Version2.0 2020-07-18T10:19:21Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 22-Jun-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)c1ccc(cc1)[C@H](C(=O)NCc2ccco2)N(CCOC)C(=O)Cn3c4ccccc4nn3 C13502489 RHF 6-31G(d) (6D,7F) CC(C)c1ccc(cc1)[C@H](C(=O)NCc2ccco2)N(CCOC)C(=O)Cn3c4ccccc4nn3 C01[X(C27H31N5O4)] 195 C1 602 COCCN([C@H](c1ccc(cc1)C(C)C)C(=O)NCc1ccco1)C(=O)Cn1nnc2c1cccc2 COCCN([C@H](c1ccc(cc1)C(C)C)C(=O)NCc1ccco1)C(=O)Cn1nnc2c1cccc2 COCCN([C@@H](C(=O)NCc1occc1)c2ccc(cc2)C(C)C)C(=O)Cn3nnc4ccccc34 InChIKey=GDKDTIHQTSPYRK-AREMUKBSSA-N InChI=1S/C27H31N5O4/c1-19(2)20-10-12-21(13-11-20)26(27(34)28-17-22-7-6-15-36-22)31(14-16-35-3)25(33)18-32-24-9-5-4-8-23(24)29-30-32/h4-13,15,19,26H,14,16-18H2,1-3H3,(H,28,34)/t26-/m1/s1 InChI=1/C27H31N5O4/c1-19(2)20-10-12-21(13-11-20)26(27(34)28-17-22-7-6-15-36-22)31(14-16-35-3)25(33)18-32-24-9-5-4-8-23(24)29-30-32/h4-13,15,19,26H,14,16-18H2,1-3H3,(H,28,34)/t26-/m1/s1/f/h28H CC(C)c1ccc(cc1)[C@H](C(=O)NCc2ccco2)N(CCOC)C(=O)Cn3c4ccccc4nn3 C01[X(C27H31N5O4)] 195 C01 602 COCCN([C@H](c1ccc(cc1)C(C)C)C(=O)NCc1ccco1)C(=O)Cn1nnc2c1cccc2 COCCN([C@H]([C]1[CH][CH][C]([CH][CH]1)C(C)C)[C]([NH]CC1=[CH][CH]=CO1)=O)C(=O)C[N]1[N][N][C]2[C]1[CH][CH][CH][CH]2 COCCN([C@H]([C]1[CH][CH][C]([CH][CH]1)C(C)C)C(=O)NCc2occc2)C(=O)CN3[N][N][C]4[CH][CH][CH][CH][C]34 InChIKey=GDKDTIHQTSPYRK-AREMUKBSSA-N InChI=1S/C27H31N5O4/c1-19(2)20-10-12-21(13-11-20)26(27(34)28-17-22-7-6-15-36-22)31(14-16-35-3)25(33)18-32-24-9-5-4-8-23(24)29-30-32/h4-13,15,19,26H,14,16-18H2,1-3H3,(H,28,34)/t26-/m1/s1 InChI=1/C27H31N5O4/c1-19(2)20-10-12-21(13-11-20)26(27(34)28-17-22-7-6-15-36-22)31(14-16-35-3)25(33)18-32-24-9-5-4-8-23(24)29-30-32/h4-13,15,19,26H,14,16-18H2,1-3H3,(H,28,34)/t26-/m1/s1/f/h28H 3832.5874428324 -1612.1404016 1-A 21536.4624 130 472 602 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9.4171 0.7281 0.4643 1.8679 0.0906 0.4910 2.0788 0.1349 0.7800 0.5082 0.4119 0.5747 2.1072 0.2958 2.8101 6.1739 3.1539 3.0400 8.2627 2.9174 0.0182 1.7323 0.3406 1.2555 3.4924 3.6304 3.3608 3.7105 7.6211 1.3935 14.9902 5.6945 1.5254 5.5694 4.7854 12.6781 1.0253 13.0365 1.2121 3.0046 5.5562 8.3285 3.0180 10.6579 0.9887 7.3240 1.7709 5.4913 48.0411 1.3500 0.7388 94.2053 36.2181 12.8534 59.0412 14.6853 14.4304 13.5808 1.4774 39.8415 0.7220 10.4816 0.7369 66.6385 18.7704 3.3514 52.9314 18.4999 32.6064 12.3943 41.7649 5.1526 15.1075 3.5245 0.2708 0.8646 6.9660 17.7874 1.4443 10.8718 0.9274 18.3468 1.1014 31.0663 5.3821 1.2532 4.1851 28.8603 0.7549 29.6581 10.8198 0.0516 3.4378 6.9748 7.9982 38.8420 19.5807 11.1911 6.6379 19.6264 133.5620 27.5897 0.8607 20.2162 1.2851 18.4654 19.8397 133.1820 72.3589 4.4194 33.9489 17.6432 79.0598 3.9776 4.9972 44.2982 72.7896 184.2185 15.1348 0.2420 80.2112 21.1849 61.7084 23.0051 10.2118 10.1802 24.8059 1.7211 5.6774 57.8838 37.5488 37.1896 32.3913 2.0659 22.2265 49.1913 13.0974 9.7461 20.2363 155.1754 7.0239 10.7791 30.4615 0.0117 4.6460 1.8273 4.8764 5.5281 6.0023 3.9633 7.6908 2.9731 33.2501 21.7474 6.2854 29.7437 18.2479 512.6656 1.4658 1.2853 1.9455 12.9694 7.5588 135.6575 519.6735 57.1938 97.4132 32.4576 