! 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    -0.3849424712    1.0187023997    -0.8330388956
 O    -1.7845227070    -3.0943991878    1.2862557312
 C    -2.6941528911    0.9944234397    -0.2067118022
 C    -2.5941491377    -0.3905613060    0.4475812449
 C    -1.3729897687    1.7689099190    -0.0976849742
 C    -3.9376414869    1.6709682290    0.3616125080
 C    -1.2726349861    -1.0431175903    0.1270107189
 C    -5.1799370340    0.8995626307    -0.1011285776
 C    -3.8019891659    -1.1716650377    -0.0214365492
 C    -4.9690610706    -0.5821444568    -0.2487351714
 C    -0.2843380688    -0.3255461283    -0.5310113055
 C    -0.8663816387    1.9504775142    1.3360732391
 C    -1.4351952840    3.1219030291    -0.8028980853
 C    -0.9525514245    -2.3477204113    0.5400661386
 C    0.9332984999    -0.9145309268    -0.8940892932
 C    -6.1682092282    -1.3476497257    -0.7097855994
 C    1.2330829582    -2.2172419873    -0.5020589535
 C    0.2878993941    -2.9062520923    0.2391727539
 C    2.5487235956    -2.8588234516    -0.8431957102
 C    3.7464606252    -1.9027002097    -0.8716937642
 C    3.9963811791    -1.2079403264    0.4677017812
 C    5.1111495208    -0.1641299561    0.4082260874
 C    4.6988371893    1.1131686991    -0.3116097981
 H    -2.8522809307    0.8389777658    -1.2810079549
 H    -2.6671367749    -0.2706222599    1.5415333669
 H    -3.8856061398    1.6776328649    1.4520304726
 H    -4.0152995751    2.7034051642    0.0232098479
 H    -6.0064637848    1.0804497820    0.5894812998
 H    -5.4993069052    1.2794478324    -1.0763570649
 H    -3.6905779519    -2.2293333731    -0.2093457414
 H    -0.7753195607    0.9963525471    1.8546423872
 H    -1.5367523255    2.5908377451    1.9017587841
 H    0.1226183427    2.4455012943    1.3070034788
 H    -0.4265012007    3.5217695153    -0.9098463457
 H    -2.0296251489    3.8286362697    -0.2338810798
 H    -1.8636603660    3.0123300304    -1.7949470813
 H    1.5620818043    -0.3698118410    -1.6042651490
 H    -6.5202209184    -0.9590535126    -1.6641665843
 H    -5.9427091618    -2.4039085022    -0.8256374507
 H    -6.9812050862    -1.2402769402    0.0068015708
 H    0.4828009686    -3.9035589837    0.5982823844
 H    2.4579049539    -3.3238020790    -1.8287161399
 H    2.7408635803    -3.6593517257    -0.1273374850
 H    4.6334637130    -2.4853208584    -1.1252619720
 H    3.6090879877    -1.1654401497    -1.6641481427
 H    -2.6229399820    -2.6418360146    1.4488967648
 H    4.2496224329    -1.9652822262    1.2107790922
 H    3.0644728213    -0.7042534289    0.8245238190
 H    5.4208569080    0.0856849538    1.4245056526
 H    5.9750283653    -0.5906866074    -0.1045155406
 H    3.8042479814    1.5712358716    0.1925221927
 H    4.4749356874    0.9284615901    -1.3623427100
 H    5.4920187000    1.8549104919    -0.2648421711
 Ag    1.8525615664    1.1784460821    0.1952607545
*