Version2.4 2021-06-08T06:33:24Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 17-Dec-2019 #N HF/6-31G(d) OPT=(MaxStep=1,RFO) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cccc(c1)N2C(=O)[C@@H]3[C@H]4C[C@H]5[C@]6(CCC[C@@]([C@H]6CC[C@]5([C@@H]3C2=O)C=C4C(C)C)(C)C(=O)[O-])C C12661516 RHF 6-31G(d) (6D,7F) Cc1cccc(c1)N2C(=O)[C@@H]3[C@H]4C[C@H]5[C@]6(CCC[C@@]([C@H]6CC[C@]5([C@@H]3C2=O)C=C4C(C)C)(C)C(=O)[O-])C C01[X(C31H38N1O4)] 216 C1 616 Cc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]13CC[C@H]4[C@]([C@@H]3C[C@H]2C(=C1)C(C)C)(C)CCC[C@@]4(C)C(=O)[O-] Cc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]13CC[C@H]4[C@]([C@@H]3C[C@H]2C(=C1)C(C)C)(C)CCC[C@@]4(C)C(=O)[O-] CC(C)C1=C[C@@]23CC[C@H]4[C@](C)(CCC[C@@]4(C)C([O-])=O)[C@@H]2C[C@@H]1[C@@H]5[C@H]3C(=O)N(C5=O)c6cccc(C)c6 InChIKey=MRRXYEYSIFOGFP-WYBWAZTESA-M InChI=1S/C31H39NO4/c1-17(2)21-16-31-13-10-22-29(4,11-7-12-30(22,5)28(35)36)23(31)15-20(21)24-25(31)27(34)32(26(24)33)19-9-6-8-18(3)14-19/h6,8-9,14,16-17,20,22-25H,7,10-13,15H2,1-5H3,(H,35,36)/p-1/t20-,22-,23-,24+,25-,29-,30+,31-/m0/s1 InChI=1/C31H39NO4/c1-17(2)21-16-31-13-10-22-29(4,11-7-12-30(22,5)28(35)36)23(31)15-20(21)24-25(31)27(34)32(26(24)33)19-9-6-8-18(3)14-19/h6,8-9,14,16-17,20,22-25H,7,10-13,15H2,1-5H3,(H,35,36)/p-1/t20-,22-,23-,24+,25-,29-,30+,31-/m0/s1/fC31H38NO4/q-1 Cc1cccc(c1)N2C(=O)[C@@H]3[C@H]4C[C@H]5[C@]6(CCC[C@@]([C@H]6CC[C@]5([C@@H]3C2=O)C=C4C(C)C)(C)C(=O)[O-])C C01[X(C31H38N1O4)] 216 C01 616 Cc1cccc(c1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]13CC[C@H]4[C@]([C@@H]3C[C@H]2C(=C1)C(C)C)(C)CCC[C@@]4(C)C(=O)[O-] O=C1N([C]2[CH][CH][CH][C]([CH]2)C)C(=O)[C@H]2[C@@H]1[C@@]13CC[C@H]4[C@]([C@@H]3C[C@H]2C(=C1)C(C)C)(C)CCC[C@@]4(C)[C]([O])[O] C[C]1[CH][CH][CH][C]([CH]1)N2C(=O)[C@@H]3[C@H]4C[C@H]5[C@@]6(C)CCC[C@@](C)([C]([O])[O])[C@H]6CC[C@@]5(C=C4C(C)C)[C@@H]3C2=O InChIKey=XMFQZQMJDWDWRG-WYBWAZTESA-N InChI=1S/C31H38NO4/c1-17(2)21-16-31-13-10-22-29(4,11-7-12-30(22,5)28(35)36)23(31)15-20(21)24-25(31)27(34)32(26(24)33)19-9-6-8-18(3)14-19/h6,8-9,14,16-17,20,22-25H,7,10-13,15H2,1-5H3/t20-,22-,23-,24+,25-,29-,30+,31-/m0/s1 InChI=1/C31H38NO4/c1-17(2)21-16-31-13-10-22-29(4,11-7-12-30(22,5)28(35)36)23(31)15-20(21)24-25(31)27(34)32(26(24)33)19-9-6-8-18(3)14-19/h6,8-9,14,16-17,20,22-25H,7,10-13,15H2,1-5H3/t20-,22-,23-,24+,25-,29-,30+,31-/m0/s1 4178.1508674174 -1550.0163456 1-A 19209.4037 132 484 616 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.48010 -20.47685 -20.29534 -20.29047 -15.55014 -11.29409 -11.29168 -11.21806 -11.18544 -11.17601 -11.17501 -11.17304 -11.17193 -11.17190 -11.17184 -11.16956 -11.16919 -11.16876 -11.15932 -11.15549 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2211.28 2221.77 2224.18 2230.93 2233.80 2247.47 2252.84 2259.26 2262.76 