Version2.1 2021-01-13T19:05:24Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 08-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cccc2c1[nH]c(=O)c(c2)[C@H](c3nnnn3C(C)(C)C)N4CCCc5c4cccc5 C06443749 RHF 6-31G(d) (6D,7F) Cc1cccc2c1[nH]c(=O)c(c2)[C@H](c3nnnn3C(C)(C)C)N4CCCc5c4cccc5 C01[X(C25H28N6O1)] 174 C1 536 O=c1[nH]c2c(cc1[C@H](c1nnnn1C(C)(C)C)N1CCCc3c1cccc3)cccc2C O=c1[nH]c2c(cc1[C@H](c1nnnn1C(C)(C)C)N1CCCc3c1cccc3)cccc2C Cc1cccc2C=C([C@@H](N3CCCc4ccccc34)c5nnnn5C(C)(C)C)C(=O)Nc12 InChIKey=DOJWNXUMHGZUNZ-JOCHJYFZSA-N InChI=1S/C25H28N6O/c1-16-9-7-11-18-15-19(24(32)26-21(16)18)22(23-27-28-29-31(23)25(2,3)4)30-14-8-12-17-10-5-6-13-20(17)30/h5-7,9-11,13,15,22H,8,12,14H2,1-4H3,(H,26,32)/t22-/m1/s1 InChI=1/C25H28N6O/c1-16-9-7-11-18-15-19(24(32)26-21(16)18)22(23-27-28-29-31(23)25(2,3)4)30-14-8-12-17-10-5-6-13-20(17)30/h5-7,9-11,13,15,22H,8,12,14H2,1-4H3,(H,26,32)/t22-/m1/s1/f/h26H Cc1cccc2c1[nH]c(=O)c(c2)[C@H](c3nnnn3C(C)(C)C)N4CCCc5c4cccc5 C01[X(C25H28N6O1)] 174 C01 536 O=c1[nH]c2c(cc1[C@H](c1nnnn1C(C)(C)C)N1CCCc3c1cccc3)cccc2C O=C1N[C]2[C]([CH]=C1[C@H]([C]1[N][N][N][N]1C(C)(C)C)N1CCC[C]3[C]1[CH][CH][CH][CH]3)[CH][CH][CH][C]2C C[C]1[CH][CH][CH][C]2C=C([C@H]([C]3[N][N][N]N3C(C)(C)C)N4CCC[C]5[CH][CH][CH][CH][C]45)C(=O)N[C]12 InChIKey=DOJWNXUMHGZUNZ-JOCHJYFZSA-N InChI=1S/C25H28N6O/c1-16-9-7-11-18-15-19(24(32)26-21(16)18)22(23-27-28-29-31(23)25(2,3)4)30-14-8-12-17-10-5-6-13-20(17)30/h5-7,9-11,13,15,22H,8,12,14H2,1-4H3,(H,26,32)/t22-/m1/s1 InChI=1/C25H28N6O/c1-16-9-7-11-18-15-19(24(32)26-21(16)18)22(23-27-28-29-31(23)25(2,3)4)30-14-8-12-17-10-5-6-13-20(17)30/h5-7,9-11,13,15,22H,8,12,14H2,1-4H3,(H,26,32)/t22-/m1/s1/f/h26H 3322.9676869892 -1364.5354597 1-A 13394.9441 114 422 536 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.53418 -15.64780 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7.2085 7.1789 7.2444 7.2526 7.2557 7.3119 7.3924 7.4445 7.4585 9.5019 0.2934 0.6774 0.2532 0.4601 0.9691 1.6292 0.3509 3.9286 2.4151 0.6202 1.1153 1.7411 0.0089 0.7784 0.6834 0.2471 2.3421 0.4477 0.0735 2.0131 2.6891 1.9949 2.9084 0.2114 4.9223 0.4250 2.1494 3.2462 1.5367 2.6689 0.1845 2.8527 2.2591 0.5905 4.4809 4.3013 1.7260 0.4678 5.3612 1.4049 2.6252 7.1365 28.8776 12.5806 0.2207 11.8302 6.6318 3.7284 78.7942 3.7761 4.0735 0.2745 1.6802 23.2609 3.5556 0.8842 20.6506 62.1333 30.2084 17.7515 3.4566 19.1892 29.4038 14.0807 7.7821 9.2300 6.7417 8.0356 7.6201 0.2692 0.1698 2.5658 1.2965 0.2159 1.8953 15.6855 0.6136 4.6442 12.4717 5.5308 1.4146 5.8330 7.9007 0.4243 19.0613 0.3327 11.9092 18.3839 16.3287 8.6215 9.8145 24.4989 20.7331 16.6358 44.2631 8.0957 29.8624 8.5686 55.6928 51.5872 5.2504 66.5606 20.5319 51.1480 10.8860 52.5764 34.8988 31.0408 9.6456 59.3903 25.3077 27.2531 5.2422 100.8239 5.5885 12.5723 4.9590 12.9756 5.0445 15.2059 23.8555 22.4912 10.9655 24.1256 5.4853 54.8425 17.5022 7.0460 2.4829 3.0456 0.5263 3.9275 2.6037 12.6955 2.3206 