33.0773 19.4008 30.4424 17.5771 62.1099 0.2733 122.4195 34.5490 45.0176 24.0201 15.2269 5.6415 32.9344 23.9131 6.6479 16.2058 22.6838 7.2221 3.3697 20.7208 19.6574 21.2402 14.5461 6.6253 1.7512 1.7108 3.8583 77.0931 1.0842 1.7546 4.0551 2.8554 0.8227 0.4310 0.1423 1.7060 4.2740 4.0559 5.0203 0.9595 0.7759 0.2302 1.0053 0.6029 1.2369 1.6299 3.0281 0.3849 1.6044 0.8583 0.9604 2.2693 0.6392 1.7141 0.7325 0.8856 0.2266 0.7621 0.8409 0.3549 0.7045 0.1560 0.2946 0.4076 0.2951 0.8564 0.9363 0.1091 1.2625 0.7543 1.6196 0.1337 1.7485 1.6365 3.4991 0.4862 0.9686 0.6418 2.4350 6.0900 1.1251 0.5835 4.8225 6.2995 3.6707 2.2414 3.2374 6.9211 3.1686 6.9230 2.6996 16.0299 1.7332 2.1117 5.3774 7.9550 5.7020 0.6559 12.0111 1.9318 2.3315 1.1035 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4609.50 4614.74 4648.43 4663.10 4670.00 4688.61 4701.14 4705.28 4711.40 4724.32 4746.44 4766.35 4769.71 4789.27 4790.36 4816.51 4831.16 4836.45 4838.89 4851.56 4861.62 4882.42 4892.73 4942.02 4947.50 4960.34 5009.15 5536.30 0.596117 0.628133 0.629078 0.524129 -1611.544284 -1611.512268 -1611.511324 -1611.616273 3.520007D-04 MUNgauss RevisionA2.0 retrievium 18-Jul-2020 DUDE CC(C)c1ccc(cc1)[C@H](C(=O)NCc2ccco2)N(CCOC)C(=O)Cn3c4ccccc4nn3 C13502489 RHF 6-31G(d) (6D,10F) C1 489.237605 |X|Y|Z| 80.883423 55.887796 108.953758 78.971958 27 6 7 8 21 5 1 |36.858105| |12.411541|36.858105| |7.524448|12.411149|36.858105| |7.521205|12.520410|7.523747|36.858105| |5.306409|7.533244|5.319172|13.757742|36.858105| |3.996251|4.986111|4.003151|7.850618|13.697502|36.858105| |3.715868|4.384173|3.720096|6.746405|7.908165|13.749535|36.858105| |4.306222|4.991639|4.309453|7.893493|6.947517|7.995703|13.650562|36.858105| |6.062910|7.476168|6.057765|13.651785|8.017999|6.893171|7.872123|13.818024|36.858105| |2.889733|3.247547|2.894730|4.384714|4.952214|7.364345|12.498321|7.663020|5.041789|36.858105| |2.736702|3.071805|2.844330|4.041671|4.292743|5.750073|9.098056|7.381781|4.857424|17.701637|0.500000| |2.494797|2.823953|2.554099|3.621757|4.308669|6.257396|7.334765|4.973945|3.816920|12.386228|0.250037|36.858105| |2.480583|2.810409|2.496995|3.546734|4.438155|6.433273|6.265653|4.313569|3.531003|7.870759|0.164169|15.790681|73.516695| |2.181412|2.449773|2.291700|3.024513|3.431817|4.510167|5.230909|4.069598|3.227550|7.884477|0.218842|14.173080|15.107160|53.358707| |1.915832|2.136690|2.016063|2.547040|2.893722|3.613264|3.860415|3.141781|2.635954|5.023534|0.136790|7.813394|12.238473|17.866387|36.858105| |1.750340|1.948802|1.883989|2.274444|2.511002|2.999605|3.214388|2.763762|2.369038|3.957188|0.115230|5.193974|8.143823|10.672448|12.772829|36.858105| |1.574981|1.728422|1.682001|1.983288|2.148236|2.502592|2.689444|2.389086|2.076310|3.251067|0.095556|3.959312|6.334087|7.377003|7.345063|14.203534|36.858105| |1.505496|1.657487|1.640054|1.876950|2.007665|2.285633|2.436028|2.216107|1.960812|2.829032|0.084355|3.293474|5.320354|5.784800|5.142700|8.566170|13.225143|36.858105| |1.614667|1.804189|1.798570|2.050824|2.204552|2.509193|2.651646|2.400327|2.130161|3.023089|0.090591|3.541412|5.705889|6.195140|5