38 1a C 3.2345751212 3.5483481473 1.1648615999 C 2.9613505890 3.4550657170 2.5415877927 C 2.3677280909 2.9008969290 0.2402668099 C 1.8557994898 2.7291513632 2.9589273527 C 1.2599119469 2.1558437599 0.6597372278 C 1.0164500771 2.0831753761 2.0259957747 H 3.6117781997 3.9441414739 3.2611093547 H 1.6313631688 2.6508733771 4.0186283781 H 0.6197466155 1.6529061216 -0.0567436223 H 0.1625702763 1.5146225929 2.3825704100 C 4.2611573687 4.1827704261 0.4045189642 N 2.8568880982 3.1304487308 -1.0366018938 C 4.0169480395 3.9225106601 -0.9295350753 C 2.2587703336 2.7030333052 -2.2513271597 C 0.9136504673 2.9930597584 -2.5031447110 C 3.0158572393 2.0052609091 -3.1988547951 C 0.3277500426 2.5792481429 -3.6987515294 C 2.4275196232 1.6133393312 -4.4003792206 C 1.0828667819 1.8948838169 -4.6528378611 H 0.3440714521 3.5510149602 -1.7672865400 H 4.0553062206 1.7803788688 -2.9890644508 H -0.7167563725 2.8069774374 -3.8902508510 H 3.0195486014 1.0748202657 -5.1347380452 H 0.6264088574 1.5820382186 -5.5872108591 C 4.7081308670 4.3574669780 -2.0736927282 C 5.2538855793 4.6993145260 -3.1045977409 C 5.8443910138 5.0589199322 -4.3452335726 C 7.0009808892 5.8612224298 -4.3994663856 C 5.2652541772 4.6053681824 -5.5489492813 C 7.5610089718 6.1986950698 -5.6283125448 C 5.8342409188 4.9496248002 -6.7710127822 C 6.9821040784 5.7459058212 -6.8166320932 H 7.4475086262 6.2111819747 -3.4742652936 H 4.3733400880 3.9875567647 -5.5046369811 H 8.4529158649 6.8179605964 -5.6600116478 H 5.3808189472 4.5963635056 -7.6928351201 H 7.4221709778 6.0131119139 -7.7729984786 H 5.0847778538 4.7735332823 0.7770783775 16 IMeAu+ C -0.9142753794 7.5673319558 -3.5811170707 C -0.5849136090 8.2617226358 -2.4590525760 N 0.7583221105 8.0318389210 -2.2183498413 C 1.2507611521 7.2078323183 -3.1683268782 N 0.2310431167 6.9218383516 -4.0083408167 H -1.1787248714 8.8958312135 -1.8194366884 H -1.8514002965 7.4827848451 -4.1085221278 Au 3.1119547736 6.5279630773 -3.3616289559 C 1.4761334760 8.5764465963 -1.0597536332 H 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7.0672559969 -5.1121839795 H 6.7230683644 3.2815862083 -3.8766089933 H 6.6659738043 7.1286695574 -7.0228549192 H 8.3063809259 3.3471963354 -5.7856065799 H 8.2760076512 5.2674125164 -7.3614122737 H 5.2413726903 4.5636090520 0.5637739695 C 1.6043349493 8.8644307269 -1.2870907147 H 0.9080661770 9.0106739889 -0.4587102869 H 2.3628955166 8.1388912271 -0.9952600374 H 2.0851897577 9.8143289615 -1.5334365433 C 0.3587380187 6.2997575093 -5.3304503854 H 1.1667209020 6.5580891954 -6.0183543387 H 0.5122251411 5.2906740298 -4.9449266704 H -0.5945731685 6.3446827250 -5.8584357754 54 2a[Au]-TS+ C 6.3169510684 10.2246931921 -2.0513834834 C 7.4291397520 9.8639820205 -2.7413870206 N 7.3565671364 8.4937809327 -2.9273132001 C 6.2203004236 7.9929560091 -2.3749906257 N 5.5886101358 9.0661260633 -1.8370497511 H 8.2545252540 10.4529390950 -3.1089090527 H 5.9871685689 11.1869172780 -1.6926572958 Au 5.6664614073 6.0178613665 -2.4003012237 C 1.8249674755 3.0190223029 -1.4602536792 C 0.5118145927 3.0473678969 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6.2430903629 3.3337159323 -3.0277243513 C 7.5773551263 3.5291842528 -3.5538438847 C 7.8291462844 3.4509416241 -4.9350434637 C 8.6321514916 3.8285397821 -2.6703981711 C 9.1105153312 3.6884194783 -5.4233657833 C 9.9115602983 4.0691295898 -3.1673673066 C 10.1523305265 3.9981186094 -4.5422988374 H 7.0140416847 3.2105874664 -5.6100978134 H 8.4297551116 3.8850954795 -1.6053316696 H 9.2999257971 3.6357244591 -6.4912326958 H 10.7208042364 4.3055187699 -2.4828054379 H 11.1514646254 4.1794540951 -4.9274193477 H 2.8844935984 4.9638457776 -1.0265530805 C 8.3376149982 7.7149383061 -3.6840396870 H 9.3122080043 8.2001997313 -3.6044473611 H 8.4052969917 6.7077736311 -3.2717156807 H 8.0456522079 7.6547096217 -4.7356667292 C 4.3237103483 9.0308617106 -1.1072556576 H 3.6012374202 9.6952767486 -1.5874369185 H 3.9402074686 8.0112739961 -1.1194961068 H 4.4807195967 9.3470257704 -0.0728822994 54 2a[Au]+ C 6.2857286536 10.1973898523 -2.0704934075 C 7.4969523292 9.8456957871 -2.5715171381 N 7.4696463680 8.4730550124 -2.7532598075 C 6.2681328212 7.9564440369 -2.3809559422 N 5.5486550215 9.0299955620 -1.9596644551 H 8.3636039931 10.4416660448 -2.8103877204 H 5.8912177689 11.1587002701 -1.7808688804 Au 5.7131589039 5.9662350840 -2.4693834262 