8.6790 116.1054 7.6031 43.1793 14.8848 12.4490 16.4524 91.4156 56.7177 68.4677 916.5207 20.3911 91.8758 28.2828 16.1616 34.8363 24.9304 23.2856 25.2755 56.8846 51.5673 4.9303 32.9345 60.6374 22.2638 10.0402 12.0933 5.6174 26.9452 10.9687 14.0754 21.1915 5.4927 1.0706 23.2953 52.3779 27.3121 28.8472 68.7992 3.3998 6.0773 3.9729 4.4340 0.5030 3.5089 0.4102 0.1101 0.4466 1.2956 2.8231 0.9656 1.3905 1.4321 0.2198 1.9494 1.6215 2.7318 0.7721 1.6955 0.5799 0.8219 0.6916 0.9360 0.6531 0.3640 1.1689 1.3835 0.8310 0.5096 1.2606 1.9423 2.0272 0.9361 5.3036 3.2932 0.7235 3.1972 3.3056 1.4891 0.3430 9.8855 2.7300 2.3708 0.0921 4.8854 4.6506 4.7757 1.2156 3.6196 11.6256 8.5499 11.9092 2.8064 4.8742 1.8543 2.5986 0.8017 6.6653 0.5896 1.8509 8.6369 4.9490 2.0804 2.1184 0.7625 5.5367 1.2324 1.3100 6.5491 4.9903 1.1743 1.4795 0.0889 17.4508 7.7182 0.4323 1.3662 2.7365 6.5567 6.0884 16.7030 4.0334 5.1693 13.9253 0.5514 7.5064 9.7154 8.0012 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0.4768 0.8526 0.1932 0.7380 0.7811 0.5877 0.8498 0.6595 0.5641 0.8434 0.3611 0.2972 0.2446 0.3413 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 6 6 6 6 6 6 6 7 1 6 8 6 6 6 1 6 7 7 7 7 6 6 6 6 7 6 6 6 6 6 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 15.99491 12.00000 12.00000 12.00000 1.00783 12.00000 14.00307 14.00307 14.00307 14.00307 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 10014.6665 16085.0719 21076.0545 0.99990 0.01232 0.00722 -0.01208 0.99941 -0.03226 -0.00761 0.03216 0.99945 1 0.00865 0.00538 0.00411 0.18021 0.11220 0.08563 22.95 41.04 46.66 54.58 62.65 70.54 103.78 151.07 177.74 192.89 215.12 237.05 246.70 262.18 288.06 291.93 294.97 332.32 342.52 388.60 421.76 426.32 429.59 439.74 498.04 510.19 523.25 530.91 548.05 581.40 585.98 623.84 639.58 661.26 677.58 688.00 719.89 758.98 765.18 808.81 838.15 842.32 857.45 869.12 877.48 901.70 925.25 934.78 989.52 1028.89 1073.43 1107.93 1151.29 1163.58 1169.75 1177.96 1192.50 1210.69 1241.38 1266.47 1272.34 1284.89 1294.74 1349.88 1365.60 1402.56 1407.79 1428.94 1446.03 1456.52 1474.39 1492.24 1518.95 1530.86 1540.70 1552.67 1576.86 1587.19 1592.94 1631.14 1639.92 1645.27 1662.37 1673.95 1678.99 1686.79 1704.08 1725.09 1751.37 1780.31 1787.88 1808.46 1827.35 1857.30 1866.14 1873.23 1876.36 1903.00 1906.45 1924.40 1965.46 1977.92 1986.37 1989.02 2000.03 2015.59 2016.07 2036.01 2046.54 2072.59 2088.42 2122.61 2165.46 2182.31 2189.61 2233.14 2246.07 2246.97 2260.01 2270.13 2277.26 2289.38 2290.65 2328.45 2333.77 2336.43 2343.81 2352.21 2352.62 2352.99 2362.90 2365.09 2366.95 2371.22 2385.11 2390.76 2399.89 2407.97 2419.78 2467.58 2558.68 2570.13 2599.55 2604.76 2642.77 2783.24 4571.09 4586.14 4596.44 4630.13 4633.48 4633.68 4647.95 4665.96 4671.23 4700.06 4716.40 4729.71 4739.32 4739.82 4749.45 4768.75 4772.85 4785.84 4799.03 4814.40 4830.49 4831.15 4838.50 4848.97 4866.35 4881.54 4898.76 