.339539|8.779202|8.609887|14.234751|36.858105| |1.784930|2.016141|1.983264|2.338661|2.568976|3.011126|3.179309|2.777434|2.419992|3.708726|0.109980|4.630211|7.343194|8.625915|7.850842|14.134352|8.641097|8.627555|14.175484|73.516695| |2.724658|2.902995|2.561572|3.746839|4.055858|5.399109|7.629878|6.083322|4.326668|12.892361|0.259811|7.713827|10.779804|7.981412|4.233765|3.397951|2.944492|2.537484|2.611041|5.473106|53.358707| |2.875279|2.970167|2.530694|3.771685|4.137199|5.279712|6.411809|5.294909|4.148591|7.460568|0.157411|5.710404|9.582651|5.930144|3.487662|2.829089|2.494599|2.176525|2.232030|4.605010|17.745845|36.858105| |2.523431|2.619843|2.246526|3.202373|3.661668|4.604382|4.890084|3.942931|3.305568|5.665276|0.123017|5.472501|10.457867|5.739684|3.620000|2.853482|2.519626|2.165376|2.199627|4.552960|10.320838|12.524973|36.858105| |2.153380|2.227125|1.965622|2.654896|2.952967|3.609971|3.928810|3.304793|2.782109|4.850893|0.113060|4.965760|9.041708|5.726987|3.751421|2.966241|2.683730|2.259693|2.239412|4.585236|8.962215|8.035952|13.647300|73.516695| |1.930449|2.003137|1.783533|2.334439|2.619175|3.128116|3.242520|2.747119|2.385843|3.847319|0.092337|4.260150|8.249982|5.143548|3.654678|2.898597|2.655866|2.223677|2.182135|4.439217|6.254782|5.207756|8.105717|24.240974|36.858105| |2.351254|2.469926|2.249231|3.051220|3.192700|3.970409|5.223456|4.697576|3.538717|7.923162|0.218997|6.015406|8.409874|7.545827|4.140325|3.463969|3.115529|2.657808|2.660656|5.446957|19.062791|7.671534|5.679069|10.673523|4.335500|36.858105| |2.189684|2.331752|2.178272|2.848462|2.960591|3.635897|4.726796|4.334552|3.304927|7.146302|0.237100|5.913578|7.909830|8.569689|4.580346|3.991080|3.618057|3.065429|3.044619|6.210790|11.536228|5.311617|4.358576|8.275316|3.701407|15.828253|73.516695| |2.164556|2.203669|2.005929|2.627759|2.700274|3.188298|3.901525|3.708003|2.997223|4.989351|0.135450|4.186248|6.464749|5.356580|3.256438|2.820046|2.642244|2.286105|2.246940|4.458065|10.466541|6.593056|5.253309|10.779022|4.355836|12.445809|14.288064|36.858105| |1.894346|1.928338|1.793570|2.247121|2.287752|2.640181|3.148413|3.054700|2.543735|3.919692|0.112341|3.490920|5.419707|4.780547|3.028676|2.738255|2.663333|2.315046|2.225317|4.305728|7.000309|4.424197|3.869982|8.090076|3.658795|7.746878|12.623118|13.286922|53.358707| |1.819435|1.847788|1.748220|2.127718|2.124506|2.403486|2.864519|2.881726|2.434722|3.446512|0.103057|3.046180|4.713522|4.268636|2.724425|2.561853|2.532950|2.260188|2.170275|4.113502|5.695820|3.580440|3.107328|6.158675|2.911770|5.838352|10.828812|7.513049|19.125593|36.858105| |1.908549|1.930621|1.847505|2.215014|2.160287|2.405382|2.899954|3.048759|2.590932|3.368410|0.103729|2.877905|4.431319|4.002561|2.520841|2.407281|2.359531|2.160769|2.110681|3.976226|5.343838|3.344938|2.815865|5.307957|2.522606|5.134159|9.712528|5.823198|10.206240|13.604234|36.858105| |1.728717|1.746005|1.696912|1.965047|1.906829|2.087157|2.456317|2.592951|2.269419|2.777223|0.085421|2.447429|3.824570|3.456289|2.237631|2.194617|2.192612|2.050782|1.990875|3.669636|4.204084|2.698871|2.345186|4.403949|2.161