2305.65 2342.90 2348.85 2350.29 2351.44 2355.80 2359.29 2365.84 2366.70 2372.91 2375.17 2377.87 2380.52 2382.84 2388.01 2396.38 2404.60 2422.45 2581.37 2613.69 2690.00 2714.82 2838.26 2937.52 4560.24 4582.82 4593.64 4594.41 4596.98 4605.35 4606.77 4610.31 4614.13 4615.90 4617.43 4628.07 4642.33 4651.92 4657.51 4674.72 4678.87 4680.46 4682.86 4685.40 4687.64 4691.99 4697.81 4702.67 4704.21 4710.44 4711.98 4715.32 4725.89 4738.72 4768.48 4790.36 4809.92 4821.61 4845.96 4854.03 4877.29 4910.81 0.683725 0.714259 0.715203 0.622219 -1549.332620 -1549.302087 -1549.301143 -1549.394126 3.118665D-04 MUNgauss RevisionA2.1 retrievium 08-Jun-2021 DUDE Cc1cccc(c1)N2C(=O)[C@@H]3[C@H]4C[C@H]5[C@]6(CCC[C@@]([C@H]6CC[C@]5([C@@H]3C2=O)C=C4C(C)C)(C)C(=O)[O-])C C12661516 RHF 6-31G(d) (6D,10F) C1 488.280084 |X|Y|Z| 117.127971 61.416926 41.449784 66.807259 25 6 7 24 1 |36.858105| |12.604037|36.858105| |7.534609|13.741190|36.858105| |5.008356|7.906626|13.734899|36.858105| |4.423853|6.815990|7.926061|13.795426|36.858105| |5.024732|7.902564|6.899559|7.980876|13.729269|36.858105| |7.577969|13.697611|7.978859|6.906318|7.927811|13.783304|36.858105| |3.855508|5.134746|4.550066|5.158222|7.823080|13.361492|7.843740|53.358707| |3.515841|4.327396|3.750955|4.019397|5.352524|7.699007|6.198707|18.769684|36.858105| |3.770030|4.489903|3.775835|3.859947|4.795934|6.647677|6.238894|11.341205|15.975210|73.516695| |2.787259|3.273606|2.953255|3.192537|4.082283|5.113901|4.275025|11.047201|12.612145|14.011299|36.858105| |2.693440|3.051144|2.701720|2.829180|3.467888|4.338172|3.917916|8.411494|9.050749|12.535356|17.574629|0.500000| |2.401587|2.779636|2.599006|2.844668|3.532923|4.046582|3.420083|7.542557|7.480476|10.849737|12.314317|0.245447|36.858105| |2.407170|2.741823|2.542227|2.729379|3.302470|3.790906|3.331684|6.644558|6.909348|11.691443|8.814294|0.212349|17.588888|0.500000| |2.058738|2.323034|2.187808|2.368822|2.846094|3.172812|2.773924|5.595261|4.959515|7.548575|7.741354|0.200988|12.365674|0.243171|36.858105| |1.985534|2.256716|2.156098|2.367729|2.858286|3.114435|2.675801|5.476459|4.367033|6.404583|6.463442|0.161641|7.498773|0.151585|12.232832|36.858105| |1.834777|2.080168|2.020535|2.234564|2.661842|2.809169|2.416735|4.746507|3.693932|5.591401|4.966813|0.123853|6.107449|0.132093|8.921114|17.548879|0.500000| |1.824476|2.029777|1.927463|2.076193|2.440329|2.664464|2.371388|4.508987|3.524352|5.346818|4.843056|0.135806|4.931228|0.112265|7.202205|12.101550|0.251356|36.858105| |1.920690|2.108437|1.959445|2.067900|2.414784|2.717737|2.486089|4.607569|3.671059|5.615405|5.027156|0.157040|4.568080|0.108387|6.021765|7.256458|0.152094|12.304140|36.858105| |1.734918|1.871311|1.746558|1.823745|2.080411|2.305439|2.156381|3.739377|2.894406|4.570775|3.627472