5565.68 0.538112 0.564170 0.565114 0.480627 -1363.997348 -1363.971290 -1363.970346 -1364.054833 2.833708D-04 MUNgauss RevisionA2.0 retrievium 13-Jan-2021 DUDE Cc1cccc2c1[nH]c(=O)c(c2)[C@H](c3nnnn3C(C)(C)C)N4CCCc5c4cccc5 C06443749 RHF 6-31G(d) (6D,10F) C1 428.232460 |X|Y|Z| 86.627898 65.702463 39.669754 60.892852 26 6 7 20 6 |36.858105| |12.613388|36.858105| |7.556016|13.823471|36.858105| |4.988267|7.837982|13.634131|36.858105| |4.411642|6.784610|7.967580|13.898497|36.858105| |4.984799|7.820799|6.901042|7.937190|13.615585|36.858105| |7.506677|13.561050|8.008169|6.870186|7.899966|13.684896|36.858105| |6.568619|7.853802|5.211694|4.589484|5.213433|8.036643|13.816654|53.358707| |7.529555|7.262087|4.781278|4.013742|4.265916|5.811201|9.233446|26.024897|0.500000| |4.468203|5.113976|3.936250|3.758120|4.481460|6.679954|7.740284|18.894547|0.265943|36.858105| |3.899620|4.095098|3.243458|3.061192|3.494835|4.700810|5.401378|11.627804|0.223393|15.833114|73.516695| |3.683748|4.490737|3.778847|3.923628|5.105772|7.759080|6.713737|10.791111|0.161158|12.939243|14.254496|36.858105| |3.837472|5.100615|4.530447|5.091895|7.628813|13.178452|7.843016|9.587445|0.143035|7.866786|9.561613|14.224945|36.858105| |2.852885|3.299101|2.918656|3.070324|3.837211|4.958398|4.359545|6.755876|0.114670|7.225292|11.276545|12.415953|7.705765|36.858105| |2.656665|3.106708|2.833731|3.062084|3.878640|4.782090|4.009799|5.834243|0.099950|5.631182|8.733313|9.136048|7.433525|17.689638|0.500000| |2.608293|2.867344|2.515440|2.564365|3.040050|3.782926|3.611969|5.874072|0.106649|6.226913|11.988088|7.323291|5.024845|12.473407|0.250400|36.858105| |2.386102|2.556103|2.253001|2.272214|2.627795|3.181591|3.115475|5.056877|0.095520|5.061547|10.475994|5.378072|3.986147|7.732889|0.166151|14.710937|53.358707| |2.196840|2.300578|2.036171|2.032877|2.301463|2.728495|2.725802|4.400413|0.085815|4.174859|8.902513|4.182334|3.268476|5.335376|0.127903|9.048138|19.520469|53.358707| |2.235975|2.346697|2.077488|2.074762|2.349569|2.785501|2.781180|4.473745|0.087036|4.209877|8.816172|4.221876|3.326023|5.217798|0.132212|8.876118|12.221966|20.769609|53.358707| |2.480023|2.676742|2.359316|2.384386|2.767830|3.361673|3.277377|5.279249|0.098813|5.210913|10.309101|5.588408|4.206300|7.296438|0.187210|14.162535|12.148548|12.400472|19.434691|53.358707| |2.486918|2.691261|2.396573|2.427162|2.796080|3.332959|3.241632|5.049206|0.094858|4.622569|8.568124|4.911648|4.018275|5.541867|0.160149|7.218021|7.171849|7.478159|10.811635|17.414283|36.858105| |2.082716|2.220611|2.024507|2.058777|2.324676|2.656752|2.576585|3.889216|0.074751|3.380061|6.300445|3.575601|3.100246|4.094895|0.121049|5.147985|5.865209|6.594259|9.417945|10.610158|12.412448|36.858105| |2.754389|2.888006|2.511345|2.461951|2.757775|3.309531|3.417094|5.500157|0.107554|4.818800|9.311312|4.511112|3.735863|4.468825|0.121423|5.461064|5.971036|6.358282|8.568281|10.597129|12.433507