814|3.803914|7.341359|4.141115|7.042851|8.098884|13.911839|36.858105| |1.541563|1.559823|1.517770|1.740049|1.708779|1.868699|2.154555|2.223512|1.967802|2.443225|0.073995|2.231642|3.533048|3.196439|2.129468|2.114864|2.161635|2.023951|1.928882|3.505992|3.670172|2.394483|2.152036|4.119685|2.070352|3.289205|6.366549|3.619437|6.389062|6.947145|7.818307|13.467876|36.858105| |1.494255|1.515933|1.462332|1.697279|1.690953|1.867164|2.138783|2.155989|1.897306|2.469099|0.073650|2.303602|3.665779|3.320370|2.243121|2.212899|2.286791|2.101093|1.971677|3.594530|3.769543|2.471497|2.268827|4.465756|2.262142|3.439037|6.620115|3.909394|7.420552|7.859259|6.682876|7.859217|13.919039|36.858105| |1.609233|1.635627|1.558107|1.855783|1.866034|2.092795|2.424097|2.407210|2.079818|2.875496|0.084987|2.667755|4.212148|3.819441|2.542744|2.442687|2.489317|2.227014|2.093831|3.894747|4.566837|2.961753|2.706490|5.468796|2.708037|4.388755|8.319904|5.335216|12.050701|13.776451|7.824157|6.951102|8.060483|13.610374|36.858105| |1.564759|1.593704|1.505238|1.809927|1.849270|2.090561|2.386483|2.307915|1.996042|2.862579|0.082258|2.743787|4.399789|3.923622|2.672507|2.523903|2.585281|2.260850|2.102649|3.938691|4.610973|3.055376|2.908566|6.154139|3.102765|4.388921|8.029545|5.497298|12.202307|8.545369|5.342319|4.657295|5.158859|7.555774|13.875627|53.358707| |1.703187|1.736583|1.619588|1.997527|2.059506|2.364426|2.724916|2.591529|2.206208|3.349793|0.094211|3.185024|5.087993|4.453723|2.969488|2.702033|2.694435|2.314036|2.178704|4.173899|5.693895|3.771851|3.589125|7.932984|3.824409|5.666823|9.685964|7.958948|19.430902|8.664020|5.315330|4.255228|4.279404|5.442680|8.942098|20.702188|53.358707| |17.542262|8.784203|6.889277|5.485876|4.271739|3.329736|3.088776|3.479872|4.581773|2.490160|0.066061|2.202151|3.915981|2.660876|1.743556|1.607938|1.456881|1.401446|1.501031|2.924738|3.211552|2.480984|2.227150|3.430860|1.754303|2.073374|3.463505|1.929498|2.330329|1.653118|1.731736|1.586435|1.425767|1.381773|1.477267|1.957349|2.114961|0.500000| |17.557321|8.756229|5.472736|6.894638|5.400802|4.137525|3.784484|4.226712|5.576874|2.957506|0.076144|2.558092|4.584855|3.003546|1.941138|1.752712|1.576741|1.493922|1.592370|3.142189|3.882816|3.121670|2.754422|4.108367|2.066002|2.430420|3.955915|2.260393|2.660867|1.854960|1.924969|1.730333|1.547326|1.510810|1.639111|2.185997|2.397228|0.301140|0.500000| |17.545873|8.735576|6.792763|6.719117|4.668006|3.747991|3.698395|4.534126|6.489152|2.915003|0.078044|2.462592|4.268277|2.958506|1.893831|1.740489|1.574598|1.506905|1.610143|3.148553|3.790911|2.902844|2.488578|3.815374|1.904842|2.433783|4.034105|2.253469|2.690717|1.917363|2.040052|1.847929|1.631615|1.567764|1.683501|2.206210|2.394937|0.301879|0.301601|0.500000| |8.951338|17.535598|8.951042|9.021332|7.460963|4.830951|3.994138|4.209949|5.600754|3.032535|0.078602|2.736605|4.970982|3.225692|2.102866|1.911652|1.692526|1.622729|1.768657|3.519417|3.689949|2.808871|2.560233|3.862410|1.984456|2.306849|3.873236|2.066738|2.469548|1.727421|1.783231|1.618064|1.460581|1.430061|1.543564|2.065488|2.250608|0.215499|0.213423