Version2.0 2020-02-03T04:32:37Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 12-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1cc(c(c(c1)O)C(=O)N(Cc2ccco2)[C@H](c3c(cc(cc3O)O)O)C(=O)NC4CCCCC4)O C36500501 RHF 6-31G(d) (6D,7F) c1cc(c(c(c1)O)C(=O)N(Cc2ccco2)[C@H](c3c(cc(cc3O)O)O)C(=O)NC4CCCCC4)O C01[X(C26H28N2O8)] 186 C1 596 Oc1cc(O)c(c(c1)O)[C@@H](N(C(=O)c1c(O)cccc1O)Cc1ccco1)C(=O)NC1CCCCC1 Oc1cc(O)c(c(c1)O)[C@@H](N(C(=O)c1c(O)cccc1O)Cc1ccco1)C(=O)NC1CCCCC1 Oc1cc(O)c([C@@H](N(Cc2occc2)C(=O)c3c(O)cccc3O)C(=O)NC4CCCCC4)c(O)c1 InChIKey=UPEINMMJGDSNDZ-XMMPIXPASA-N InChI=1S/C26H28N2O8/c29-16-12-20(32)22(21(33)13-16)24(25(34)27-15-6-2-1-3-7-15)28(14-17-8-5-11-36-17)26(35)23-18(30)9-4-10-19(23)31/h4-5,8-13,15,24,29-33H,1-3,6-7,14H2,(H,27,34)/t24-/m1/s1 InChI=1/C26H28N2O8/c29-16-12-20(32)22(21(33)13-16)24(25(34)27-15-6-2-1-3-7-15)28(14-17-8-5-11-36-17)26(35)23-18(30)9-4-10-19(23)31/h4-5,8-13,15,24,29-33H,1-3,6-7,14H2,(H,27,34)/t24-/m1/s1/f/h27H c1cc(c(c(c1)O)C(=O)N(Cc2ccco2)[C@H](c3c(cc(cc3O)O)O)C(=O)NC4CCCCC4)O C01[X(C26H28N2O8)] 186 C01 596 Oc1cc(O)c(c(c1)O)[C@@H](N(C(=O)c1c(O)cccc1O)Cc1ccco1)C(=O)NC1CCCCC1 Oc1cc(O)c(c(c1)O)[C@@H](N([C@@H](c1c(O)cccc1O)O)Cc1ccco1)C(=O)NC1CCCCC1 O[C@@H](N(Cc1occc1)[C@@H](C(=O)NC2CCCCC2)c3c(O)cc(O)cc3O)c4c(O)cccc4O InChIKey=YMPYKKQEDQFTSW-AOYPEHQESA-N InChI=1S/C26H30N2O8/c29-16-12-20(32)22(21(33)13-16)24(25(34)27-15-6-2-1-3-7-15)28(14-17-8-5-11-36-17)26(35)23-18(30)9-4-10-19(23)31/h4-5,8-13,15,24,26,29-33,35H,1-3,6-7,14H2,(H,27,34)/t24-,26-/m1/s1 InChI=1/C26H30N2O8/c29-16-12-20(32)22(21(33)13-16)24(25(34)27-15-6-2-1-3-7-15)28(14-17-8-5-11-36-17)26(35)23-18(30)9-4-10-19(23)31/h4-5,8-13,15,24,26,29-33,35H,1-3,6-7,14H2,(H,27,34)/t24-,26-/m1/s1/f/h27H 4169.8654575563 -1708.6808844 1-A 16728.7400 131 465 596 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|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|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| 11.8876 17.8912 27.9535 33.6171 34.6373 41.7704 49.7301 56.8707 66.3789 77.1569 84.1089 104.8189 121.6238 129.2046 145.8291 166.2867 168.4287 187.4445 209.1819 226.7484 238.9845 242.9818 247.6535 261.3002 269.1968 303.8267 314.7228 340.3486 351.5330 361.2362 363.3020 373.5598 385.1418 389.5008 394.9570 416.5281 425.3729 437.1638 473.1902 475.4212 486.4827 503.9467 520.5595 531.7812 537.8852 571.3083 573.3930 578.2241 586.0033 613.1924 631.0974 640.5035 651.6065 660.3909 661.0073 666.3186 688.3062 692.2136 699.0740 710.0432 720.1558 733.0804 783.0769 801.9766 812.8699 828.5093 843.0102 862.8929 864.2247 865.7293 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3342.8916 3368.1902 3375.5307 3379.7584 3400.9369 3405.6404 3437.2550 3450.1538 3485.7751 3872.9339 3882.0320 3959.1391 4037.4935 4110.1512 4112.7444 3.1553 5.7106 5.4152 5.8204 5.8299 5.4407 4.9612 6.1227 6.1839 7.0030 5.8591 4.2290 5.5643 7.2102 6.5927 7.7192 6.4577 6.9159 8.1945 4.2083 5.2096 5.1084 1.9088 4.5202 5.0108 7.2145 4.3894 3.8458 2.7228 2.3992 2.5411 2.9470 3.8074 1.8514 1.2028 5.8953 5.8479 6.1325 