! 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    -0.3779192978    1.0201805588    -1.0589950371
 O    -1.5649523419    -2.9159767445    1.3894910613
 C    -2.6020587056    1.0176996467    -0.1487988405
 C    -2.4056951520    -0.3332761114    0.5488993899
 C    -1.2872969831    1.8050795948    -0.2565940094
 C    -3.7412907139    1.7603955438    0.5443380285
 C    -3.6326740935    -1.1959488505    0.2236274328
 C    -1.1155927694    -0.9786115440    0.1181673730
 C    -4.9086730482    -0.4510279227    0.5103259087
 C    -0.2228024122    -0.2969554499    -0.6934151725
 C    -0.6107081822    2.0785028959    1.0883919461
 C    -1.4568695061    3.1093834979    -1.0309717482
 C    -4.9397699215    0.8645133442    0.6661118828
 C    -0.7479344270    -2.2726950156    0.5330374550
 C    0.9480410410    -0.9025119768    -1.1691826172
 C    -6.1318563278    -1.3070455653    0.6115293209
 C    1.3002183202    -2.1813115158    -0.7580588100
 C    0.4461095615    -2.8464758786    0.1117944181
 C    2.6088107179    -2.7761756434    -1.1758977881
 C    3.6861849258    -2.6317951497    -0.0850162596
 C    3.9248060363    -1.1920335238    0.3861012696
 C    3.1586892990    -0.8439034156    1.6626609955
 C    3.2893442460    0.6284854353    2.0259865600
 H    -2.9134320140    0.8125043366    -1.1799472498
 H    -2.3887107034    -0.1913086070    1.6357823164
 H    -4.0217661307    2.6482793118    -0.0249495481
 H    -3.4353095040    2.0909850321    1.5418558945
 H    -3.6133942573    -2.1085808309    0.8182405503
 H    -3.6079116593    -1.4906607865    -0.8303597248
 H    0.3699642667    2.5516749558    0.9047790910
 H    -1.2028276925    2.7657302342    1.6841688055
 H    -0.4623300659    1.1604731002    1.6535818258
 H    -0.4752256823    3.5260499782    -1.2615722557
 H    -1.9797025193    2.9298604401    -1.9660961743
 H    -2.0125183686    3.8347712605    -0.4467904347
 H    -5.8705152421    1.3632188795    0.8927316588
 H    1.4872949586    -0.4061325387    -1.9881765210
 H    -6.0434304536    -1.9949688695    1.4516191941
 H    -6.2502615435    -1.9032140646    -0.2922215913
 H    -7.0226793941    -0.7018225296    0.7505592484
 H    0.7086293329    -3.8345157133    0.4627359975
 H    2.4834593475    -3.8381355034    -1.3892844677
 H    2.9597095104    -2.2870348359    -2.0862226714
 H    4.6120343960    -3.0400363156    -0.4905201846
 H    3.4081517560    -3.2413097226    0.7751501570
 H    -1.2218074192    -3.7948809991    1.5976995029
 H    4.9898512841    -1.0425157792    0.5688294714
 H    3.6317919213    -0.4776281007    -0.4179070080
 H    3.5614210002    -1.4380825874    2.4849052936
 H    2.1026823774    -1.1039093886    1.5466801114
 H    2.7369152932    0.8585214723    2.9331499781
 H    4.3314564622    0.9003164027    2.1753592270
 H    2.8833343205    1.2782026844    1.2022519849
Ag    2.0106777800    1.3349781251    -0.5811865656
*