|0.173699|0.500000| |6.888821|8.784350|17.541491|5.486942|4.278653|3.333859|3.091239|3.481520|4.579365|2.493389|0.068013|2.243019|3.936642|2.768345|1.818824|1.710708|1.541159|1.509107|1.646813|3.196641|3.062902|2.247560|2.028319|3.182466|1.640969|2.001782|3.449031|1.813645|2.226701|1.598668|1.685312|1.561490|1.406683|1.356169|1.437055|1.893348|2.026740|0.207152|0.140797|0.168856|0.215523|0.500000| |6.793717|8.736289|17.546565|6.721180|4.677080|3.753902|3.702705|4.538027|6.482653|2.920318|0.081437|2.522082|4.295817|3.113779|1.994941|1.878025|1.686613|1.648501|1.801583|3.509426|3.545525|2.536972|2.212188|3.472270|1.757869|2.316629|4.010529|2.069341|2.529823|1.831210|1.962980|1.807607|1.602292|1.529477|1.622839|2.112899|2.265127|0.168899|0.139030|0.200403|0.173705|0.301828|0.500000| |5.473394|8.758103|17.561215|6.900580|5.425151|4.151524|3.793028|4.233172|5.572133|2.967234|0.081516|2.670826|4.641902|3.285521|2.130760|2.003054|1.774968|1.742035|1.934169|3.805162|3.479330|2.479821|2.225519|3.480762|1.788063|2.248057|3.920384|1.978210|2.419282|1.731878|1.821907|1.677134|1.507091|1.455948|1.550296|2.043115|2.194772|0.140802|0.122481|0.139039|0.213421|0.301082|0.301672|0.500000| |4.998260|7.002037|5.015677|8.937497|17.700999|8.956064|5.648666|4.989464|5.673987|4.044482|0.098578|3.779097|7.230756|4.194339|2.700312|2.357014|2.026969|1.903642|2.090154|4.302863|4.666138|3.570169|3.340998|4.845553|2.486830|2.775585|4.607115|2.401270|2.808245|1.916639|1.934373|1.725943|1.564635|1.555276|1.707429|2.319874|2.569315|0.117654|0.143499|0.116769|0.231056|0.117960|0.117069|0.144435|0.500000| |3.383875|4.086965|3.390976|5.626325|8.932849|17.793829|8.927472|5.668015|4.968663|6.746430|0.143959|6.989403|15.028860|6.583189|4.007328|3.210948|2.638610|2.378469|2.610140|5.662048|6.924292|5.067742|4.899462|6.805334|3.418505|3.807557|6.229647|3.080468|3.498576|2.311944|2.268609|1.977929|1.796727|1.816998|2.042750|2.821872|3.200384|0.081017|0.098448|0.087556|0.115345|0.081147|0.087722|0.098852|0.217480|0.500000| |3.719906|4.079273|3.724025|5.633840|4.988672|5.668644|8.899451|17.691921|8.974050|7.209498|0.221438|4.624545|6.889958|5.449458|3.072655|2.755142|2.420657|2.248311|2.407751|4.881747|8.544412|5.103840|3.725035|5.787528|2.679478|5.252867|8.784875|4.111189|4.641588|3.289633|3.597532|3.005715|2.509060|2.397042|2.678745|3.418364|3.824237|0.085920|0.100967|0.112647|0.096614|0.085983|0.112801|0.101176|0.108109|0.124309|0.500000| |6.290386|6.904311|6.282823|8.870678|5.670852|4.962368|5.630589|8.988037|17.711503|4.136587|0.115384|3.221562|5.286507|3.850125|2.351696|2.157635|1.922992|1.834681|1.981158|3.927480|5.081045|3.584890|2.888341|4.437418|2.155815|3.211862|5.401971|2.806394|3.308512|2.375342|2.582268|2.291131|1.971775|1.875975|2.031336|2.620911|2.862714|0.133836|0.151097|0.212907|0.139747|0.133730|0.212519|0.150918|0.124222|0.107786|0.218351|0.500000| |2.134161|2.369947|2.241967|2.909124|3.182185|4.055956|4.951790|4.097693|3.204126|7.626750|0.249321|9.484437|10.946661|25.992634|9.042070|7.209342|5.495419|4.357548|4.537185|10.499957|8.222144|4.258584|3.