2.8401 3.6680 4.1752 2.4533 2.1399 2.0972 2.1664 4.1008 6.3646 2.0773 2.9764 2.2800 1.5189 4.0268 3.6285 3.4396 3.8286 3.5228 2.3181 3.8324 3.9124 3.6009 2.7289 2.0022 4.5493 3.2521 4.2977 4.4935 3.5995 1.2929 2.3856 1.6149 2.4363 3.2656 1.7981 4.5786 1.7741 1.9542 1.4672 3.7939 1.9299 1.4500 6.0627 2.0038 1.3855 1.4079 2.9605 3.7473 2.6108 2.5971 3.6811 1.5259 1.3113 3.3451 1.8886 3.4586 1.4398 3.5836 2.4957 1.2751 2.1916 2.6651 2.9572 2.7100 2.8473 2.4627 2.4224 2.5660 2.7292 1.5658 1.6095 3.1177 1.4523 1.4389 1.5822 2.2817 1.8151 2.0688 1.7736 1.9642 1.5779 1.4597 1.2460 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3.2959 203.2099 16.6837 16.3913 20.4807 10.9532 12.6085 17.1612 1.8297 64.5348 26.1148 21.9901 20.1941 8.8964 72.6678 57.5543 14.0410 137.4569 6.6619 9.1622 2.1745 21.5239 30.1285 37.4642 13.9289 8.0776 20.1968 2.7368 63.8274 33.4453 28.8255 5.3563 7.2498 6.0094 57.6233 7.8300 2.6728 23.0545 10.8778 48.9152 62.1761 55.8625 41.3270 15.2981 22.5750 5.6165 0.3494 4.8550 4.8243 0.3304 0.1662 20.8580 8.1470 3.4240 31.0588 11.2370 31.2015 1.9004 15.7105 2.0306 8.6061 1.2028 59.7312 37.4088 0.9435 6.9893 93.6207 18.5498 125.5152 12.1683 29.8535 14.7794 14.6763 28.1247 83.0088 54.5061 50.7020 2.2750 321.1591 18.2900 52.8990 61.6378 88.1050 14.4322 146.5050 117.1848 155.8413 4.4690 19.1798 45.5895 23.8751 2.4806 24.8944 23.1699 83.5626 190.2847 3.9463 137.5231 5.0700 11.6108 9.0207 53.6862 96.2335 11.1779 2.3001 122.3669 0.1006 3.6591 1.2714 66.9652 47.3329 18.0507 9.9963 194.6859 1.5269 93.5326 18.7947 496.0442 136.1786 141.6111 9.5257 306.3275 719.6145 368.9290 341.2041 19.6486 19.9804 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1857.76 1876.24 1883.44 1895.21 1904.77 1923.26 1943.12 1956.55 1969.40 1977.77 1995.85 2002.11 2005.93 2012.36 2017.12 2037.11 2067.07 2102.20 2117.50 2124.14 2137.20 2146.49 2155.01 2165.60 2186.65 2192.91 2197.36 2206.23 2207.89 2222.43 2243.87 2249.29 2334.59 2345.96 2353.44 2360.84 2364.45 2365.24 2367.67 2373.09 2382.07 2387.77 2424.84 2448.17 2475.25 2557.97 2582.16 2600.10 2617.41 2622.75 2664.78 2746.25 4558.56 4580.49 4586.22 4591.61 4594.67 4652.98 4654.62 4663.44 4670.54 4678.22 4697.31 4714.32 4749.60 4809.68 4846.07 4856.64 4862.72 4893.19 4899.96 4945.44 4964.00 5015.25 5572.29 5585.38 5696.32 5809.05 5913.59 5917.32 0.557553 0.587905 0.588849 0.493025 -1708.123332 -1708.092979 -1708.092035 -1708.187859 3.213953D-04 MUNgauss RevisionA2.0 retrievium 03-Feb-2020 DUDE c1cc(c(c(c1)O)C(=O)N(Cc2ccco2)[C@H](c3c(cc(cc3O)O)O)C(=O)NC4CCCCC4)O C36500501 RHF 6-31G(d) (6D,10F) C1 496.184566 |X|Y|Z| 72.883282 91.843227 54.603930 71.498948 29 6 7 8 26 2 1 |36.858105| |13.800844|36.858105| |7.963396|13.707058|36.858105| |6.892496|7.896464|13.622985|36.858105| |7.996130|6.857521|7.884635|13.590510|36.858105| |13.750105|7.885110|6.821475|7.878617|13.781625|36.858105| |5.292904|4.621921|5.213035|7.955956|14.170172|8.149014|73.516695| |4.476929|5.020836|7.537789|12.768125|7.659028|5.057147|12.017718|36.858105| |3.864165|4.123069|5.542539|8.169568|6.527629|4.480976|11.985993|15.632272|73.516695| |3.741030|4.286416|6.094689|7.728963|5.338426|4.001874|8.685364|14.104198|15.101188|53.358707| |3.772670|4.333875|5.772353|6.479000|4.837618|3.901936|7.649509|7.697017|9.506620|17.662643|36.858105| |3.179531|3.737687|4.690920|4.628439|3.621204|3.130474|5.762092|5.194559|7.183261|10.392060|12.740372|36.858105| |2.660524|3.022612|3.556694|3.527739|2.947253|2.625951|4.840160|3.882454|5.743015|7.093999|7.368802|14.190657|36.858105| |2.432633|2.801774|3.219476|3.055067|2.567534|2.343402|4.182921|3.278818|4.985618|5.634017|5.142314|8.564222|13.232227|36.858105| |2.665774|3.184235|3.735719|3.391192|2.759724|2.516403|4.390073|3.601629|5.403789|6.120262|5.323166|8.783425|8.613214|14.228306|36.858105| |3.187231|3.925106|4.946577|4.446763|3.411595|3.019213|5.296808|4.795727|6.786830|8.642242|7.795518|14.173435|8.654011|8.634898|14.189819|73.516695| |2.937409|3.299923|4.326300|5.027244|3.918558|3.110741|6.787709|7.850378|12.394075|17.726523|7.591737|6.413206|4.969912|4.101683|4.359058|9.990463|36.858105| |2.711490|3.056530|3.883310|4.266388|3.411761|2.813404|5.849544|5.838537|9.005014|12.827382|7.816941|7.925261|6.393322|5.071664|5.170563|11.517733|17.651071|0.500000| |2.579885|2.767826|3.433077|4.104102|3.519320|2.814949|6.575656|5.991945|11.232806|10.114036|5.359319|4.529818|3.934490|3.285088|3.320049|6.997586|12.478158|0.253967|36.858105| |2.336238|2.465558|2.952736|3.452336|3.086052|2.544780|5.830672|4.568524|8.124446|7.706225|4.907836|4.299671|4.035060|3.279074|3.140562|6.350629|7.581509|0.208863|13.593576|36.858105| |2.063743|2.135859|2.483167|2.874339|2.679985|2.259784|5.188993|3.603772|6.670404|5.572454|3.674151|3.298757|3.196821|2.701130|2.576578|5.049990|5.000568|0.136350|7.792941|13.802989|36.858105| |1.983043|2.037023|2.353042|2.731277|2.586848|2.184787|5.094750|3.406908|6.669637|4.957124|3.150636|2.822764|2.683644|2.340954|2.289122|4.487090|4.397074|0.113433|6.777316|7.999166|13.728708|36.858105| |2.120230|2.190376|2.565226|3.011632|2.821228|2.344423|5.569241|3.874812|8.078581|5.425467|3.246357|2.870422|2.641440|2.332116|2.343740|4.673048|4.923656|0.118546|7.818273|6.923535|7.929465|13.809856|36.858105| |2.422987|2.554377|3.098467|3.704968|3.313614|2.672054|6.397809|5.170887|11.170721|7.348865|4.018360|3.468038|3.066026|2.679204|2.748128|5.655279|7.320406|0.157730|13.606070|8.006054|6.864776|7.948616|13.697749|36.858105| |2.518811|2.673337|3.259117|3.863724|3.427453|2.763468|6.511553|5.336151|12.721789|6.889918|3.685799|3.213745|2.789105|2.509141|2.652891|5.490196|6.345746|0.134489|7.946808|5.247824|4.634316|5.313390|8.227109|14.240076|73.516695| |1.768210|1.797467|2.032558|2.322089|2.246726|1.941884|4.431629|2.776822|5.384701|3.961094|2.606985|2.378113|2.302894|2.043168|1.987339|3.825555|3.357999|0.088776|4.586579|5.307719|8.175944|14.180047|7.984065|5.230108|7.203443|73.516695| |2.365482|2.518764|2.999454|3.412955|3.017634|2.533521|5.521999|4.315681|7.105558|7.781168|5.743128|5.270448