! wB97X-D3 Opt Freq def2-TZVPP def2/J RIJCOSX TightSCF defgrid3 CHELPG
%maxcore 5120

%pal nprocs 16 
end

%chelpg
grid 0.1
rmax 3.0
end


*xyz 1 1
 O    -1.1894252137    -1.5881381243    1.5360736367
 O    -0.3404236442    -1.2306792474    -3.1956532917
 C    -2.5076432128    0.0630302982    0.4811840571
 C    -2.1497538308    -0.4045269930    -0.9406096036
 C    -2.5608297102    -1.1384594002    1.4302781991
 C    -3.6400058112    1.0791875755    0.4146816292
 C    -2.1235647677    0.8418244355    -1.8776097058
 C    -0.8072229778    -1.0840125459    -0.8221474880
 C    -3.0007579206    2.3791289923    -0.1217538827
 C    -1.8564395242    2.0460715827    -1.0341521763
 C    -0.3755549111    -1.4788900135    0.4694721508
 C    -3.4460496659    -2.2919376399    0.9571030108
 C    -2.9522249882    -0.7272916284    2.8484490240
 C    0.0545883608    -1.3361645768    -1.9031020569
 C    0.9668950840    -1.8227909308    0.6768518541
 C    1.8625613862    -1.8831312650    -0.3898246195
 C    -0.6673405801    2.6773524092    -1.0332944942
 C    1.3839415123    -1.6934870372    -1.6784492775
 C    3.3222565564    -2.1106438946    -0.1276495089
 C    3.9024000254    -0.9624405168    0.7119279412
 C    3.7988165836    0.3935145979    0.0118244587
 C    4.0440860526    1.5770605136    0.9455735108
 C    2.8840318016    1.8236806409    1.9010969656
 H    -1.6358515601    0.6340032761    0.8738556430
 H    -2.9201548041    -1.0922055072    -1.3041836651
 H    -4.0748204752    1.2622478879    1.3946677646
 H    -4.4334398127    0.7267843171    -0.2443605754
 H    -3.1001242124    0.9488026642    -2.3514378937
 H    -1.3702577454    0.7513018187    -2.6591467196
 H    -2.6579859316    3.0032546886    0.7047852199
 H    -3.7374911474    2.9564518595    -0.6851078714
 H    -4.4320759238    -1.9212332891    0.6911516139
 H    -3.5513889200    -3.0182314797    1.7581391313
 H    -3.0076078966    -2.8040674992    0.1042510199
 H    -2.6851438230    -1.5278932398    3.5324096961
 H    -4.0222270187    -0.5577518858    2.9124889589
 H    -2.4231242139    0.1727923111    3.1531451799
 H    1.2563615726    -2.1376559762    1.6679525197
 H    0.0296589296    2.5252057562    -1.8571258539
 H    -0.5335989442    3.5815548417    -0.4522546978
 H    2.0158758792    -1.8459067048    -2.5383879971
 H    3.4585745351    -3.0454153574    0.4186891569
 H    3.8605375635    -2.1870026400    -1.0723830456
 H    4.9527929909    -1.1715422644    0.9178256514
 H    3.3771038674    -0.9291091087    1.6672361564
 H    4.5114657135    0.4234629834    -0.8135943490
 H    2.7798463976    0.5200021385    -0.4381243326
 H    4.2077759102    2.4747838230    0.3464571950
 H    4.9497418150    1.3961676680    1.5269684022
 H    1.9275337607    1.9389551473    1.3263865224
 H    2.7717517582    1.0105445681    2.6151130692
 H    3.0342361543    2.7429744480    2.4606924732
 H    -1.3004603421    -1.2724499165    -3.2789686878
Ag    0.6833090150    0.8361342895    0.0467686565
*