930440|7.150402|3.526746|6.359955|14.766235|4.330505|5.398534|3.597834|3.379686|2.889899|2.650265|2.744758|3.176544|4.359612|4.920443|0.053134|0.059638|0.059885|0.062836|0.055279|0.063120|0.065162|0.078589|0.114924|0.117615|0.079432|0.500000| |1.808700|1.983858|1.859461|2.340771|2.639503|3.251584|3.469674|2.868119|2.423803|4.513718|0.120503|6.559303|10.930689|12.345510|17.556922|9.047480|6.926710|4.655733|4.461802|10.238154|5.644552|3.505099|3.784262|7.374995|4.195630|4.188414|8.065049|3.410885|4.366798|2.822634|2.540582|2.249139|2.169682|2.330866|2.677362|3.944309|4.426325|0.045864|0.051321|0.049750|0.054315|0.046939|0.051179|0.053980|0.068866|0.100021|0.078644|0.060576|0.204697|0.500000| |1.953381|2.200762|2.066015|2.614280|3.045544|3.801736|3.837408|3.072186|2.631887|4.677854|0.122169|7.395872|13.715683|12.609205|17.640074|8.967500|5.758282|4.479477|4.880045|12.693629|5.277897|3.347155|3.562185|6.333557|3.558524|3.614818|6.792632|2.913954|3.636722|2.409659|2.255001|2.014298|1.914390|2.002995|2.249721|3.213408|3.563092|0.049507|0.055087|0.053011|0.061003|0.051873|0.056052|0.061085|0.080471|0.122159|0.081231|0.064676|0.180147|0.302554|0.500000| |1.507650|1.636168|1.582551|1.870228|2.018681|2.344932|2.526160|2.255122|1.961791|3.072150|0.089213|3.683550|5.965508|6.605275|6.362351|8.834091|17.793930|8.437678|5.858040|10.460690|3.940004|2.478135|2.534666|4.931958|2.783006|3.132027|6.423137|2.724221|3.811654|2.642261|2.406784|2.238342|2.242666|2.421266|2.652665|3.834100|3.967977|0.038782|0.042155|0.041951|0.044498|0.040432|0.044139|0.045994|0.052981|0.068649|0.063840|0.050681|0.138810|0.192718|0.139598|0.500000| |1.396944|1.526324|1.517737|1.709223|1.810176|2.031451|2.159947|1.996905|1.786243|2.471196|0.073571|2.797260|4.568502|4.722231|4.035058|5.839303|8.433636|17.802571|8.829685|10.449929|3.078247|1.965408|1.954075|3.639865|2.023070|2.387624|4.859029|2.101362|2.938864|2.135221|2.047250|1.974767|1.975156|2.049966|2.137228|2.943521|2.962203|0.036306|0.038466|0.038934|0.041499|0.039036|0.042493|0.044608|0.047861|0.058325|0.056571|0.046873|0.099903|0.105776|0.100067|0.192766|0.500000| |1.595855|1.791169|1.810095|2.013939|2.146681|2.397271|2.508099|2.307442|2.081664|2.769911|0.083091|3.150415|5.136121|5.244026|4.275501|6.036510|5.819369|8.619796|17.835026|16.505151|3.247623|2.063307|2.018976|3.609099|1.973278|2.406892|4.836253|2.051990|2.759679|1.996529|1.970194|1.875247|1.810938|1.829920|1.922152|2.602320|2.683871|0.041411|0.043416|0.044177|0.048823|0.046187|0.050366|0.054469|0.056821|0.068646|0.064090|0.054131|0.106660|0.100849|0.113502|0.123131|0.195198|0.500000| |2.751195|2.750923|2.368488|3.373704|3.530661|4.200937|5.013794|4.619203|3.771548|5.603832|0.131570|4.425195|7.389933|4.969421|3.014904|2.528598|2.285664|2.012352|2.041669|4.126168|12.459677|17.635938|8.918750|12.814916|4.772383|7.223467|8.842108|7.717609|6.673514|3.904355|3.629505|2.881606|2.537916|2.620278|3.172079|4.432680|5.536386|0.066448|0.083180|0.078515|0.071733|0.059046|0.066727|0.063689|0.085944|0.110555|0.130309|0.094383|0.102316|0.085245|0.079655|0.063749|0.051