C 1.8391535437 3.0977785768 -1.4803983747 C 0.5762370058 3.1850089968 -0.8900696581 C 2.2475765761 1.8847167667 -2.0809350164 C -0.2413789432 2.0552170650 -0.8867987435 C 1.4597189292 0.7364476111 -2.0325272957 C 0.2010061876 0.8441815938 -1.4365486458 H 0.2469129932 4.1126956830 -0.4328805387 H -1.2266529684 2.1064590483 -0.4343297458 H 1.7996664759 -0.2218624150 -2.4035201273 H -0.4374211306 -0.0320332166 -1.3926362696 C 2.9268580056 4.0379180238 -1.5927848350 N 3.5680607635 2.0892954880 -2.5643422429 C 3.9772010504 3.4445028251 -2.2231343243 C 4.3299222028 1.3095074516 -3.3408541630 C 3.8157559757 0.2539806530 -4.1291158648 C 5.8021690033 1.6027307943 -3.3440607803 C 4.6522905686 -0.4510492625 -4.9619813884 C 6.5965277303 0.8168193602 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7.8765027174 -4.4019878133 C 4.1843969238 8.9869913053 -1.4430298222 H 3.5423827986 9.6427859586 -2.0368426805 H 3.8170824628 7.9637323479 -1.5136225973 H 4.1675150320 9.3082860890 -0.3981393774 92 3a[Au]-TS+ C 2.809572933 4.789323870 2.016713167 C 3.154803332 4.920074343 3.369566092 C 1.973632232 3.718053138 1.605346152 C 2.732162377 3.948178834 4.267624206 C 1.608909623 2.702108373 2.494568928 C 1.995718266 2.835914606 3.825220944 H 3.767129709 5.755702696 3.697332545 H 3.001834433 4.027600716 5.316270485 H 1.098153911 1.805875254 2.172324138 H 1.731049691 2.052779591 4.528465160 C 3.217688961 5.510020595 0.843032071 N 1.763155220 3.859798102 0.216458406 C 2.556045312 4.904797287 -0.242891465 C 1.003094356 3.085778803 -0.664201291 C 0.017055575 2.197942493 -0.206734890 C 1.236088553 3.229804281 -2.064928608 C -0.654015662 1.379807639 -1.101602001 C 0.567622156 2.345389502 -2.940646637 C -0.354325659 1.425834225 -2.470665236 H -0.242998183 2.169716985 0.840570055 H 3.334886486 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0.089339186 C 3.411020648 0.521581109 0.200503972 C 2.453993488 -0.414913921 -0.229102217 C 4.030160434 0.360208133 1.468671546 C 2.136503590 -1.474572688 0.607394851 C 3.692513889 -0.695198465 2.323903898 C 2.746659078 -1.608475900 1.872855155 H 1.963798766 -0.291228311 -1.190281556 H 1.401537212 -2.209528092 0.292208276 H 4.140464683 -0.792277595 3.306520888 H 2.468561001 -2.441156230 2.512186740 C 3.915369014 1.733636878 -0.360457016 N 4.893666218 1.437675084 1.663392602 C 4.777729343 2.289351566 0.555131770 C 5.828761005 1.565565278 2.721830153 C 6.579824222 0.448648584 3.113729423 C 6.017011520 2.793301134 3.364635051 C 7.492747223 0.557895123 4.161401287 C 6.958033777 2.900388874 4.388100359 C 7.691863064 1.785252109 4.798428282 H 6.445101455 -0.494052561 2.594423321 H 5.412505769 3.642732967 3.075790427 H 8.057238479 -0.316983788 4.472324644 H 7.098147815 3.856479713 4.884533134 H 8.404415205 1.868689883 5.613780019 C 5.577906319 3.479982182 0.387049818 C 5.421411266 4.745652516 0.277093149 C 5.953531366 6.018301273 -0.124093026 C 6.117738451 6.304915440 -1.494446304 C 6.318892716 6.982185533 0.834563066 C 6.641628592 7.531622482 -1.892070195 C 6.849678936 8.201083696 0.427891058 C 7.008462275 8.479924325 -0.933723393 H 5.836719406 5.558866388 -2.229889439 H 6.185143065 6.758147697 1.888476851 H 6.763095562 7.749050938 -2.949188014 H 7.138863377 8.938470112 1.170289268 H 7.415922413 9.436600162 -1.246438466 H 3.663050323 2.166478863 -1.315605870 C 10.015214832 3.814467889 -2.423057466 H 9.824118683 3.171105684 -3.286449668 H 9.106936287 4.361977997 -2.170154388 H 10.808670275 4.524740719 -2.666088874 C 9.912462144 1.299098768 1.821283895 H 9.526821119 2.075924527 2.483277258 H 9.111525456 0.586585009 1.619179578 H 10.744497671 0.786515042 2.306030443 92 3a[Au]+ C 2.6064507828 4.0965721265 2.3192216455 C 2.6975069351 4.1200759346 3.7052564347 C 2.1367073688 2.9546997703 1.6577292270 C 2.3444207789 2.9751331119 4.4202676000 C 1.8442908304 1.7820428605 2.3548284281 C 1.9473843204 1.8159568743 3.7467143852 H 3.0774246552 5.0024492731 4.2092118296 H 2.4121665146 2.9710698454 5.5034389896 H 1.5934688006 0.8506316650 1.8708025007 H 1.7239545980 0.9145657394 4.3082958852 C 3.0798032361 5.1130371496 1.3220540990 N 2.1380906955 3.2382761860 0.2372595939 C 2.7225571144 4.4511952400 0.0249398949 C 1.5907667952 2.5115814807 -0.8211414526 C 0.8642869289 1.3190833817 -0.6247266539 C 1.7423293287 3.0325190887 -2.1486611226 C 0.3803315333 