|7.564333|36.858105| |2.583761|2.911313|2.648521|2.768123|3.287167|3.885585|3.559949|5.229529|0.094474|4.628698|7.721794|5.477324|4.835754|5.945973|0.197525|6.134227|5.988653|5.674572|7.011412|10.399670|12.465743|7.671419|7.570279|36.858105| |2.607940|2.990847|2.706561|2.871527|3.537369|4.329307|3.800715|5.663864|0.099092|5.478411|8.888631|7.794981|6.173304|13.183921|0.260027|7.771821|9.423045|6.397579|5.749424|6.932779|3.989556|3.255290|3.376254|4.171742|53.358707| |2.760658|3.100234|2.754811|2.840079|3.387588|4.161189|3.886749|5.958501|0.106761|5.613651|9.433157|6.638631|5.338707|7.695924|0.158362|5.966903|8.366779|5.895079|5.099575|5.730435|3.353437|2.777585|3.037399|3.364363|17.676664|36.858105| |2.327372|2.551182|2.330698|2.405357|2.776842|3.204923|3.024394|4.481505|0.083712|3.907570|6.853865|4.355965|3.834450|5.042538|0.117164|4.430447|6.734538|5.124903|4.345992|4.608310|2.758945|2.402646|2.508296|2.739427|10.440414|12.538887|36.858105| |2.125706|2.368553|2.232950|2.369619|2.754425|3.050383|2.767397|3.911320|0.072451|3.294307|5.581597|3.847286|3.643082|4.469466|0.112695|3.767044|5.392786|4.289507|3.784501|4.070720|2.528896|2.247417|2.265161|2.598412|9.197084|7.664515|12.493446|36.858105| |2.029302|2.277812|2.158234|2.320186|2.739529|3.028563|2.685918|3.789678|0.069560|3.258550|5.510252|3.990995|3.764790|5.090005|0.135932|4.240022|5.907315|4.662407|4.162996|4.556367|2.815047|2.526805|2.426118|2.936856|10.717181|6.581081|7.745782|12.627956|36.858105| |2.206840|2.502059|2.334814|2.510350|3.034070|3.476306|3.040354|4.369494|0.078701|3.939881|6.601004|5.166499|4.624854|7.739218|0.208146|5.929421|7.733705|5.725752|5.162808|5.947450|3.545418|3.085579|2.935410|3.742207|18.549488|7.617652|6.822990|7.592152|13.537267|36.858105| |2.025071|2.282490|2.151602|2.321926|2.782475|3.120699|2.732550|3.897757|0.070885|3.463532|5.878895|4.458547|4.073639|6.621226|0.211524|5.701735|7.116999|5.692955|5.379984|6.247011|3.832420|3.474229|3.022607|4.123102|10.574356|5.053174|4.620413|5.039930|7.929597|13.651861|36.858105| |1.777577|1.984151|1.902237|2.058017|2.414013|2.612437|2.309296|3.239110|0.059899|2.769559|4.743082|3.390077|3.231137|4.472492|0.139310|4.092597|5.373169|4.626230|4.401574|4.849459|3.128478|2.994707|2.538701|3.344408|6.979513|3.879064|3.850831|4.450143|6.868738|7.863430|13.737473|36.858105| |1.682984|1.869604|1.806246|1.953324|2.262814|2.410794|2.145662|2.984618|0.055623|2.502009|4.289082|2.988718|2.898439|3.734134|0.110319|3.394103|4.628540|4.005223|3.732479|4.006556|2.597024|2.480252|2.190955|2.739795|6.158359|3.712711|3.978781|5.002464|7.866611|6.768960|7.921403|13.819093|36.858105| |1.781089|1.981676|1.906824|2.056500|2.385882|2.559050|2.282343|3.179645|0.059152|2.665874|4.552147|3.176831|3.074089|3.913233|0.110004|3.453271|4.812953|4.036760|3.671455|3.935811|2.506320|2.331422|2.159527|2.620775|7.046080|4.461890|5.181616|7.552170|13.792