|5.255751|3.975496|3.614273|7.222810|6.949954|0.231135|8.113448|14.090006|8.051763|5.260202|4.642476|5.284335|7.143132|7.212097|73.516695| |2.805492|3.232448|4.216333|4.521823|3.509580|2.879795|5.911597|6.366717|10.928024|10.634982|5.356321|5.173740|4.136021|3.802848|4.335987|9.625858|12.340274|0.255556|7.299776|5.027388|3.846854|3.654743|4.270568|6.086244|11.507423|5.191004|8.204780|36.858105| |3.130372|3.747605|5.051219|5.074324|3.775538|3.128016|6.073573|6.638169|10.938676|9.765534|5.129662|4.961542|3.857156|3.664751|4.415417|10.116455|7.927021|0.179827|5.254783|3.932456|3.153298|3.039077|3.516846|4.708899|9.481876|4.465500|6.649155|15.780045|73.516695| |2.347319|2.645566|3.264373|3.442773|2.839503|2.404390|4.904677|4.474167|8.115112|7.090747|4.067362|4.144036|3.617130|3.459813|3.818177|7.691101|7.822083|0.198658|6.387551|4.747258|3.830452|3.727654|4.351829|5.836323|10.883037|5.353484|7.572147|14.241343|15.115412|53.358707| |2.148094|2.420181|2.896750|2.950928|2.489236|2.166921|4.270960|3.582258|6.585802|5.296372|3.212767|3.328068|2.980927|2.987170|3.348491|6.447134|4.978822|0.130639|4.357188|3.512235|3.032879|3.045842|3.528792|4.336637|8.641127|4.589626|5.731583|7.751010|12.066333|17.785419|36.858105| |1.886943|2.072865|2.417529|2.507553|2.194539|1.926944|3.861502|2.999509|5.695442|4.324503|2.677713|2.719896|2.512147|2.493988|2.690081|5.074002|3.988658|0.105001|3.910352|3.274938|2.988173|3.127193|3.651783|4.189773|8.322914|4.821345|5.196804|5.243922|8.146490|10.614641|12.452692|36.858105| |1.722531|1.886316|2.149648|2.184808|1.940860|1.740085|3.394344|2.511054|4.726214|3.542780|2.260404|2.313919|2.161022|2.189797|2.371418|4.382113|3.077462|0.082135|2.985355|2.592455|2.416056|2.527736|2.878376|3.176528|6.310810|4.035642|4.222165|3.884943|6.545095|6.815145|7.539198|12.437614|36.858105| |1.651088|1.822654|2.058883|2.048336|1.812485|1.644840|3.129680|2.310018|4.219460|3.315445|2.178391|2.297350|2.179224|2.273113|2.474624|4.434685|2.833380|0.078150|2.668084|2.375660|2.196905|2.235057|2.464063|2.715934|5.206309|3.592765|3.995928|3.531697|6.072074|6.027695|6.438577|7.517411|12.440259|36.858105| |1.818261|2.046230|2.332552|2.270794|1.969092|1.787350|3.337661|2.548479|4.548573|3.700382|2.440549|2.632070|2.466405|2.629710|2.960198|5.270014|3.133525|0.087254|2.800377|2.463837|2.216170|2.206322|2.426926|2.756974|5.285436|3.495869|4.227875|4.071911|7.276557|6.781584|7.535250|6.442296|7.537287|12.440863|36.858105| |2.014091|2.289900|2.685666|2.638805|2.234661|1.990920|3.777269|3.062509|5.389655|4.619458|2.992197|3.283126|3.033117|3.213986|3.664049|6.625238|4.112308|0.116397|3.519790|3.026765|2.632976|2.572174|2.839043|3.343717|6.307233|3.970616|5.208221|5.730946|9.699586|10.491125|12.441110|7.537432|6.450040|7.528456|12.438905|36.858105| |5.310134|8.199877|14.269178|7.922276|5.206851|4.617190|7.068807|6.519771|8.821674|8.360736|5.814570|5.344536|3.936332|3.718657|4.629748|11.450666|4.635903|0.118680|3.479531|2.964487|2.463953|2.322359|2.534219|3.093038|5.811655|3.554500|5.412