|0.111554|3.340675|0.082898|4.110056|4.770466|0.113026|7.388971|12.417911|36.858105| |1.669602|1.808582|1.710454|1.799167|2.042438|2.219803|2.060685|3.540422|2.629321|4.124632|3.186809|0.093280|2.935046|0.072266|3.471276|4.273844|0.106115|6.291796|7.487570|12.441692|36.858105| |1.596796|1.747770|1.679435|1.793541|2.043045|2.173508|1.980262|3.462368|2.546800|3.975750|3.098113|0.087098|2.983236|0.072465|3.600613|4.755185|0.125428|7.170858|6.312184|7.437485|12.398492|36.858105| |1.737249|1.935711|1.865470|2.024119|2.358114|2.510215|2.226686|4.124881|3.040441|4.623412|3.869162|0.104952|3.801861|0.088481|4.770581|7.433537|0.193456|12.137421|7.471383|6.436916|7.484383|12.154343|36.858105| |1.636894|1.825178|1.780339|1.944936|2.251406|2.348576|2.075547|3.794620|2.789586|4.295964|3.466218|0.092157|3.579040|0.084138|4.469341|6.794461|0.208833|8.816031|5.499675|4.895490|5.523589|8.884858|17.546336|0.500000| 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|2.583012|2.998455|2.747655|2.974661|3.722941|4.453496|3.787909|8.687122|6.197684|8.119718|8.729312|0.224085|5.711576|0.125657|5.511086|6.546062|0.136701|5.911290|6.601174|4.711194|4.389519|4.119987|5.231848|0.118927|6.536747|6.794504|8.686612|17.640579|0.500000| |3.152747|3.985935|3.738967|4.336051|6.198648|7.667586|5.328639|18.564885|8.222787|9.800083|7.906777|0.165667|5.497274|0.124443|4.428196|4.820062|0.113894|3.928212|3.908044|3.118475|3.034745|3.014544|3.715555|0.093427|4.685658|5.944666|7.350805|12.515087|0.253359|36.858105| |3.043616|3.855135|3.787560|4.529952|6.314257|6.708830|4.821643|11.388849|5.539209|7.494222|5.330764|0.122274|4.205791|0.098585|3.626844|4.110720|0.101781|3.516357|3.440949|2.877823|2.921793|2.944892|3.555456|0.090679|4.704508|5.963920|6.080181|7.803171|0.191207|16.037984|73.516695| |2.271132|2.704548|2.672322|3.106064|3.971154|4.095457|3.229679|7.311349|5.338379|7.511914|6.657862|0.138526|8.036198|0.160014|6.708843|7.766086|0.210551|4.845104|3.981094|3.075224|2.956374|3.220077|4.358309|0.120484|4.897868|7.498008|12.520770|7.804972|0.155395|6.528211|9.788223|36.858105| |2.351151|2.784780|2.711267|3.095521|3.919787|4.167889|3.348602|7.433423|6.183589|9.024749|7.586579|0.153776|12.506302|0.242285|7.672495|6.637941|0.174388|4.305538|3.733887|2.882350|2.672297|2.823069|3.643471|0.099703|3.847509|5.080246|7.848575|6.682026|0.136502|5.659481|8.091301|14.391009|36.858105| |2.267333|2.668559|2.660162|3.047243|3.711775|3.744767|3.087230|5.990086|4.862103|7.968926|5.059670|0.113595|7.142027|0.190503|5.180541|4.478876|0.126139|3.273276|2.906570|2.362033|2.212133|2.335148|2.879314|0.080658|2.996384|3.769682|4.914260|4.450535|0.099206|4.234551|6.483361|7.575149|12.572687|36.858105| |2.596658|3.092802|3.079524|3.505825|4.230135|4.277024