083|0.052663|0.500000| |3.412658|3.525990|2.891956|4.646307|5.143697|6.536626|7.686554|6.334793|5.046503|7.148098|0.150046|5.301946|9.201032|5.423807|3.213674|2.647822|2.320176|2.061710|2.146453|4.425937|12.530037|17.644885|8.940816|10.276732|4.271503|5.792220|7.887956|4.987121|4.950593|3.103048|3.010539|2.484209|2.195029|2.227329|2.598951|3.584159|4.267907|0.079872|0.105025|0.094808|0.091960|0.070566|0.079857|0.077814|0.119486|0.163653|0.156652|0.116707|0.106634|0.087408|0.087904|0.063175|0.051793|0.055813|0.305778|0.500000| |2.541723|2.578499|2.186826|3.071415|3.472036|4.118087|4.176543|3.535563|3.104533|4.440725|0.100771|4.248769|8.244338|4.648509|3.030775|2.466838|2.211125|1.931656|1.961873|3.999026|7.578129|8.937476|17.471165|16.526315|7.038540|4.461013|6.320439|4.431677|4.621114|2.788792|2.556786|2.160997|1.992606|2.092514|2.461509|3.590648|4.343721|0.062667|0.078554|0.069165|0.070606|0.055414|0.059500|0.059535|0.090055|0.120389|0.092267|0.076343|0.089249|0.087689|0.084145|0.061881|0.048919|0.050532|0.218454|0.217228|0.500000| |2.551052|2.720531|2.327965|3.357653|4.030972|5.297490|5.260953|3.987565|3.359737|6.016714|0.126329|6.525325|14.278738|6.412435|4.085688|3.109415|2.677463|2.290749|2.355385|4.969793|9.259323|8.851207|17.615121|16.562993|7.444874|5.019787|7.315238|4.333585|4.595847|2.796337|2.569061|2.176065|2.007551|2.106552|2.472552|3.595515|4.322216|0.062636|0.076907|0.068791|0.074987|0.058199|0.062865|0.064919|0.103559|0.169979|0.101310|0.080070|0.115686|0.116876|0.115858|0.073857|0.056849|0.059930|0.174376|0.215001|0.300423|0.500000| |1.935845|2.041759|1.821936|2.388521|2.736408|3.316911|3.355399|2.770908|2.407700|3.993144|0.094876|4.775793|9.861401|5.727642|4.229347|3.228601|2.896772|2.396742|2.366476|4.894715|6.054765|4.801572|7.232085|16.490573|17.538330|4.083222|6.424230|3.833589|4.463403|2.684884|2.365634|2.047669|1.961243|2.125799|2.506147|3.845196|4.611007|0.048922|0.057257|0.052634|0.056649|0.046484|0.049539|0.051227|0.072818|0.104212|0.073999|0.059880|0.104722|0.137127|0.117716|0.083638|0.059917|0.059089|0.116488|0.113823|0.169122|0.222907|0.500000| |1.765243|1.825691|1.648252|2.105673|2.322152|2.732788|2.875504|2.494602|2.173046|3.440394|0.085630|3.788013|7.033466|4.842004|3.527423|2.874103|2.708695|2.251470|2.167644|4.343410|5.562488|4.359761|5.855042|16.887900|17.627381|4.140654|6.480679|4.333274|5.240697|3.037891|2.568801|2.215697|2.158543|2.404903|2.904102|4.695535|5.816284|0.044835|0.052036|0.048714|0.050047|0.042290|0.045400|0.045953|0.061232|0.081661|0.068798|0.055246|0.094567|0.115689|0.093060|0.080740|0.057353|0.054175|0.115951|0.100155|0.144933|0.149213|0.299302|0.500000| |1.909529|1.958407|1.732747|2.249334|2.516074|2.926810|2.960325|2.552213|2.268562|3.341415|0.080684|3.591028|7.054580|4.317466|3.080221|2.513850|2.319708|1.983849|1.957559|3.938758|5.340378|4.674218|7.176974|16.456358|17.512791|3.645447|5.564355|3.763098|4.350610|2.605306|2.294068|1.987654|1.905957|2.067394|2.436249|3.755330|4.518569|0.048450|0.057299|0.052073|0.054262|0.044593|0.047230|0.047968|0.067281|0.088516|0.068635|