901|7.901113|6.935002|8.023878|13.732792|36.858105| |17.525085|8.807281|5.877289|4.272571|3.944978|4.553110|6.644223|8.919133|0.223386|4.558566|7.288323|3.650663|3.678605|2.853092|0.073972|2.677498|3.314439|3.100088|3.202276|3.546334|2.658066|2.214766|3.044826|2.724281|3.467348|2.655830|2.233801|2.029773|1.964047|2.159545|2.007603|1.758994|1.650664|1.730582|0.500000| |17.526269|8.808667|5.877881|4.273513|3.946255|4.554684|6.646481|8.915947|0.223484|4.560691|7.284172|3.653552|3.681247|2.862753|0.072623|2.638419|3.350412|3.070969|3.074331|3.364977|2.417578|2.030200|2.660344|2.462655|3.633616|2.918327|2.471066|2.217900|2.080496|2.242934|2.030177|1.780053|1.697252|1.814196|0.301370|0.500000| |17.600857|8.880871|7.281948|4.748013|3.964935|4.158960|5.557227|6.542648|0.146714|3.572613|5.676261|3.085709|3.261064|2.475844|0.064987|2.276678|2.861592|2.658613|2.705099|2.969192|2.202433|1.882510|2.419856|2.295348|3.127281|2.419251|2.089115|1.935960|1.848365|1.985240|1.835745|1.633217|1.556443|1.642419|0.302598|0.302609|0.500000| |7.037590|8.998487|17.710321|8.914956|5.672291|4.966044|5.676399|5.718596|0.112628|3.288222|5.007083|3.126651|3.607605|2.510007|0.067890|2.214484|2.739562|2.508253|2.556851|2.858533|2.139764|1.839922|2.256673|2.332907|3.205237|2.410683|2.088127|2.007254|1.934584|2.067057|1.919126|1.719449|1.643638|1.730380|0.152895|0.152894|0.225309|0.500000| |4.082550|5.613738|8.879752|17.733966|8.948451|5.637275|4.951994|4.962523|0.091148|3.111707|4.648307|3.276115|4.121979|2.686271|0.075397|2.275775|2.774772|2.504313|2.553952|2.903462|2.179996|1.886920|2.196084|2.482186|3.476582|2.514994|2.186071|2.190423|2.151380|2.292755|2.144013|1.934718|1.851366|1.939437|0.099247|0.099270|0.113378|0.215630|0.500000| |3.531912|4.905520|5.646735|8.942200|17.711083|8.896661|5.633044|5.749780|0.098149|3.907126|5.576745|4.695951|7.001485|3.781108|0.110254|2.959160|3.482807|3.045342|3.106030|3.661259|2.719587|2.297915|2.606894|3.260596|4.846114|3.299819|2.756357|2.826781|2.868014|3.159239|2.933125|2.572378|2.414081|2.527769|0.089923|0.089961|0.090270|0.124361|0.214600|0.500000| |3.219063|4.149684|3.951646|4.683138|7.043706|8.810632|5.621791|6.857773|0.110791|5.593919|7.616229|9.127402|17.689261|7.248391|0.224549|4.666803|5.102241|4.199711|4.265177|5.352836|3.785618|3.027533|3.373449|4.727896|8.564756|5.017506|3.784572|3.821086|4.122947|5.104255|4.586553|3.638916|3.237298|3.397891|0.085723|0.085850|0.078614|0.089988|0.110895|0.213106|0.500000| |1.992220|2.085609|1.892501|1.901764|2.118779|2.416949|2.391050|3.654360|0.071619|3.157905|6.089454|3.218806|2.771657|3.648495|0.103456|4.727843|5.786317|7.024083|10.392853|9.540470|8.745505|17.646428|6.933570|5.534756|4.082666|2.639356|2.319357|2.142478|2.374720|2.842792|3.133953|2.742806|2.318123|2.197875|0.059047|0.054436|0.050147|0.048143|0.048523|0.057782|0.074421|0.500000| |2.034215|2.165975|1.994798|2.030648|2.270