0.6102709648 -1.7077457931 C 1.2709475808 2.2466593869 -3.2318997760 C 0.6136333051 1.0548201033 -3.0222729627 H 0.6366903644 0.9727481579 0.3689034967 H 3.2612483086 5.9828827617 -1.3484433379 H -0.1840134726 -0.3003860931 -1.5339762610 H 1.4405099492 2.6055333030 -4.2391999558 H 0.2629067190 0.4701118092 -3.8664755535 C 2.8415861980 4.9923797840 -1.2472291067 C 2.3471064933 4.3186309210 -2.3532415510 C 2.4207488292 4.9954338954 -3.6668933052 C 3.6367127008 5.5651942075 -4.0776539816 C 1.2762898161 5.1829975918 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6.4169685326 2.2677426292 2.1616844506 C 7.0928852176 2.5652786252 3.3468363839 H 6.0131234768 5.7685910049 3.7713069863 H 5.0813161136 2.9871871464 0.6386798172 H 7.4590807426 4.0633326889 4.8542563070 H 6.5306038701 1.2906375934 1.7001757593 H 7.7258922915 1.8178827822 3.8164524702 H 2.6998863931 8.3160986485 1.6759360490 C 9.9817043976 5.6500822670 2.4746886337 H 10.3648146582 5.7001717023 3.4972662869 H 8.9298030950 5.3664130936 2.4980212606 H 10.5461605845 4.9014019906 1.9122342555 C 8.9229958482 9.8494592649 0.1202415668 H 8.3649977973 9.4271534409 -0.7170062097 H 8.2241871297 10.3220112755 0.8135641341 H 9.6297510249 10.5941568530 -0.2489157534 92 3b[Au]-TS+ C 2.8366781358 3.7316217326 1.8316860075 C 2.5026948559 3.5154005527 3.1735941742 C 2.5389380531 2.7444424202 0.8557400188 C 1.8711517032 2.3297974992 3.5273529341 C 1.8805732417 1.5624648995 1.2099083677 C 1.5646310191 1.3657199673 2.5530479959 H 2.7358092979 4.2693287293 3.9181282585 H 1.5979148676 2.1512612713 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-0.5232201291 0.4758574586 H 7.8914753538 4.9744443609 2.5855497195 C 9.3943647867 -0.7638781984 -0.0784301284 H 9.5572165628 -1.4398907667 0.7655117830 H 8.3545886164 -0.4376671700 -0.0824665286 H 9.6151822705 -1.2890073111 -1.0115745990 C 11.0058174265 3.8856929352 0.4259710872 H 11.2549605751 4.3442826944 -0.5348170519 H 10.0347307236 4.2541370237 0.7535952417 H 11.7621539247 4.1599679659 1.1647256341 92 3c[Au]-TS+ C 2.197202983 3.066837134 2.474266920 C 2.181685633 2.775650823 3.843680285 C 2.178766107 2.014036031 1.521467595 C 2.163009600 1.446574142 4.248134676 C 2.220911798 0.678525341 1.929986866 C 2.202706773 0.414056153 3.298243788 H 2.190732742 3.583126630 4.569899099 H 2.138759102 1.201829158 5.305532111 H 2.308739101 -0.143262114 1.235731925 H 2.228214213 -0.619012988 3.630761501 C 2.344865062 4.302693563 1.766850797 N 2.189559220 2.612810922 0.234144392 C 2.269842251 3.989218672 0.394891330 C 2.158977283 2.035378252 -1.044028680 C 1.857229883 0.679296985 -1.241921437 C 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6.771388987 4.062886477 H 5.198547018 11.610472498 3.109693319 H 4.572671261 8.220736384 5.686196466 H 4.288455928 10.645934893 5.214978581 C 4.918276276 5.943425272 1.360203448 C 4.709621030 4.669914470 1.525639225 C 5.112863497 3.314707350 1.548856177 C 5.343253763 2.643406982 2.771400535 C 5.232306370 2.595812851 0.335838093 C 5.687992034 1.299298838 2.774185707 C 5.570015111 1.248437669 0.350133947 C 5.789067056 0.595751666 1.568236749 H 5.242679264 3.192318302 3.700451688 H 5.041174068 3.108883219 -0.600981827 H 5.863083429 0.789693053 3.716349139 H 5.653327293 0.703278322 -0.585221460 H 6.046569947 -0.459238221 1.578250406 H 7.153437985 4.947005947 -0.272198686 C 2.469425104 9.050587362 -1.811023190 H 2.489745173 9.872703473 -2.528484774 H 3.484857966 8.696015167 -1.643355525 H 1.872697996 8.229504988 -2.215595847 C 1.414221099 9.507126653 2.989554465 H 0.698376768 8.718259095 3.236636182 H 2.409873718 9.223694372 3.331868168 H 1.116470677 10.433800578 3.483960157 92 3c[Au]+ C 3.4436238064 4.4667836906 1.7572376561 C 4.1296751977 4.4698136153 2.9636824984 C 2.3151952274 3.6558919395 1.5879032165 C 3.6718042815 3.6534135251 4.0006034924 C 1.8725060907 2.8009441987 2.5972866113 C 2.5620944444 2.8244718085 3.8121944319 H 5.0252578600 5.0707256186 3.0779940285 H 4.1953639113 3.6436743831 4.9513185686 H 1.0598294748 2.1028009555 2.4652285597 H 2.2320587821 2.1715246994 4.6142147726 C 3.7708443383 5.1753275381 0.4642890996 N 1.8731476443 3.7996687456 0.2210948120 C 2.7848134075 4.5343526908 -0.4722814791 C 0.7899053416 3.2024551668 -0.4172780605 C -0.2620732123 2.5934451539 0.2971821755 C 0.7469021098 3.2441688907 -1.8458306476 C -1.2607652857 1.9171035580 -0.3780571078 C -0.2614177288 2.4860917390 -2.4961253388 C -1.2344840062 1.8207056697 -1.7818851953 H -0.3221866625 2.6962431222 1.3692736658 H 3.4334627687 5.3098367605 -2.3412118420 H -2.0688084802 1.4604292409 0.1847122349 H -0.2620849764 2.4438188804 -3.5776986531 H -1.9958742022 1.2497514715 -2.3037036074 C 2.6836061205 4.7027817865 -1.8494493264 C 1.7046629283 4.0386294086 -2.5688307244 C 1.7036065001 4.1430778217 -4.0443464107 C 2.9044879290 3.9056245240 -4.7337465930 C 0.5553337674 4.4984993877 -4.7729776861 C 2.9459730014 3.9878550412 -6.1234080078 C 0.6080653528 4.5976343470 -6.1617892799 C 1.7995097895 4.3329570295 -6.8409840814 H 3.7985305610 3.6351614721 -4.1822421524 H -0.3683019433 4.7252260384 -4.2500160603 H 3.8758377032 3.7800661223 -6.6430850099 H -0.2808066798 4.8865455871 -6.7144534136 H 1.8345655980 4.4015424619 -7.9242850519 H 3.4321702188 6.2221389520 0.5371665994 C 2.5379688403 -1.1931814287 -2.0243413748 C 2.4958226920 -1.4018444507 -0.6836181754 N 3.2018744903 -0.3624686286 -0.0986237630 C 3.6871476491 0.4905228713 -1.0402536058 N 3.2726778399 -0.0360184105 -2.2223066281 H 2.0471620298 -2.1931395616 -0.1037553490 H 2.1268907412 -1.7632084559 -2.8426592015 Au 4.7453676917 2.2614603690 -0.7473306646 C 9.4155442825 3.3486077006 0.0458631619 C 10.6921019776 3.1780334708 0.6109477275 C 9.1873746345 2.9077193299 -1.2844070898 C 11.6941406050 2.5975376005 -0.1547687879 C 10.1997725267 2.3465315574 -2.0699493930 C 11.4525139693 2.1911641225 -1.4837624515 H 10.8871615294 3.5035491078 1.6290999882 H 12.6835087764 2.4586993295 0.2715770818 H 10.0182124255 2.0424554866 -3.0951279394 H 12.2589314649 1.7493908601 -2.0615459463 C 8.1884153088 3.9126763839 0.5156492133 N 7.8551115462 3.1840475580 -1.5938197974 C 7.2490406346 3.8090479641 -0.4888868297 C 7.2923091732 3.0001703939 -2.8779109304 C 7.3368737891 1.7312778360 -3.4703763336 C 6.7505925665 4.0799729776 -3.5838184192 C 6.8785382738 1.5542517423 -4.7753899454 C 6.2898978450 3.8948300317 -4.8868253096 C 6.3583141176 2.6360253038 -5.4904212848 H 7.7467124274 0.9024161252 -2.9026630216 H 6.7229642694 5.0593375487 -3.1189410054 H 6.9371806665 0.5721880386 -5.2367273278 H 5.8924522117 4.7423757550 -5.4379447496 H 6.0241329549 2.4999040913 -6.5151067929 C 5.8010322490 4.0145282798 -0.3989966460 C 5.2518546825 5.1709229071 0.0638777812 C 5.9566792421 6.4598656662 0.3085069211 C 7.0140993981 6.8832515633 -0.5194968048 C 5.5549292475 7.3325082222 1.3382886257 C 7.6438276861 8.1061702889 -0.3195552446 C 6.1880962243 8.5591354666 1.5429987906 C 7.2368627194 8.9530247921 0.7154359857 H 7.3498017137 6.2418534214 -1.3248709716 H 4.7457738811 7.0572194327 2.0088054914 H 8.4538737430 8.4037781800 -0.9794328144 H 5.8567658120 9.2041421430 2.3520376467 H 7.7294301058 9.9084855572 0.8691679040 H 7.9927359182 4.3248036729 1.4949955324 C 3.4101515392 -0.2387616042 1.3410500124 H 3.9410982249 -1.1165519127 1.7191130189 H 3.9993000558 0.6563624465 1.5367160194 H 2.4462522202 -0.1514109858 1.8498947435 C 3.5253005120 0.5656152066 -3.5285454356 H 2.7277716855 1.2661494370 -3.7865414279 H 4.4768332115 1.0955906544 -3.5057258899 H 3.5760729496 -0.2221129990 -4.2828296354 92 3d[Au]-TS+ C 3.1681808977 4.8659381828 1.7916198099 C 3.0718089182 5.3762858432 3.0920122370 C 2.5327547734 3.6402365542 1.4714486764 C 2.2855045394 4.7030743416 4.0203964916 C 1.7096341136 2.9830720131 2.3891188433 C 1.5923674745 3.5349969248 3.6638158308 H 3.6091336308 6.2799435140 3.3604330955 H 2.1990630094 5.0870086853 5.0323940970 H 1.1383657199 2.1030668716 2.1260296848 H 0.9533766204 3.0456206760 4.3923075131 C 3.7969608825 5.3659830303 0.5886881907 N 2.7912011589 3.3767425792 0.1004712678 C 3.4203586670 4.4837623295 -0.4450224410 C 2.5830815546 2.2224256384 -0.6545306240 C 2.2730815513 0.9918194367 -0.0533013627 C 2.7713016406 2.3028436161 -2.0687798836 C 2.0818712771 -0.1350980881 -0.8347942335 C 2.5705255703 1.1256841371 -2.8289638105 C 2.2109583311 -0.0675172152 -2.2307606386 H 2.2475379776 0.9054609971 1.0225981757 H 4.0665161218 5.4704547966 -2.2257595181 H 1.8591204887 -1.0818193605 -0.3529522778 H 2.7346706894 1.1649792082 -3.8985012458 H 2.0710138228 -0.9574580616 -2.8355833169 C 3.6393491652 4.5577074371 -1.8263392712 C 3.2562547109 3.5308590331 -2.6612100288 C 3.3820714421 3.7201299746 -4.1236678633 C 4.5641955102 4.2510083344 -4.6668629605 C 2.2976218317 3.4630599011 -4.9793627941 C 4.6592672104 4.5127675224 -6.0319530671 C 2.3930223494 3.7342220526 -6.3423321073 C 3.5736101581 4.2580267186 -6.8724738191 H 5.4125394272 4.4463596300 -4.0173176183 H 1.3693676610 3.0801555825 -4.5667303865 H 5.5810388947 4.9164658914 -6.4403624809 H 1.5409788139 3.5452167195 -6.9886502374 H 3.6462692313 4.4690472059 -7.9351858505 H 4.0475555199 6.3946897030 0.3942983755 C 4.3225078585 11.3496553541 3.5876958631 C 3.1186653916 10.8090608189 3.2725123786 N 3.3773028433 9.6113053807 2.6265697183 C 4.7160021297 9.3847791082 2.5378337645 N 5.2865088166 10.4653994498 3.1334361091 H 2.1153546733 11.1644458386 3.4474637363 H 4.5753330901 12.2737684145 4.0832224973 Au 5.6830903347 7.7414468650 1.7388042229 C 5.8743953209 1.4550469418 -0.3844752588 C 5.7719265149 0.3210196083 -1.2186998973 C 5.7296457944 1.3062012595 1.0301038371 C 5.5437860820 -0.9128341849 -0.6408697608 C 5.5476028091 0.0429422540 1.6177503483 C 5.4504435834 -1.0485674018 0.7674050544 H 5.8598793013 0.4290935592 -2.2949687955 H 5.4525918768 -1.7951679161 -1.2663227439 H 5.4938077649 -0.0752541134 2.6932182588 H 5.3059041878 -2.0366779366 1.1941389343 C 6.0793231971 2.8300841836 -0.6397399417 N 5.8323575433 2.5575299902 1.6088579728 C 6.0460740528 3.5105061166 0.5789327007 C 5.7956956009 2.8283922616 3.0067979203 C 6.7712838331 3.6409292750 3.5942586974 C 4.7865867392 2.2635511801 3.7924337881 C 6.7239591600 3.8942789170 4.9636193856 C 4.7620516862 2.5043959381 5.1644173209 C 5.7257725106 3.3230183928 5.7546164640 H 7.5652793364 4.0619168371 2.9914818251 H 4.0112866069 1.6692790553 3.3257289177 H 7.4843522463 4.5261397775 5.4134464268 H 3.9751266371 2.0636201126 5.7691033082 H 5.7018698713 3.5119838617 6.8237680352 C 6.0353350229 4.8946528270 0.7985468948 C 6.6702544689 6.0170085192 1.0464628844 C 8.1695986773 6.0661917961 1.0192125685 C 8.8176800689 7.3150771670 1.0525598710 C 8.9802320476 4.9179220377 0.9262242132 C 10.2066259687 7.4172173198 1.0104430405 C 10.3685979104 5.0177063660 0.8928875397 C 10.9909807538 6.2672330462 0.9366564086 H 8.2186574826 8.2203504164 1.0880180926 H 8.5242967845 3.9364091890 0.8629034770 H 10.6736213049 8.3981210890 1.0302709250 H 10.9677539777 4.1141820588 0.8247941836 H 12.0738939382 6.3427897417 0.9050755586 H 6.2132823592 3.3057746502 -1.5987691402 C 2.3281149883 8.7068555033 2.1628668060 H 1.5024667643 9.2943044072 1.7562457894 H 2.7278833747 8.0629327160 1.3817862004 H 1.9634865696 8.0838968775 2.9834433493 C 6.7220078274 10.7198743418 3.2346836564 H 6.9581774336 11.0710780429 4.2416176986 H 7.2623845929 9.7937309321 3.0418059717 H 7.0230085701 11.4762074061 2.5045650459 92 3d[Au]+ C 3.6114019648 4.7552589880 2.4484852258 C 3.9565485534 5.2295693529 3.7066934837 C 2.5148177248 3.9004757451 2.2857618601 C 3.1927683914 4.8323005665 4.8061104605 C 1.7721476798 3.4586189992 3.3817250162 C 2.1214282106 3.9503899548 4.6411413618 H 4.8224012822 5.8722198075 3.8184066369 H 3.4502855795 5.1883277798 5.7990995343 H 0.9892752041 2.7207450160 3.3082807657 H 1.5572170698 3.6167641961 5.5064290547 C 4.2548385073 5.0238109735 1.1115370681 N 2.4314992485 3.5580717603 0.8823536131 C 3.4851442257 4.1070158365 0.2177360252 C 1.5309296788 2.7244374566 0.2264877888 C 0.3354796171 2.2869471527 0.8299503274 C 1.8410150365 2.3148590994 -1.1107076546 C -0.4742507142 1.3751156538 0.1819195422 C 1.0112876050 1.3339578915 -1.7141377504 C -0.1156189826 0.8614392118 -1.0785545167 H 0.0194898141 2.6961011263 1.7753694439 H 4.5985844241 4.2794613270 -1.5838667320 H -1.3946268874 1.0521076590 0.6583727045 H 1.2815001626 0.9592638910 -2.6926794222 H -0.7356604352 0.1103665476 -1.5567823653 C 3.7426986452 3.8132694592 -1.1132815747 C 2.9706002046 2.8837507551 -1.7930960458 C 3.3603992313 2.5184841639 -3.1712161882 C 4.6966850170 2.1627113628 -3.4238693869 C 2.4516932263 2.5781255478 -4.2427046075 C 5.1084877202 1.8513193068 -4.7165631135 C 2.8746580487 2.2818691733 -5.5363156853 C 4.2007128492 1.9117785374 -5.7752585667 H 5.4070612924 2.1049720360 -2.6081754010 H 1.4277924938 2.8935944992 -4.0672511803 H 6.1417768444 1.5637727306 -4.8843206085 H 2.1700998371 2.3479000630 -6.3599581781 H 4.5243702937 1.6765342663 -6.7848780226 H 3.9442024972 6.0412887781 0.8118470335 C 4.1098056001 