%nprocshared=24
%mem=120GB
%chk=DCB_R_1.chk
#p opt freq b3lyp/gen scrf=(solvent=generic,read,pcm)
empiricaldispersion=gd3bj

DCB_R_1

-1 1
 C                 -3.55237000   -0.70751400   -0.18670100
 C                 -2.51350600   -0.72093000   -1.17796900
 C                 -1.43346900    0.09906600   -1.13455100
 C                 -1.21287100    1.13339400   -0.03665700
 C                 -2.32059000    1.05289200    1.00730600
 C                 -3.37786500    0.20835200    0.90554200
 H                 -2.59187600   -1.43424500   -1.99730400
 H                 -0.66495900    0.04416100   -1.90187000
 H                 -2.22650200    1.72136400    1.85982000
 H                 -4.12527100    0.21363600    1.69778100
 C                 -1.26026400    2.49016500   -0.66066400
 C                 -4.65201000   -1.56515900   -0.25947400
 N                 -1.33894600    3.53903200   -1.15988100
 N                 -5.58180500   -2.28725300   -0.32047800
 C                  3.99287000   -1.64356300   -1.07664000
 C                  3.03837700   -1.64053500   -0.05918100
 C                  2.89763900   -0.53738600    0.79571500
 C                  3.74227000    0.56317300    0.60374900
 C                  4.70057700    0.56615900   -0.41304400
 C                  4.82877000   -0.53784200   -1.25784900
 H                  4.08705500   -2.50940600   -1.72655800
 H                  2.39214500   -2.50477900    0.07672000
 H                  3.64559900    1.42671700    1.25740100
 H                  5.34591500    1.43062900   -0.54387700
 H                  5.57349200   -0.53881800   -2.04878400
 C                  1.82799400   -0.53133700    1.86509600
 H                  2.03539900    0.26788400    2.58763600
 H                  1.86077100   -1.47725500    2.42095900
 C                  0.40874100   -0.34953300    1.29288300
 H                  0.19735100   -1.15266400    0.57626000
 H                 -0.32476900   -0.45395900    2.10111900
 C                  0.20699500    0.99727700    0.60290600
 H                  0.35376500    1.81281100    1.32499900
 H                  0.95941100    1.13140100   -0.18459200

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

eps=43.310
epsinf=1.880







