! 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    -1.1806869200    1.4709680834    1.7969034611
 O    -0.6313594725    0.8427647310    -2.9566024192
 C    -2.2851573723    -1.0102059330    0.1467444702
 C    -2.3523650176    0.3509647714    -0.5928618159
 C    -3.7010624300    -1.6022118090    0.1525816108
 C    -4.5968417519    -0.7320978918    1.0315235345
 C    -3.4228998370    1.2121400318    0.0309470771
 C    -0.9860168865    0.9977390066    -0.5615189033
 C    -4.4390045984    0.7350133622    0.7451424072
 C    -1.2620816714    -1.9559731167    -0.4275128102
 C    -0.4451804818    1.4206933575    0.6674125140
 C    -0.1816200812    1.1072344676    -1.7052637942
 C    -5.4852824677    1.6245404256    1.3325281179
 C    -1.4059595320    -2.3813350933    -1.8536388048
 C    1.7063728243    1.8662299229    -0.3751085118
 C    0.8907208898    1.8258859560    0.7592157169
 C    1.1554110718    1.5097793015    -1.6032783239
 C    3.1364380933    2.3114754184    -0.2623773582
 C    -0.3044948742    -2.4885434768    0.3702926286
 C    3.9738004754    1.3225919752    0.5620186344
 C    4.1454978084    -0.0273416602    -0.1348180404
 C    4.6568109521    -1.1272242328    0.7924051136
 C    3.6189310642    -1.5547406298    1.8225590329
 H    -2.0116510128    -0.8195408677    1.1911224090
 H    -2.6463061879    0.1512874855    -1.6314154989
 H    -3.6808968956    -2.6227181578    0.5368083824
 H    -4.1006306101    -1.6259992664    -0.8621028144
 H    -4.3685828788    -0.9080403127    2.0878001284
 H    -5.6410510301    -1.0142044194    0.8850868882
 H    -3.3544703772    2.2703749499    -0.1858975810
 H    -5.2549106549    2.6734627520    1.1679779330
 H    -5.5760830072    1.4454024558    2.4028460963
 H    -6.4535358968    1.4084314704    0.8832029366
 H    -0.6992858784    -3.1706161718    -2.0976210098
 H    -2.4141026708    -2.7534995458    -2.0270773827
 H    -1.2396976490    -1.5544736902    -2.5423846616
 H    1.2323803525    2.2123665392    1.7078611747
 H    1.7147710651    1.6210738847    -2.5199917987
 H    3.5711466252    2.4209719493    -1.2565020455
 H    3.1653076878    3.2854104140    0.2296007978
 H    0.2821760116    -3.3323175668    0.0191371000
 H    -0.3564520639    -2.3558265022    1.4492824407
 H    3.4962124599    1.1857465578    1.5340808960
 H    4.9600360109    1.7550307383    0.7340525356
 H    3.1646198824    -0.3730496670    -0.5608182135
 H    4.8292481334    0.0898948479    -0.9770092758
 H    -2.1303214052    1.3948720803    1.5863577336
 H    -1.5954542085    0.8772064523    -3.0040582906
 H    5.5524973323    -0.7774945285    1.3082965321
 H    4.9374166896    -1.9926081999    0.1893314438
 H    3.9300508014    -2.4665747720    2.3243740348
 H    3.4676032372    -0.7918466662    2.5825554099
 H    2.6439542933    -1.7609584067    1.3205700081
Ag    1.1559966541    -0.6706275091    0.0116261371
*