11.9712575212 2.6697386245 C 2.9826735518 11.3020343671 3.0208372133 N 3.2495528451 9.9543297764 2.8396583097 C 4.5146199962 9.7636262989 2.3774290632 N 5.0346939291 11.0157730782 2.2819135794 H 2.0324971977 11.6587233769 3.3861223802 H 4.3354516668 13.0260741550 2.6694510084 Au 5.4336025864 7.9648819457 1.8793268003 C 7.5738089695 2.7372822477 -1.2694306442 C 8.3078521870 2.2498013195 -2.3667011588 C 6.8359670772 1.8256873843 -0.4699262322 C 8.2986318153 0.8863607170 -2.6320366185 C 6.8572820319 0.4460610513 -0.7090369943 C 7.5887926092 -0.0078044794 -1.8020872285 H 8.8718694411 2.9350349779 -2.9924283900 H 8.8620117340 0.4976526613 -3.4752834398 H 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7.9676422927 8.0496099793 0.1393038507 H 8.1672814674 4.6158606942 2.7082765884 H 10.4325498945 8.2801864417 0.2505575013 H 10.6247894522 4.8637775277 2.8541834822 H 11.7720068453 6.6941339480 1.6219252546 H 7.7015366864 4.9808011583 -1.1297690355 C 2.2731251176 8.8959276417 3.0780035460 H 1.5451952971 8.8590788742 2.2620438479 H 2.7923471954 7.9395446498 3.1428452414 H 1.7516787475 9.0862597628 4.0192425989 C 6.3801148992 11.3382580322 1.8110770932 H 6.8651820790 12.0124492920 2.5210235401 H 6.9598401806 10.4184997570 1.7350716231 H 6.3300266316 11.8176546948 0.8295147830 38 2a C 3.6126081748 4.5041914825 1.2336564508 C 4.2840096716 4.7619512323 2.4427911421 C 2.4893511635 3.6213087613 1.2176598744 C 3.8591052744 4.1307155628 3.5997799655 C 2.0946496784 2.9536882836 2.3873794896 C 2.7825181473 3.2226839415 3.5652631812 H 5.1334867998 5.4390051302 2.4539232197 H 4.3706494493 4.3190844960 4.5391976162 H 1.3103469850 2.2107521678 2.3938314978 H 2.4872935573 2.7079567202 4.4746002948 C 3.8510380827 4.9346406456 -0.0996117747 N 2.0340494677 3.5557866280 -0.1055529225 C 2.9048471518 4.3350739404 -0.9006047948 C 0.9176868616 2.9229168871 -0.6705347127 C -0.0843481184 2.3371997146 0.1189822759 C 0.7918427700 2.8995328971 -2.0925072787 C -1.1359923232 1.6426812823 -0.4662228514 C -0.2630920338 2.1492387708 -2.6480844300 C -1.2102947633 1.5168649779 -1.8559633621 H -0.0643407148 2.4562999966 1.1906667475 H 3.4082528076 4.9623695143 -2.8949033882 H -1.8974633506 1.2000781073 0.1686448819 H -0.3322282459 2.0743434268 -3.7268066112 H -2.0115134781 0.9478266190 -2.3168878285 C 2.7250015924 4.3551959552 -2.3105506800 C 1.7294792174 3.6519311257 -2.9210452971 C 1.6074686488 3.7115590959 -4.4018834191 C 2.7118960397 3.3885396516 -5.2056621581 C 0.4274741363 4.1467543106 -5.0291922596 C 2.6408354416 3.4915879972 -6.5946674402 C 0.3569739385 4.2495767521 -6.4175683569 C 1.4620883892 3.9205147913 -7.2056532513 H 3.6255462150 3.0438989499 -4.7307900313 H -0.4279521814 4.4226798521 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C 0.2552308516 6.1051677985 2.2868779065 C 2.2587281984 4.7223144465 2.0866291023 C 1.4751480393 5.6232161755 2.8003146098 H -1.1085594159 6.1004622347 0.6105071162 H -0.3360918401 6.7995553739 2.8767510364 H 3.2123665350 4.4144405017 2.4910719671 H 1.8219409260 5.9672384086 3.7701749858 C 0.4420211351 4.3097098569 -1.0460550718 N 2.3460642095 3.4266713185 -0.1247368043 C 1.5243294033 3.4780203803 -1.2698797907 C 3.4392756822 2.5509281197 -0.0690596027 C 4.1127860433 2.2775569052 1.1315137958 C 3.8431886920 1.8927054773 -1.2694244353 C 5.2225284367 1.4416306292 1.1488781627 C 4.9815204092 1.0649383217 -1.2126583863 C 5.6769328253 0.8484596583 -0.0311273347 H 3.7444756735 2.6815964911 2.0612070456 H 1.2786471369 2.9027441215 -3.3099441759 H 5.7250055498 1.2456911087 2.0914448493 H 5.3177814396 0.5687423382 -2.1156231892 H 6.5504443917 0.2038436810 -0.0238195177 C 1.9225923932 2.7823382103 -2.4471027951 C 3.0619827266 2.0412639898 -2.4956205001 C -0.6344841112 4.6345713593 -2.0093831687 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2.3582078488 5.3895127582 H 0.3390145925 1.2738279452 1.9581228138 H 0.8299795781 1.0693957946 4.3403071233 C 3.6668685324 4.1933432989 1.1533023713 N 1.8493387448 3.1119998124 0.2530015692 C 2.9664761218 3.9244059731 -0.0153167560 C 0.8742128314 2.8855474458 -0.7329845243 C -0.3410772281 2.2398492199 -0.4536756764 C 1.1115783315 3.3725630614 -2.0550815324 C -1.2722268186 2.0108797994 -1.4588606388 C 0.1556333822 3.1011365133 -3.0527519810 C -1.0188984521 2.4213068569 -2.7711235087 H -0.5846015630 