%nprocshared=24
%mem=120GB
%chk=DCB_R_TS_CN_opt_1.chk
#p opt freq b3lyp/gen scrf=(solvent=generic,read,pcm)
empiricaldispersion=gd3bj

DCB_R_TS_CN_opt_1

0 1
 C                  4.01053800    0.35105700   -0.06667600
 C                  2.97271400    1.29047400    0.06206500
 C                  1.65300600    0.87832800   -0.08088700
 C                  1.33664900   -0.46151000   -0.35231600
 C                  2.38315200   -1.38677800   -0.47759800
 C                  3.70987900   -0.99452300   -0.33851300
 H                  3.20752400    2.32928000    0.26815500
 H                  0.85208600    1.60586800    0.01679200
 H                  2.15318800   -2.42714600   -0.68932600
 H                  4.51261300   -1.71694000   -0.44063700
 C                  5.37241500    0.76515700    0.07537100
 N                  6.48072000    1.10201000    0.19154600
 C                 -4.19728100    1.54875200    0.75838900
 C                 -3.39588400    0.50078300    1.21218200
 C                 -3.07212800   -0.57505400    0.37250900
 C                 -3.57425200   -0.57338600   -0.93506500
 C                 -4.37689000    0.47355700   -1.39521200
 C                 -4.69073200    1.53897900   -0.54945200
 H                 -4.43989800    2.37139600    1.42557500
 H                 -3.01727000    0.51325700    2.23173200
 H                 -3.33324800   -1.40094500   -1.59783900
 H                 -4.75703500    0.45494500   -2.41295300
 H                 -5.31614000    2.35341400   -0.90386600
 C                 -2.16545400   -1.68121400    0.86305100
 H                 -2.26129800   -2.55619300    0.20852100
 H                 -2.47775800   -1.99771200    1.86593700
 C                 -0.68533200   -1.25744200    0.92725800
 H                 -0.58249600   -0.39255100    1.59503800
 H                 -0.09546900   -2.06975700    1.36968400
 C                 -0.10142200   -0.90123300   -0.45244900
 H                 -0.18112500   -1.77375300   -1.11225800
 H                 -0.70258300   -0.10291300   -0.90132200

C H N
6-31G(d)
****

eps=43.310
epsinf=1.880