373|4.877028|11.231321|5.042551|3.317408|2.662434|2.366354|2.303546|2.690910|3.151064|73.516695| |17.711171|8.973391|5.663582|4.961721|5.677934|8.953382|7.590416|3.573651|5.659794|4.219820|3.169979|2.769535|2.383585|2.213689|2.405997|4.964342|2.524483|0.065692|2.253390|2.071231|1.855982|1.789056|1.898148|2.133474|3.932083|2.870821|3.739668|2.433560|4.784244|2.833815|1.932199|1.715469|1.584538|1.527835|1.675471|1.831886|7.620695|0.500000| |8.859924|17.752583|8.967784|5.641770|4.947548|5.611460|6.520625|4.097639|6.155393|5.031747|3.809511|3.504944|2.897734|2.776171|3.202346|6.806123|2.971632|0.078120|2.493529|2.242825|1.955913|1.865380|1.995270|2.305848|4.291158|2.948409|4.103788|2.986877|6.196092|3.394830|2.327383|1.990216|1.835667|1.797639|2.035120|2.251108|13.428890|0.214134|0.500000| |8.836398|5.611455|4.928467|5.630267|8.973939|17.753832|13.287171|4.132780|6.847371|4.604290|3.315888|2.717030|2.342844|2.099484|2.220483|4.624585|2.735086|0.069295|2.555630|2.351656|2.133062|2.078887|2.213397|2.464598|4.504990|3.331484|4.140821|2.529313|4.795212|2.940449|1.962144|1.774557|1.613008|1.522390|1.636523|1.805342|6.514910|0.213518|0.123241|0.500000| |4.483734|4.193893|4.987609|7.734814|10.061116|6.130836|35.582866|7.984842|16.415634|7.392326|4.418652|3.317887|2.772690|2.393632|2.518347|5.424952|4.336040|0.100147|4.310422|3.678096|3.251017|3.247008|3.659750|4.310042|7.911549|4.922255|5.971465|3.743765|6.727868|4.190249|2.644339|2.395106|2.076724|1.889698|2.006132|2.287725|7.085452|0.102085|0.094612|0.154199|0.500000| |3.382658|3.676899|4.560021|5.305974|4.416448|3.609168|7.459677|6.254475|8.515419|12.412727|17.599716|9.122543|7.054388|4.699436|4.478297|10.236963|6.646287|0.196472|5.456665|5.534017|4.115415|3.388577|3.359287|4.023753|6.268157|4.981574|12.478930|4.538443|7.408498|4.989967|2.908550|2.506515|2.117590|2.033498|2.232869|2.703951|7.839090|0.080620|0.090358|0.088106|0.119213|0.500000| |4.650030|5.441153|7.300535|7.868168|5.747562|4.710946|8.405590|7.454746|9.030976|12.502264|17.682704|8.986696|5.924981|4.521519|4.816116|12.181706|5.614951|0.152748|4.293037|3.942352|3.130278|2.766625|2.868448|3.464240|5.855262|4.165970|7.855108|4.467503|8.153816|4.719562|2.867626|2.414318|2.084316|2.014651|2.257807|2.695582|11.869957|0.105634|0.128379|0.107472|0.128145|0.303454|0.500000| |2.485137|2.739670|3.157418|3.230726|2.796099|2.498297|4.708926|3.559029|5.384887|6.327226|6.405480|8.834305|17.801257|8.439248|5.859628|10.474195|4.506265|0.157669|3.850209|4.208261|3.385935|2.770113|2.650219|3.001099|4.743884|4.257429|10.369277|3.637081|5.921591|4.442507|2.698256|2.342877|2.018440|2.020692|2.237334|2.706950|5.955204|0.062328|0.072378|0.062885|0.074734|0.197932|0.145691|0.500000| |2.158599|2.444824|2.737266|2.609582|2.249731|2.081486|3.709424|2.775362|4.327441|4.604036|4.036919|5.837916|8.434580|17.802614|8.827493|10.455748|3.420578|0.114746|2.873688|2.925665|2.483253|2.163143|2.132631|2.397450|3.991922|3.409806|6.241756|3.226309|5.512752|4.150210|2.705638|2.313731|2.062790|2.168