0.057240|0.082565|0.095489|0.085108|0.067069|0.050582|0.049746|0.122914|0.111511|0.207015|0.181254|0.299230|0.299725|0.500000| |2.307855|2.305289|2.087127|2.737068|2.744544|3.163197|3.880807|3.879120|3.175910|4.613594|0.125467|3.714172|5.838405|4.654191|2.842806|2.500227|2.339910|2.069612|2.056819|4.051634|9.358197|6.521323|4.846490|9.073037|3.772480|8.863006|11.124786|17.567406|12.575937|6.812996|6.016467|4.227975|3.559844|3.686630|4.776190|6.301044|8.178413|0.056870|0.067202|0.067631|0.059432|0.052423|0.060286|0.056449|0.067390|0.082915|0.121707|0.083935|0.103083|0.081053|0.072180|0.066239|0.053187|0.052888|0.239667|0.144579|0.119735|0.110523|0.092848|0.102019|0.094691|0.500000| |2.090150|2.121152|1.913037|2.509242|2.627480|3.103157|3.644932|3.358067|2.779625|4.566675|0.117905|4.081894|6.596665|5.126191|3.226668|2.741898|2.570809|2.204315|2.156775|4.291007|9.383148|6.907415|6.220873|14.560806|5.476867|8.841038|10.954454|17.685902|12.750091|5.714228|4.482160|3.439830|3.141790|3.467295|4.623279|7.077839|10.631773|0.052001|0.061320|0.059705|0.055966|0.048348|0.054195|0.052419|0.065869|0.085338|0.099185|0.071711|0.110493|0.096372|0.081312|0.074405|0.056319|0.054589|0.227893|0.139540|0.145523|0.134777|0.125612|0.152566|0.129245|0.301383|0.500000| |2.127767|2.147023|2.047462|2.489705|2.392269|2.659664|3.282148|3.567902|2.989046|3.752611|0.116826|3.062258|4.677929|4.157035|2.556356|2.413029|2.316824|2.129895|2.117643|4.035755|5.980026|3.698167|2.985006|5.446846|2.543795|5.592603|10.189818|6.009678|8.874895|8.771451|17.740281|8.915201|5.577667|4.854414|5.580470|5.893131|6.228940|0.053123|0.059462|0.063865|0.054452|0.051471|0.060964|0.055744|0.058734|0.068412|0.121471|0.083406|0.097109|0.070493|0.064051|0.064664|0.055593|0.055231|0.112037|0.093797|0.075198|0.075489|0.066523|0.070485|0.064518|0.186807|0.125488|0.500000| |1.747002|1.758910|1.727658|1.962691|1.879082|2.029466|2.380057|2.565798|2.280048|2.622800|0.081047|2.296563|3.603442|3.224627|2.087856|2.062243|2.050351|1.948377|1.912336|3.507534|3.875562|2.508819|2.171285|3.997908|1.973503|3.373624|6.466615|3.549839|5.618551|5.709428|9.012761|17.715858|8.866515|5.634375|4.992784|5.020337|4.708420|0.044660|0.048187|0.052270|0.045035|0.044235|0.051572|0.047305|0.047227|0.053004|0.083081|0.064959|0.074304|0.057614|0.052701|0.057470|0.052269|0.050596|0.073952|0.065447|0.055998|0.056415|0.052311|0.055639|0.050817|0.103008|0.083247|0.215512|0.500000| |1.448144|1.463476|1.435356|1.615741|1.581171|1.712095|1.951627|2.022001|1.815725|2.177314|0.065765|2.007192|3.205016|2.878269|1.940897|1.950590|2.006663|1.908600|1.819415|3.268723|3.208507|2.117159|1.920640|3.644519|1.856535|2.792664|5.383355|3.008129|5.052949|4.991680|5.618023|8.859672|17.725537|8.980675|5.687966|5.617884|4.740439|0.037435|0.040214|0.042572|0.038129|0.037144|0.042133|0.039618|0.040434|0.045765|0.062875|0.050854|0.065660|0.054687|0.048835|0.057627|0.052273|0.047840|0.061909|0.054594|0.049788|0.050187|0.049174|0.053648|0.047845|0.082842|0.074145|0.123638|0.216071|0.500000| 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