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

Opt freq calcfc

-1 1
 C                  0.58455799    1.86467072   -0.05963381
 N                 -0.59029282    1.83996586   -0.13889375
 C                  2.60877710    2.10466795    3.48602305
 N                  3.59203695    1.61048559    3.05830165
 C                  3.72906861   -1.74890002    0.85833921
 N                  3.78682586   -1.56060190   -0.30394017
 C                  0.48773504   -1.47222544    3.41719318
 N                 -0.52342649   -1.23549958    2.86059921
 C                  3.01719988    1.96628376   -3.32983497
 N                  3.94772439    1.56635930   -2.72128582
 C                  1.07859826   -1.70169517   -3.34289252
 N                 -0.01634092   -1.42487351   -3.00583855
 C                 -3.61370511    1.26971374    3.25106414
 N                 -3.08219976    2.19251148    2.74137801
 C                 -5.55027858   -0.76483640   -0.47607701
 N                 -4.45139211   -0.39399105   -0.24295024
 C                 -3.08428519    2.37752165   -3.16253457
 N                 -2.77911819    1.25933349   -3.38573216
 K                 -3.30555871   -1.49868975    2.17495219
 K                 -0.27117185    1.76096738    3.00062471
 K                  3.36386225   -1.21021018    3.70613528
 K                  3.59001672    1.52859624    0.15250754
 K                  0.47838289   -1.74411427    0.01793986
 K                 -3.30943713    2.17532332   -0.16672976
 K                  0.10767293    1.53911541   -3.22446400
 K                 -2.82520893   -1.48117481   -2.41920533
 K                  3.92798538   -1.30146598   -3.07611592
 C                 -2.45620219   -3.91829719    0.48756586
 N                 -1.90997721   -3.20512130   -0.27914139

solventname=c60
eps=4.08
epsinf=3.83