630|2.482942|2.962558|5.515641|0.055342|0.067879|0.052477|0.058832|0.106736|0.101252|0.192713|0.500000| |2.537697|3.050009|3.498150|3.100432|2.549909|2.361701|4.046278|3.232591|4.964051|5.223581|4.263038|6.041675|5.820762|8.612473|17.839257|16.524635|3.769747|0.118807|2.943545|2.751997|2.309241|2.093525|2.163148|2.516687|4.413201|3.264002|5.445083|3.992107|7.501712|4.921403|3.338026|2.669098|2.408402|2.567820|3.148158|3.810512|7.874744|0.064346|0.087412|0.058109|0.064425|0.101039|0.111385|0.123142|0.194981|0.500000| |1.920701|1.975693|2.258066|2.572740|2.431625|2.091381|4.683580|3.104649|5.619624|4.782675|3.327112|3.057212|3.066739|2.598448|2.428202|4.661600|4.088665|0.116131|5.570421|8.869574|17.724461|8.922568|5.649751|4.948428|6.531739|13.303264|12.872730|3.245542|4.861845|4.418625|2.653660|2.625554|2.176412|2.012422|2.026436|2.374203|3.978893|0.048433|0.050605|0.055308|0.079665|0.105368|0.079913|0.092723|0.067451|0.060473|0.500000| |2.010431|2.061510|2.380285|2.765995|2.637364|2.222224|5.228385|3.443277|7.310864|4.642258|2.813160|2.513106|2.317485|2.084309|2.112107|4.176631|4.034553|0.097953|5.614001|4.979646|5.624572|8.861043|17.727877|8.972709|13.530304|12.658967|6.541327|3.738624|5.688295|5.256830|3.317078|3.559165|2.877838|2.419417|2.340458|2.665370|4.165829|0.050352|0.052380|0.058827|0.095105|0.079771|0.070715|0.064241|0.053354|0.054888|0.123838|0.500000| |2.875915|3.072950|3.852019|4.727686|4.081760|3.184579|7.678654|6.947373|19.168109|8.174482|4.119301|3.469517|2.920344|2.609456|2.802103|5.958606|6.928642|0.139438|7.522135|4.933851|4.189385|4.528756|6.279955|10.117887|35.308422|6.295031|7.038069|7.062760|11.025662|7.968527|4.659446|4.201071|3.297836|2.790847|2.915768|3.483562|6.760912|0.069000|0.075814|0.079747|0.150476|0.106541|0.103549|0.076687|0.064106|0.072665|0.094369|0.160547|0.500000| |1.723518|1.746499|1.966013|2.241199|2.183140|1.894402|4.321138|2.659650|5.251023|3.709341|2.416903|2.205674|2.118551|1.902008|1.870367|3.601456|3.115431|0.081188|4.143234|4.455297|6.073667|10.038956|7.831105|4.997387|7.267163|35.739666|6.184146|2.794400|4.326626|3.944770|2.538568|2.715474|2.295077|2.017388|1.942672|2.178546|3.432248|0.043833|0.044811|0.050985|0.075267|0.071035|0.061054|0.060532|0.049644|0.048418|0.152186|0.228706|0.098068|0.500000| |2.164363|2.277053|2.646072|2.970238|2.698681|2.314036|4.976828|3.596511|6.014899|6.114508|4.672622|4.437998|4.694811|3.651275|3.241188|6.241141|5.171653|0.166559|6.044288|10.018058|7.966139|5.054997|4.207041|4.452051|6.156440|7.310891|35.740872|3.781111|5.619383|4.913267|2.849370|2.648465|2.191229|2.087983|2.184024|2.636280|4.746071|0.054112|0.058425|0.059898|0.082955|0.158890|0.105320|0.152287|0.092639|0.077240|0.235940|0.094638|0.093746|0.096223|0.500000| |2.190616|2.422856|2.941048|3.165316|2.679830|2.271412|4.737021|4.111817|7.563032|6.591268|3.882194|3.919455|3.550729|3.329250|3.510402|6.910667|7.552940|0.201087|7.345909|5.580852|4.516124|4.380635|5.064614|6.679126|11.177116|6.146386|8.502923|9.501218|10.912306|26.