|3.562366|6.426560|5.305045|9.524090|4.751989|0.108994|5.812380|0.173182|4.115823|3.544207|0.095808|2.760677|2.580720|2.137249|1.997473|2.056642|2.455999|0.067514|2.590953|3.143890|3.944858|3.992435|0.091061|4.091753|6.247927|5.305714|7.490849|12.412289|36.858105| |1.971576|2.245188|2.220717|2.464725|2.870485|2.928918|2.542039|4.575572|3.800076|6.526481|4.114798|0.099524|5.939442|0.174956|5.020133|4.115846|0.120460|3.121990|2.752887|2.270038|2.100242|2.226357|2.699746|0.076791|2.677310|3.203827|4.015097|3.581808|0.084069|3.271547|5.119294|5.372449|7.557172|12.401860|7.541863|36.858105| |1.431241|1.551210|1.495895|1.589214|1.786936|1.886120|1.736371|2.955243|2.209155|3.528574|2.645428|0.074858|2.647844|0.065941|3.234789|4.006442|0.111456|5.694733|4.956905|5.981945|7.542581|12.314413|7.298608|0.196461|4.861189|3.721385|3.384732|2.969282|0.088963|2.486775|4.295450|2.779721|2.511321|2.139673|1.882929|2.102573|36.858105| 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|17.571724|8.836815|7.229020|4.740266|3.956815|4.173636|5.580718|4.451531|2.980136|5.609012|2.434927|0.065216|2.145126|0.059670|1.862191|1.808633|0.046896|1.669595|1.743005|1.589452|1.541824|1.483159|1.604554|0.042274|1.768423|1.897783|2.031331|2.358184|0.063599|2.769609|4.856472|2.071603|2.130113|2.081316|2.370066|1.824670|1.337016|1.435640|2.548016|2.465441|1.501239|0.301740|0.301643|0.500000| |6.972855|8.920059|17.700579|8.923443|5.646495|4.964499|5.658951|4.926722|3.106424|5.618122|2.533060|0.065265|2.274410|0.062218|1.949953|1.924220|0.050524|1.739420|1.766069|1.593757|1.566907|1.540247|1.693276|0.045120|1.897332|2.098750|2.223306|2.525150|0.066248|3.099146|5.635766|2.340070|2.370808|2.357912|2.706172|2.009488|1.383053|1.506054|2.647889|2.622473|1.555388|0.149737|0.154068|0.221456|0.500000| |4.084673|5.634959|8.914958|17.714209|8.950479|5.665816|4.969051|5.685883|3.383847|5.775773|2.811659|0.069509|2.582403|0.068801|2.189710|2.208850|0.058808|1.944163|1.912588|1.701460|1.692944|1.704910|1.917330|0.051728|2.192178|2.531121|2.650616|2.914572|0.073901|3.737701|7.121883|2.908886|2.865220|2.882500|3.262756|2.356366|1.520710|1.679398|2.911371|2.969630|1.722235|0.098811|0.100106|0.112810|0.215584|0.500000| |3.541907|4.926074|5.636762|8.903958|17.764658|8.919358|5.648503|9.778627|5.054227|7.756967|4.134688|0.095243|3.712947|0.094053|3.001828|3.083085|0.080926|2.579638|2.484672|2.127161|2.107220|2.147933|2.520418|0.067607|2.976018|3.689829|4.019523|4.502427|0.106315|6.579244|12.538871|4.631811|4.386307|4.149686|4.526702|3.110296|1.874161|2.081806|3.540360|3.681168|2.209726|0.090359|0.090466|0.090157|0.124104|0.214881|0.500000| |7.033097|8.903155|5.661701|4.971064|5.652244|8.964630|17.738818|9.850711|6.572631|12.360985|4.526522|0.120817