%nprocshared=8
%mem=22GB
#p opt freq=noraman b3lyp 6-31G(d) scrf=(pcm,solvent=generic,read) nosymm empiricaldispersion=gd3 scf=(xqc,maxcyc=1024)

Opt freq

1 1
 C                  0.32260200    2.28322300    0.37061800
 N                 -0.10120400    1.37916700   -0.25669300
 C                  3.63450800    0.91755100    1.79378300
 N                  3.88122200   -0.11218900    1.27594600
 C                  2.07742300   -2.14264400   -2.81920900
 N                  2.13894400   -1.84845700   -1.67798700
 C                  1.45569300   -3.22363400    1.96684000
 N                  0.43665800   -2.86717700    2.44014000
 C                  0.90673400    2.30195000   -4.03887300
 N                  1.82240200    1.55955000   -4.08469400
 C                 -1.63296300   -0.96858700   -3.75857100
 N                 -2.27691300   -0.74725700   -2.79559200
 C                 -0.66148800    0.45945400    4.28531400
 N                  0.10351400    1.31908600    4.02910800
 C                 -3.85610500   -1.37259900    0.75973700
 N                 -2.92527500   -1.16423100    1.45431000
 C                 -4.02875000    2.61018100   -0.27407100
 N                 -4.21456900    2.28993100   -1.39357100
 K                 -1.92613300   -2.24020300    3.79926800
 K                  2.16561300   -0.84125300    3.81029800
 K                  3.82252900   -2.80302200    0.30918700
 K                  2.77918700    0.98696000   -1.48389800
 K                 -0.53477600   -1.47612000   -0.39842900
 K                 -2.48783800    1.66626700    1.95329000
 K                 -1.63869700    2.25155700   -2.65712600
 K                 -4.87113500   -0.43680300   -1.77916000
 K                  0.89665900   -0.93776600   -5.16904700
 K                  1.83395300    3.14198400    2.66484900

solventname=c60
eps=4.08
epsinf=3.83