1.9520195814 0.5557204017 H 4.0896645965 4.9476086147 -1.5240744547 H -2.2042943619 1.5117704705 -1.2108605552 H 0.3561022283 3.4452787244 -4.0614386175 H -1.7383188585 2.2244306633 -3.5598777355 C 3.2060520673 4.3555224325 -1.3430521709 C 2.3185815725 4.1270768095 -2.3474369306 C 2.5818049369 4.7620535644 -3.6652066317 C 3.7612108486 4.4774431930 -4.3678919808 C 1.7264766727 5.7626040665 -4.1538120476 C 4.0776538553 5.1734237997 -5.5347439450 C 2.0475877716 6.4620252324 -5.3152045911 C 3.2221386847 6.1679334409 -6.0107015600 H 4.4294250143 3.7089236601 -3.9894263215 H 0.8364677535 6.0245952670 -3.5913572553 H 4.9953475202 4.9424220637 -6.0685135553 H 1.3911781519 7.2550406353 -5.6606153766 H 3.4738868621 6.7178862227 -6.9130995260 C 2.1898382836 8.0036131364 -0.9900609451 C 0.9177217565 8.4427677916 -1.4006875701 C 3.3326349246 8.4307282207 -1.7194442490 C 0.8161372555 9.2718121274 -2.5100188355 C 3.2350565917 9.2591700292 -2.8415856868 C 1.9640673153 9.6737462191 -3.2247070784 H 0.0303598263 8.1269355424 -0.8601825283 H -0.1611704170 9.6154907898 -2.8374514176 H 4.1180485971 9.5540418412 -3.3981487066 H 1.8541886496 10.3156836020 -4.0941420320 C 2.6536117294 7.1342576302 0.0423463633 N 4.4454560436 7.8379743742 -1.1390569641 C 4.0250481552 7.0277822113 -0.0647324887 C 5.7744960794 7.9929121579 -1.6137945112 C 6.3284908501 9.2761175461 -1.6828016750 C 6.5216275862 6.8851606621 -2.0287436978 C 7.6229053180 9.4496491253 -2.1697996551 C 7.8227872378 7.0643839374 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1.4264553955 C 3.8816867706 6.1489695496 3.7450825242 C 1.8497527763 5.8275866320 2.4313792007 C 2.4893940206 6.2820708045 3.5792290366 H 5.7212291982 5.3827867799 2.9155693186 H 4.3499466956 6.5216722095 4.6513370962 H 0.7735447271 5.8955923512 2.3596884559 H 1.8953434190 6.7360176044 4.3667974799 C 4.5352157418 4.3054235289 0.4916490409 N 2.2960287421 4.6813955166 0.1862298616 C 3.4532569721 4.0912939851 -0.3539866869 C 1.0898016622 4.6826668904 -0.5242123557 C 0.0008286861 5.4812852401 -0.1389002595 C 0.9799008084 3.8551001383 -1.6828041067 C -1.2173642841 5.3854198146 -0.7994938972 C -0.2857854711 3.7453754975 -2.2933732398 C -1.3750820859 4.4856325274 -1.8585999000 H 0.1179737183 6.2039722145 0.6536960011 H 4.2621891428 2.9274941490 -1.9578981569 H -2.0447422156 6.0131650551 -0.4827566586 H -0.4003657046 3.0657636511 -3.1291711752 H -2.3358526269 4.3787802398 -2.3526908969 C 3.3562515405 3.3698619612 -1.5677187398 C 2.1634674072 3.1826315927 -2.2039681753 C 2.1344459986 2.2886572146 -3.3896351661 C 2.6963952968 1.0056491544 -3.2735286125 C 1.6210692406 2.6890691819 -4.6339662438 C 2.7313140347 0.1433942443 -4.3675671605 C 1.6564882548 1.8235459907 -5.7266960473 C 2.2079644727 0.5470735396 -5.5968673743 H 3.0941945876 0.6843541279 -2.3157132567 H 1.2110899998 3.6880547499 -4.7481045794 H 3.1664491417 -0.8457654244 -4.2545161777 H 1.2607743662 2.1501668049 -6.6844344775 H 2.2315236004 -0.1259940388 -6.4493071478 C 8.6359841349 6.2297028386 1.3855061339 C 9.7821291101 6.7543470267 2.0076333900 C 7.7192356085 7.1189626825 0.7607419227 C 9.9923748876 8.1260780899 1.9764002874 C 7.9360274206 8.4989381495 0.7112249275 C 9.0811045211 8.9878703693 1.3298980339 H 10.4893046745 6.0930553935 2.4992904097 H 10.8726967452 8.5465821016 2.4539596771 H 7.2337236895 9.1570135295 0.2105503808 H 9.2768157543 10.0561395324 1.3164388354 C 8.1079364678 4.9112495054 1.2234984315 N 6.6746423826 6.3608341210 0.2490266003 C 6.9195101131 5.0112056951 0.5323337032 C 5.6438619224 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-1.9278366755 6.3110679211 -3.0561981631 H -1.7728430897 7.3058164633 -3.4826280961 C -3.4400862279 6.1634950997 -2.8207274430 C -1.4242350152 5.2978073499 -4.0992709332 H -0.3472590795 5.3918938666 -4.2633733297 H -1.6284776277 4.2747101536 -3.7667960120 H -1.9340066432 5.4457256723 -5.0578527452 H -3.7063715267 5.1562871689 -2.4843598613 H -3.9834486927 6.3489696751 -3.7529320696 H -3.7974068177 6.8746974293 -2.0701965147 C 1.7610137757 8.1278781630 -0.0034473328 H 2.0528433850 8.6007087113 -0.9462414932 C 3.0422390369 7.5403713712 0.6091971623 C 1.1651846340 9.2294258768 0.8965452841 H 0.2873603273 9.6910056522 0.4318542208 H 0.8543012929 8.8178797956 1.8628200196 H 1.9048284746 10.0153696965 1.0835330088 H 2.8655492524 7.1165526181 