|3.502106|0.095972|2.863597|2.717999|0.067254|2.443509|2.629997|2.278956|2.143134|2.024475|2.259178|0.057889|2.525867|2.748529|3.145370|4.125349|0.109937|5.043775|7.803190|3.105526|3.259535|2.953102|3.357081|2.487370|1.775374|1.892877|3.320168|3.192808|2.110492|0.195690|0.187065|0.140841|0.124217|0.107827|0.124475|0.500000| |1.890756|2.115312|2.015726|2.181168|2.572477|2.795350|2.470638|4.713314|4.079915|6.532072|5.576599|0.146507|8.830478|0.213617|17.568558|8.713499|0.234212|5.940014|4.828736|3.589604|3.089245|3.279697|4.214980|0.115878|3.746955|4.196203|5.766541|4.808267|0.117217|3.648649|5.520064|5.821915|6.871555|5.271168|4.041283|5.769665|3.086719|2.696510|4.236784|4.717765|6.175480|0.051681|0.053179|0.047958|0.050421|0.056718|0.075702|0.070225|0.500000| |2.041019|2.263595|2.099197|2.228236|2.637206|2.994568|2.702091|5.208516|4.715434|7.416217|7.210014|0.225181|8.877165|0.212821|17.586999|8.646619|0.179623|7.062515|7.008321|4.627789|3.654808|3.607066|4.518341|0.113461|4.025255|4.198015|5.835773|5.730153|0.149078|4.021204|5.891554|4.996650|5.571773|4.158918|3.566672|4.117110|3.270222|2.861324|4.583919|4.792465|6.455713|0.056668|0.057477|0.051097|0.052185|0.056931|0.075523|0.079313|0.304746|0.500000| |1.935525|2.107374|1.941076|2.029748|2.359665|2.684178|2.489657|4.541912|3.795390|5.956550|5.250855|0.176617|4.896715|0.120476|6.634575|6.557895|0.139783|8.740048|17.510600|8.859203|5.483634|4.755670|5.443183|0.123268|4.555145|4.081084|4.898978|5.095150|0.159206|3.663461|5.613878|3.786162|3.761548|2.964157|2.659963|2.865547|4.135333|3.482694|5.662626|5.477640|7.112078|0.055024|0.053847|0.048607|0.048635|0.051949|0.066756|0.074115|0.147343|0.251937|0.500000| |2.122270|2.350203|2.162828|2.282172|2.698545|3.100407|2.821550|5.387664|4.212734|6.238942|5.827178|0.183537|4.734537|0.110494|5.611230|6.739178|0.138874|8.751894|17.582638|8.976021|6.797964|5.573913|6.652808|0.136913|6.451924|5.313219|6.082544|6.948544|0.268941|4.713417|7.246636|4.196894|3.876282|2.972140|2.687577|2.721446|4.192753|4.162764|6.874426|6.314676|5.512269|0.060899|0.057903|0.053056|0.053661|0.058011|0.076585|0.083495|0.121567|0.173445|0.304684|0.500000| |1.603010|1.718062|1.611264|1.679549|1.899444|2.084722|1.959177|3.336068|2.609126|4.199917|3.226462|0.098669|3.106529|0.078630|3.898534|4.355449|0.107654|6.579083|8.807511|17.534392|8.790045|6.610723|5.606500|0.128088|4.216349|3.407898|3.514987|3.406807|0.106754|2.725115|4.483607|2.826609|2.693546|2.251384|2.029765|2.215010|6.478552|4.379155|7.147789|6.489029|6.624715|0.045846|0.044208|0.041002|0.041087|0.043781|0.054022|0.057341|0.098525|0.122927|0.216067|0.175009|0.500000| |1.778230|1.896379|1.751054|1.805549|2.044553|2.291032|2.183889|3.678508|2.856933|4.570478|3.484363|0.110207