497|2.550496|2.474084|3.659962|0.070666|3.072730|5.606855|3.229315|2.902398|3.530427|0.105812|4.126749|4.764481|5.193638|6.841162|7.659894|8.868995|17.560635|6.873155|7.120789|3.888825|2.469552|2.152019|2.038265|2.272839|2.721837|3.045499|2.689962|2.258556|2.119707|0.060401|0.054486|0.051476|0.050643|0.052028|0.062456|0.079100|0.301016|0.500000| |1.948906|2.096846|1.934777|1.993520|2.266599|2.560420|2.432785|3.614600|0.068872|3.143729|5.768313|3.450926|3.032900|4.144174|0.126607|5.112054|5.919668|6.508531|8.676113|9.663846|8.774901|17.565245|5.494901|6.954542|4.599899|2.812678|2.469383|2.349114|2.708086|3.333382|3.937809|3.431372|2.764375|2.535503|0.056789|0.052969|0.049181|0.048854|0.051087|0.063197|0.084535|0.301574|0.300817|0.500000| |3.254739|3.418042|2.876453|2.772624|3.117120|3.881980|4.158472|7.058657|0.137646|6.281445|12.135613|5.390582|4.328204|4.871669|0.127123|5.643008|6.079558|6.102659|7.561886|9.591102|8.772865|5.492243|17.600773|6.839050|4.917763|3.321702|2.670076|2.379580|2.502958|3.024880|3.010280|2.500123|2.184049|2.191391|0.101436|0.087048|0.077529|0.070855|0.067446|0.079918|0.103728|0.141265|0.140538|0.122811|0.500000| |2.656929|2.777840|2.458061|2.412886|2.664007|3.107516|3.194056|4.922825|0.096943|4.046361|7.464656|3.862170|3.394173|3.746614|0.105370|4.271573|4.815381|5.077728|6.499152|7.637472|8.828380|6.893726|17.551195|6.948395|3.984782|2.642711|2.223298|2.046060|2.190388|2.605284|2.711284|2.331319|2.023664|1.979857|0.082258|0.070066|0.065775|0.061922|0.060338|0.070217|0.086544|0.171767|0.205564|0.140419|0.300252|0.500000| |2.563695|2.617498|2.277663|2.210968|2.438076|2.888934|3.030305|4.922896|0.099478|4.272583|8.778226|3.879442|3.214026|3.935570|0.104272|5.021534|5.949825|6.818163|9.412457|9.660749|8.809658|6.935465|17.597769|5.506575|4.237814|2.878939|2.428206|2.168187|2.300897|2.738009|2.802113|2.387119|2.083185|2.059616|0.078740|0.069941|0.063011|0.057565|0.055199|0.064076|0.081162|0.208906|0.169621|0.141744|0.302119|0.300654|0.500000| |2.350505|2.664093|2.473357|2.637342|3.161457|3.638781|3.230067|4.636279|0.083639|4.088343|6.801756|5.103507|4.650512|6.138099|0.228858|6.051452|6.010915|5.572247|6.620244|9.423482|8.757831|6.958703|5.487687|17.563581|6.066079|3.431363|2.839421|2.762451|3.237440|4.220862|4.981875|3.994153|3.141292|2.924293|0.067609|0.062744|0.058590|0.060742|0.066544|0.089820|0.135100|0.141162|0.174835|0.207823|0.140133|0.141118|0.122884|0.500000| |2.475093|2.763900|2.556123|2.667937|3.093452|3.520612|3.264816|4.665253|0.086029|3.886990|6.512330|4.369647|4.103211|4.478933|0.144180|4.573644|4.832538|4.726876|5.770739|7.599528|8.935710|7.149060|6.915615|17.580486|4.620373|2.840277|2.375602|2.279194|2.545511|3.123197|3.436290|2.923274|2.440525|2.321061|0.073132|0.064692|0.061882|0.063282|0.067297|0.085449|0.112373|0.144777|0.220723|0.174483|0.167720|0.208706|0.141908|0.302685|0.500000| |2.986122|3.