1.6033201597 H 3.7964560168 8.3263960615 0.7188660661 H 3.4591549726 6.7541889914 -0.0267954097 H -1.0678834960 9.5744677685 -2.5010545108 H 0.4127486443 10.4391583081 -4.7037308435 Au 2.8502056439 6.2334786362 -2.9837045437 C 2.2476527662 2.9981012776 0.7792503342 C 1.6466723366 2.7047953124 2.0221184351 C 1.7121896703 2.4120589286 -0.4061876532 C 0.5489284625 1.8643373745 2.0485386350 C 0.6089591473 1.5459524493 -0.3774336188 C 0.0360876967 1.2896470387 0.8578358063 H 2.0406282101 3.1368334267 2.9368098831 H 0.0714495416 1.6317343511 2.9953869494 H 0.2226907630 1.1037961726 -1.2892356140 H -0.8223149915 0.6275028199 0.9179021396 C 3.3214048116 3.8382976371 0.3840708656 N 2.4543075055 2.8536214353 -1.4765541661 C 3.4276751513 3.7494278284 -0.9983234482 C 2.2229592304 2.5816349479 -2.8520273024 C 0.9865738348 2.9073187785 -3.4119951370 C 3.2445207217 2.0376092455 -3.6357211290 C 0.7660599861 2.6684536402 -4.7662781971 C 3.0184992816 1.8162909711 -4.9933738970 C 1.7788311864 2.1247033722 -5.5582359400 H 0.2270282524 3.3582757441 -2.7828283309 H 4.1957821958 1.7865214497 -3.1791058481 H -0.1936205773 2.9174348936 -5.2073386184 H 3.8074331003 1.3913208655 -5.6064188356 H 1.6035938292 1.9435284678 -6.6142670022 C 4.1958052203 4.4894113003 -1.9046085739 C 4.7814149916 5.1042923962 -2.8208720488 C 5.9107114746 5.3964654831 -3.6705553065 C 5.7792249801 6.1677013534 -4.8386223026 C 7.1750320386 4.8906495853 -3.3109076474 C 6.8939466846 6.4208029058 -5.6326778943 C 8.2830045566 5.1549107446 -4.1086354653 C 8.1454626703 5.9187372604 -5.2711735099 H 4.8119103611 6.5670830833 -5.1232297169 H 7.2758759291 4.2988944027 -2.4067515009 H 6.7794346393 7.0172786265 -6.5320606012 H 9.2552117361 4.7638772602 -3.8239473441 H 9.0134660523 6.1217709775 -5.8915015050 H 3.9339920615 4.4658581819 1.0141648117 104 2a[IPrAu]+ C 2.4629570157 9.4657668558 -7.5816179658 C 1.1288594327 9.1396858665 -7.3267465470 C 2.9127392749 9.5770593948 -8.9162098961 C 0.2799140567 8.9008276291 -8.4065726756 C 2.0864206165 9.2811168124 -9.9995042285 C 0.7566400179 8.9547183323 -9.7240371206 H 0.7705704979 9.0590385594 -6.3053420377 H -0.7600311228 8.6465644415 -8.2269699018 H 2.4460738053 9.2624679415 -11.0205691255 H 0.0878589376 8.7284320468 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5.3833608780 14.7697447641 -3.5079174993 C 6.5808195759 15.4782135930 -3.5507458619 H 8.6964970985 15.4461082940 -3.1801482652 H 4.4652680682 15.2485848722 -3.8346545204 H 6.5893792167 16.5026331368 -3.9123942175 C 4.4722521190 7.6275644557 -1.9894301143 H 4.6558502044 8.3907467938 -1.2253137377 C 3.6531194522 6.5135353768 -1.3200379249 C 3.6610656714 8.3027339176 -3.1147788030 H 4.2061861211 9.1548415979 -3.5297803116 H 3.4701073071 7.5949648507 -3.9295106038 H 2.6971164081 8.6598027537 -2.7346871036 H 3.2938270228 5.7767909128 -2.0463986469 H 2.7714011734 6.9414690805 -0.8325924555 H 4.2382970296 5.9837685947 -0.5619241511 C 9.3799618543 8.5789173124 -3.1684607176 H 9.0594516820 9.5717534061 -2.8420851537 C 9.9281230717 8.7344273927 -4.5978659846 C 10.4756798466 8.1078028883 -2.1927278780 H 10.0932278115 8.0383696731 -1.1688153909 H 10.8607843581 7.1211237190 -2.4726080610 H 11.3173240769 8.8089129439 -2.1960356588 H 10.3145934112 7.7872183351 -4.9894158833 H 10.7491983773 9.4577158078 -4.6124399302 H 9.1559284760 9.0930938455 -5.2843437862 C 9.0953816676 12.8943733435 -2.2606324064 H 8.8613775313 11.9784204940 -1.7103045256 C 9.9550857537 13.7649320960 -1.3291292287 C 9.8723247726 12.4738948885 -3.5219898148 H 9.2699688284 11.8204554624 -4.1599419146 H 10.1551297517 13.3540210317 -4.1103190260 H 10.7896985013 11.9386074987 -3.2522265908 H 10.3135397508 14.6707677600 -1.8288219103 H 10.8362120557 13.2048035456 -0.9992696170 H 9.3948470918 14.0718466993 -0.4401649762 C 4.0229777212 12.6883918492 -2.9991597970 H 4.2316145327 11.6607305718 -2.6887047269 C 3.3608716296 12.6158931526 -4.3874303350 C 3.0740276570 13.3066634006 -1.9549777706 H 3.5315440524 13.3166155316 -0.9601346424 H 2.8186614173 14.3397665200 -2.2147365761 H 2.1412831712 12.7355122685 -1.8961715004 H 3.0729887624 13.6087042527 -4.7494775858 H 2.4518579782 12.0052833067 -4.3420359873 H 4.0378205149 12.1702398309 -5.1223863774 H 6.5946847788 11.8593277359 -0.0305135540 H 6.8688730450 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