|3.113411|0.078860|3.656398|4.002590|0.095092|5.444906|8.888674|17.482169|8.825479|5.451769|4.834414|0.107424|4.209927|3.391616|3.519307|3.719799|0.124188|3.002035|4.918303|2.788850|2.661706|2.210928|2.044756|2.117634|4.593552|4.038768|7.114530|5.856646|4.652825|0.051576|0.048826|0.045122|0.044452|0.046558|0.057282|0.064976|0.088808|0.116317|0.215050|0.221487|0.305297|0.500000| |1.553196|1.664280|1.577066|1.646867|1.843970|1.990750|1.872100|3.109710|2.306253|3.681563|2.717319|0.079695|2.528381|0.063496|2.935998|3.464366|0.088517|4.743457|5.472496|8.818891|17.569423|8.849277|5.467933|0.124220|4.593344|3.396179|3.153665|3.073847|0.098759|2.609484|4.516205|2.533184|2.322093|1.967616|1.795220|1.886153|7.171680|6.744579|12.746348|8.494769|4.204178|0.044798|0.042146|0.040070|0.040440|0.043247|0.052576|0.054096|0.074309|0.086115|0.123361|0.140001|0.214136|0.211479|0.500000| |1.784880|1.940653|1.829875|1.923991|2.190871|2.393553|2.221004|3.818742|2.773260|4.302563|3.313976|0.096359|2.939147|0.071977|3.340485|4.108666|0.100455|5.543518|6.726165|8.860289|17.573723|8.853009|6.680722|0.137881|6.519044|4.390552|3.968377|3.998887|0.137181|3.334384|5.794609|3.014947|2.695673|2.221697|2.028331|2.069179|5.528519|7.028051|13.275002|8.777796|4.235616|0.051683|0.048003|0.045670|0.046400|0.050073|0.062551|0.064171|0.081292|0.096578|0.138940|0.199066|0.173540|0.216685|0.307033|0.500000| |1.806372|2.036687|1.997949|2.199957|2.558160|2.647061|2.317078|4.225320|2.895974|4.368622|3.421196|0.089496|3.197977|0.075327|3.528300|4.899580|0.131363|5.467389|4.609464|4.284002|5.426865|7.077618|8.898312|0.218769|17.664957|8.982634|5.517964|4.571442|0.137928|3.993491|7.512402|4.099363|3.276629|2.664506|2.332437|2.400328|4.749603|8.111507|11.383884|13.993972|4.069230|0.051040|0.048028|0.046685|0.050402|0.058443|0.077071|0.063865|0.087497|0.091373|0.102489|0.135522|0.102771|0.102068|0.123013|0.165859|0.500000| |2.052497|2.321440|2.215604|2.409692|2.859841|3.108079|2.724414|5.204607|3.591706|5.256365|4.435672|0.118513|3.807734|0.087988|4.173983|5.784729|0.136000|6.663980|6.488679|5.534052|6.571028|6.741966|8.714580|0.174307|17.529788|8.851068|6.744478|6.457750|0.228970|5.122702|9.082962|4.452449|3.650625|2.849205|2.539190|2.528360|4.396736|5.992700|9.624430|8.992221|4.389292|0.058607|0.054617|0.052165|0.055109|0.062397|0.084151|0.076730|0.097443|0.111542|0.134929|0.221961|0.121268|0.133481|0.136892|0.226732|0.305213|0.500000| |1.890445|2.182413|2.176932|2.476739|2.970479|2.992307|2.504605|4.902475|3.388063|5.025726|4.089884|0.099211|4.204083|0.094733|4.562864|6.847930|0.211876|5.643570|4.189380|3.471911|3.715209|4.572044|6.865242|0.212129|8.921173|17.496117|8.951407|5.453209|0.138079|4.672401|8.418385|7.160995|4.864501|3.782608|3.062