058565|9.007764|7.483063|4.714260|4.125816|4.340999|6.213672|5.751949|0.054266|0.063227|0.057333|0.082777|0.101315|0.090894|0.091699|0.082738|0.090881|0.104230|0.120869|0.155325|0.091317|0.112713|0.500000| |2.293994|2.603668|3.130308|3.155984|2.644949|2.302988|4.489146|3.780826|7.057131|5.325594|3.175770|3.211942|2.811960|2.808133|3.209482|6.326324|4.709338|0.118440|4.050438|3.220983|2.794438|2.838856|3.340366|4.135084|8.782751|4.306433|5.255833|7.495416|13.783768|12.648108|17.601845|8.899847|6.839075|5.700320|6.846188|8.905992|6.415080|0.057125|0.069562|0.057613|0.077364|0.078707|0.080560|0.070425|0.070249|0.089903|0.068026|0.088895|0.137653|0.066796|0.072621|0.183976|0.500000| |1.928532|2.095139|2.447691|2.594815|2.295080|1.996663|4.102923|3.145265|6.196626|4.418588|2.677162|2.634786|2.410560|2.341303|2.506835|4.820408|4.068274|0.103019|4.198474|3.432609|3.183434|3.462819|4.244114|4.851951|10.223866|5.302395|5.261477|5.178844|7.987224|9.712772|8.863059|17.549871|8.789660|5.478249|4.837084|5.502212|4.688402|0.048554|0.055282|0.051274|0.071622|0.070150|0.067278|0.063074|0.060066|0.068276|0.076429|0.118310|0.136250|0.084361|0.074330|0.198936|0.216022|0.500000| |1.781732|1.946174|2.256779|2.350327|2.071534|1.823823|3.668935|2.809391|5.259541|4.149834|2.626552|2.702819|2.557093|2.538818|2.675264|4.953503|3.889351|0.106233|3.935240|3.429683|3.173699|3.288438|3.713595|4.118395|7.609186|5.097381|5.458972|4.774807|7.162291|9.711748|8.856963|17.467956|8.852131|6.776908|5.663929|6.799996|4.391628|0.045143|0.051930|0.046869|0.062913|0.069414|0.065120|0.066987|0.066138|0.073050|0.078041|0.098876|0.105268|0.078931|0.078126|0.219363|0.174274|0.302262|0.500000| |1.781840|1.952946|2.218766|2.243552|1.996521|1.795441|3.476688|2.550934|4.846399|3.513612|2.225365|2.250582|2.074558|2.096410|2.296224|4.295157|2.976177|0.077954|2.855007|2.449813|2.277140|2.394948|2.760377|3.071924|6.316774|3.827893|3.988888|3.795048|6.678411|6.274886|6.791165|8.859638|17.504881|8.850977|6.781991|5.659523|4.335812|0.045549|0.052859|0.046192|0.059103|0.057489|0.057697|0.053640|0.054562|0.065126|0.056904|0.077571|0.093544|0.060844|0.057339|0.116543|0.201487|0.214750|0.173818|0.500000| |1.592974|1.723936|1.944363|1.991918|1.797236|1.618551|3.177555|2.275357|4.310805|3.193381|2.057180|2.090698|1.974519|1.988653|2.118944|3.896988|2.751671|0.073664|2.756173|2.443718|2.334233|2.478931|2.801048|2.982045|5.838226|4.035374|3.957028|3.314467|5.533865|5.647764|5.498242|8.837357|17.540321|8.805851|5.489068|4.839532|3.744690|0.040911|0.046529|0.042023|0.053927|0.054247|0.052860|0.051869|0.052482|0.059414|0.058838|0.079202|0.083522|0.064377|0.057725|0.113970|0.140207|0.211481|0.215211|0.303628|0.500000| |1.551770|1.704502|1.898953|1.878205|1.679679|1.540266|2.899400|2.081605|3.803809|2.948468|1.957902|2.055742|1.957426|2.047624|2.223835|3.966866|2.459061|0.067649|2.329373|2.096522|1.959847|2.001585|2.193851|2.384036|4.579076|3.261226|3.543316|2.990443|5.255625|4.861471|4.833824|5.484418|8.819737|17.535555|8.810778|5.486