclooctene 

0 1
 C                  1.97391800    0.07920000   -0.11684000
 C                  1.25847000   -1.18323200    0.40065800
 C                 -1.41085900    1.28537300   -0.03133400
 C                  0.01545000   -1.67417900   -0.37839700
 C                 -1.94474900    0.06988300   -0.20284500
 C                 -1.36079400   -1.26254100    0.22006000
 H                  2.55848100   -0.18059400   -1.01057300
 H                  0.97556700   -1.03754500    1.45169600
 H                  0.06939200   -1.36301000   -1.42960500
 H                 -1.96975900    2.14155900   -0.41079300
 H                  2.70709300    0.37692900    0.64639600
 H                  2.00631400   -1.98727600    0.41564400
 H                  0.03865700   -2.77125100   -0.38704600
 H                 -2.91423800    0.01783000   -0.69929000
 H                 -2.08810900   -2.03865000   -0.04598000
 H                 -1.27863700   -1.30151000    1.31692800
 C                  1.09060700    1.29207800   -0.46638500
 H                  0.64049300    1.13630100   -1.45349600
 H                  1.74244500    2.16912300   -0.56861600
 C                 -0.05164100    1.59062700    0.55104400
 H                  0.10752900    1.01060100    1.46930000
 H                 -0.01764600    2.64423600    0.84966700

-C -H 0
cc-pvTZ
****