947|3.291787|3.716614|4.354139|6.409745|8.369826|4.364020|0.052156|0.050696|0.048771|0.054383|0.066238|0.093953|0.067612|0.115153|0.106694|0.100281|0.119481|0.087720|0.083646|0.086842|0.105184|0.217550|0.174204|0.500000| |2.192516|2.588557|2.581280|2.983030|3.692036|3.727457|3.023112|6.192206|3.916449|5.604951|4.515827|0.107280|4.116563|0.093067|4.062017|5.489876|0.143818|4.708160|4.038698|3.365713|3.626775|4.055904|5.449272|0.143174|8.831874|17.589840|8.823290|6.869607|0.176257|6.717118|13.782503|6.651277|4.641163|3.593453|3.107300|2.977849|3.179095|4.005459|6.362869|7.179911|3.534651|0.060855|0.057754|0.056162|0.063438|0.078595|0.118028|0.080457|0.098065|0.098993|0.096620|0.126084|0.082012|0.084427|0.084925|0.110194|0.217609|0.212803|0.303470|0.500000| |2.168052|2.586686|2.627988|3.117668|3.922593|3.802188|3.002411|6.295618|4.342526|6.377990|4.920286|0.108842|5.601268|0.124151|4.974821|5.834360|0.173211|4.097654|3.377612|2.734409|2.708804|3.005740|3.968532|0.113994|4.548889|7.067004|8.423576|5.815485|0.126327|5.572709|9.309092|17.673678|9.007649|6.818746|4.890663|4.933697|2.623974|2.804008|4.433576|5.171408|3.458151|0.058155|0.058599|0.055654|0.064503|0.083287|0.132524|0.078599|0.128513|0.109383|0.088344|0.098145|0.070431|0.069092|0.065423|0.076933|0.111686|0.112245|0.210995|0.188906|0.500000| |2.170949|2.566880|2.627761|3.078733|3.715423|3.557917|2.907704|5.486638|4.136617|6.707119|4.243815|0.096839|5.407914|0.138976|4.339862|4.099524|0.119837|3.066558|2.684105|2.223427|2.129296|2.281707|2.808513|0.080114|2.970353|3.815024|4.663263|4.062199|0.091975|4.028242|6.474417|7.396646|9.067793|17.519488|8.935039|8.940985|2.091912|2.113241|3.420528|3.855121|2.826832|0.056804|0.060193|0.056015|0.065169|0.082967|0.120050|0.075865|0.122782|0.098356|0.074434|0.076334|0.058860|0.057597|0.052826|0.059598|0.074770|0.077279|0.109898|0.103149|0.220063|0.500000| |2.696146|3.153631|3.027822|3.313132|3.946635|4.249724|3.690381|6.490023|5.904207|11.630796|5.142888|0.121110|6.282935|0.211627|4.294789|3.510223|0.092451|2.774725|2.661239|2.193674|2.014389|2.041376|2.415171|0.065526|2.514167|2.966599|3.771909|3.992522|0.092341|3.973124|5.922392|4.714174|6.717460|8.718347|17.564722|6.750558|1.873510|1.852091|3.077743|3.256635|2.567250|0.069266|0.078345|0.067490|0.073875|0.083917|0.111712|0.099783|0.116028|0.106697|0.077845|0.076965|0.057963|0.058837|0.050345|0.056700|0.062433|0.069440|0.078997|0.080566|0.115690|0.173370|0.500000| |2.419272|2.827582|2.871921|3.238833|3.709095|3.621770|3.127553|5.166574|4.120513|7.591907|3.743596|0.089570|4.454366|0.133729|3.436676|3.018185|0.083362|2.424691|2.266565|1.916997|1.803812|1.863091|2.190084|0.060820|2.290273|2.730574|3.279367|3.261457|0.076818|3.361432|5.331445|4.256452|5.477936