417|3.751134|0.040169|0.046970|0.039793|0.048348|0.050929|0.050894|0.050642|0.054665|0.064555|0.050291|0.060470|0.068720|0.051129|0.051829|0.093123|0.127562|0.123031|0.139244|0.215007|0.211490|0.500000| |1.570869|1.725836|1.944771|1.945301|1.728899|1.569660|3.001135|2.199439|3.992751|3.203539|2.132915|2.270413|2.193793|2.295793|2.452426|4.327400|2.764048|0.077771|2.641262|2.403531|2.240885|2.263714|2.450304|2.659541|4.949956|3.661245|4.067842|3.335740|5.576442|5.755333|5.649349|6.765110|8.850591|17.493803|8.850457|6.778271|3.845884|0.040448|0.047222|0.040486|0.050231|0.055898|0.054419|0.056947|0.061540|0.070181|0.057479|0.066360|0.072989|0.056793|0.059554|0.114393|0.131711|0.138943|0.199311|0.173754|0.214701|0.303334|0.500000| |1.894517|2.142663|2.433662|2.342371|2.029206|1.850486|3.413492|2.592774|4.647588|3.676142|2.406606|2.557793|2.356403|2.496947|2.854077|5.176023|3.030099|0.082541|2.685131|2.335760|2.100345|2.105261|2.339601|2.672822|5.251449|3.339611|3.994547|3.979313|7.510173|6.249553|6.791693|5.659135|6.783728|8.850425|17.500413|8.851502|5.016764|0.048526|0.059490|0.046952|0.056911|0.060637|0.062741|0.059199|0.064981|0.084981|0.053238|0.063222|0.081888|0.051832|0.057171|0.108748|0.201869|0.126817|0.131172|0.199518|0.139259|0.214767|0.173736|0.500000| |1.726753|1.943484|2.186771|2.105213|1.835491|1.684329|3.098986|2.322657|4.085968|3.393982|2.299766|2.525925|2.411138|2.633147|2.955735|5.093565|2.819573|0.080145|2.517550|2.266402|2.047275|2.015993|2.176889|2.441649|4.586681|3.224359|3.963754|3.514198|6.313477|5.612857|5.493356|4.833062|5.489484|8.808611|17.538605|8.827937|4.492562|0.044505|0.054229|0.042945|0.051260|0.058668|0.059440|0.060725|0.070234|0.089169|0.052670|0.058147|0.070708|0.049567|0.057418|0.102674|0.140314|0.106560|0.126780|0.139272|0.123107|0.211371|0.214670|0.303643|0.500000| |1.893598|2.132266|2.482482|2.464308|2.108200|1.881362|3.596172|2.866202|5.011543|4.425665|2.939030|3.287775|3.148069|3.364108|3.695471|6.458935|4.015001|0.118861|3.528452|3.140839|2.745709|2.642849|2.846481|3.286565|5.938368|4.093772|5.478671|5.160680|8.213799|9.639067|8.874395|6.808524|5.672785|6.777901|8.828187|17.493581|5.097877|0.048014|0.058120|0.047662|0.060321|0.075175|0.072615|0.078844|0.087682|0.104986|0.069415|0.073429|0.089542|0.061831|0.077776|0.178195|0.174591|0.139937|0.201088|0.131254|0.127023|0.139147|0.199454|0.173508|0.214118|0.500000| |2.179055|2.527210|2.989893|2.859922|2.375871|2.123211|3.938972|3.274294|5.583309|5.002558|3.290002|3.721662|3.374878|3.672794|4.415245|7.945590|4.303549|0.123565|3.481657|2.993059|2.556114|2.455040|2.688286|3.206447|6.016334|3.778889|5.285448|6.065527|11.084112|9.571324|8.870300|5.506052|4.841200|5.483272|8.792136|17.558191|6.474170|0.054861|0.069640|0.052960|0.065738|0.080612|0.082668|0.081388|0.092323|0.131641|0.064304|0.069546|0.095290|0.057273|0.073788|0.152875|0.216483|0.123822|0.139861|0.126797|0.106665|0.123019|0.139145|0.214483|0.211303|0.302635|0.500000| 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