|8.793653|17.525716|6.959202|1.727924|1.726112|2.862603|3.088113|2.279061|0.061601|0.069235|0.062369|0.071704|0.086033|0.109577|0.081618|0.096513|0.084401|0.064827|0.064922|0.051032|0.051061|0.045479|0.050687|0.058176|0.062087|0.075220|0.075302|0.114608|0.214216|0.301605|0.500000| |2.933059|3.638048|3.689576|4.372186|5.519087|5.374459|4.233518|7.729970|5.885193|10.272730|4.836058|0.108797|5.293464|0.148076|3.782407|3.416147|0.091075|2.693989|2.546634|2.119432|2.004322|2.053973|2.446133|0.066713|2.654612|3.256206|4.017155|4.229277|0.095680|4.694298|7.198403|5.340385|6.802837|8.751398|17.564519|5.479435|1.856011|1.906941|3.175413|3.382884|2.421568|0.074155|0.082406|0.073989|0.087885|0.111123|0.165997|0.106400|0.099579|0.092199|0.071859|0.075155|0.055290|0.056623|0.050000|0.057275|0.066695|0.073020|0.086666|0.092235|0.140089|0.214261|0.302366|0.301456|0.500000| |1.819577|2.060112|2.042576|2.267021|2.629506|2.671492|2.323653|4.196897|3.409366|5.715355|3.850141|0.094387|5.495120|0.150910|5.250383|4.473431|0.139242|3.368519|2.861167|2.363690|2.198379|2.377948|2.916845|0.084893|2.827294|3.381254|4.162472|3.505956|0.083320|3.122701|4.962186|5.477187|6.924525|8.753400|5.480009|17.556044|2.271261|2.127353|3.392909|3.878853|3.399825|0.048481|0.051215|0.046974|0.051606|0.060634|0.079781|0.063360|0.179186|0.116813|0.081897|0.077090|0.064629|0.060365|0.054742|0.059509|0.070484|0.072638|0.099493|0.085300|0.142537|0.213816|0.138377|0.141806|0.122524|0.500000| |1.891567|2.138989|2.141228|2.369553|2.693968|2.693097|2.370623|4.051210|3.285985|5.790702|3.405983|0.084029|4.503934|0.134175|3.906036|3.346297|0.098057|2.657204|2.379272|2.010209|1.878161|1.986323|2.357568|0.067338|2.350160|2.771409|3.320381|3.026691|0.072493|2.862946|4.582647|4.293438|5.500991|8.776107|6.923889|17.530466|1.892448|1.812440|2.949275|3.284320|2.634203|0.049624|0.053795|0.049084|0.054411|0.063753|0.080714|0.063967|0.121882|0.093107|0.068521|0.065519|0.054719|0.052495|0.047364|0.051510|0.059561|0.061903|0.079563|0.072950|0.115483|0.214661|0.168128|0.210474|0.141621|0.301049|0.500000| |1.989177|2.237341|2.172082|2.362703|2.736662|2.875385|2.549708|4.528831|3.938092|6.973260|4.315675|0.107640|6.431117|0.214707|5.419023|4.087308|0.115271|3.158101|2.855638|2.341716|2.121790|2.212558|2.653795|0.074282|2.590962|3.011668|3.824478|3.552825|0.084501|3.172766|4.885000|4.748887|6.747228|8.727808|6.794583|17.538352|2.099517|1.962134|3.185730|3.495708|3.148890|0.052728|0.056994|0.050829|0.054607|0.062011|0.080306|0.070626|0.177182|0.127625|0.084827|0.077857|0.063829|0.061106|0.053002|0.057802|0.064069|0.068971|0.084098|0.077283|0.116192|0.173520|0.198477|0.170378|0.138717|0.301250|0.302055|0.500000| 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