471606|3.110722|3.267912|4.003601|4.967455|4.438668|6.477273|0.112215|5.786667|8.931082|7.243878|6.433819|6.865466|0.223833|6.211542|5.954590|5.373051|6.289474|9.190425|8.715828|5.520323|6.916436|17.631894|6.227234|3.706792|2.916393|2.749146|3.048785|3.890001|4.059233|3.241709|2.712491|2.660493|0.087151|0.078262|0.072505|0.074439|0.079532|0.108286|0.166263|0.122677|0.144289|0.140862|0.204547|0.173724|0.140534|0.299591|0.303631|0.500000| |3.084808|3.555062|3.152972|3.264993|3.940207|4.906123|4.524017|6.686601|0.117014|5.906195|9.160839|6.937216|6.101631|6.585911|0.143854|4.896231|6.455510|4.892643|4.417932|5.016793|3.094432|2.556136|2.879694|3.195665|12.415029|17.517705|8.928710|6.758833|5.528971|6.017266|4.286205|3.420532|3.320856|3.961417|0.080431|0.091172|0.074632|0.075591|0.079240|0.104984|0.154574|0.067108|0.064363|0.071160|0.089036|0.070742|0.075008|0.089332|0.076211|0.100445|0.500000| |2.883099|3.146180|2.719997|2.724533|3.181095|3.981743|3.945191|6.479644|0.119133|6.460275|12.010974|6.647618|4.936618|7.379133|0.146384|6.700938|10.102250|6.910612|5.781490|6.343496|3.584596|2.924004|3.328288|3.431732|12.425691|17.629784|8.903167|5.573146|5.025117|5.894872|4.400171|3.433931|3.229747|3.714733|0.078225|0.085795|0.069391|0.066442|0.066652|0.084087|0.122586|0.078447|0.071491|0.080677|0.102492|0.078778|0.089150|0.094415|0.080253|0.104517|0.301706|0.500000| |2.361560|2.550017|2.325586|2.365906|2.673324|3.055699|2.961120|4.377764|0.083381|3.675055|6.490610|3.877105|3.487069|4.155018|0.097963|3.739908|5.643201|4.513426|3.873898|4.048236|2.479687|2.170151|2.317648|2.451326|7.639281|8.944200|17.547610|8.771751|5.566877|4.947685|3.663590|3.169549|3.304179|4.173810|0.062363|0.070808|0.059117|0.058341|0.059850|0.072764|0.093734|0.058684|0.054565|0.061228|0.069046|0.057496|0.062800|0.069463|0.059957|0.072813|0.223422|0.210368|0.500000| |2.146717|2.313949|2.110453|2.161391|2.467555|2.835634|2.714919|4.084491|0.077574|3.598083|6.587037|3.916505|3.375420|4.733456|0.111006|4.561204|7.532690|5.757963|4.681456|4.780752|2.797707|2.478997|2.523078|2.701773|9.113281|8.878856|17.562915|8.866686|7.091449|6.463595|4.667807|3.946230|4.053976|5.125784|0.058040|0.063135|0.053726|0.052966|0.054870|0.068044|0.092514|0.067354|0.061017|0.071249|0.073421|0.061767|0.068915|0.078045|0.065062|0.078085|0.175013|0.220673|0.301835|0.500000| |2.244231|2.541590|2.426729|2.611798|3.056659|3.329038|2.962377|4.066762|0.074621|3.330355|5.469475|3.925735|3.910083|4.278787|0.109553|3.465677|4.760500|3.845854|3.480723|3.804502|2.424632|2.138175|2.198728|2.544038|8.382795|7.011474|8.863366|17.486265|8.847950|6.362268|4.460926|3.962503|4.378316|6.145813|0.058723|0.064930|0.056914|0.060310|0.067151|0.087875|0.115334|0.056246|0.054508|0.061582|0.064802|0.055655|0.057928|0.074627|0.062483|0.076054|0.202363|0.141364|0.211548|0.173768|0.500000| |1.924278|2.112271|2.007838|2.117804|2.408819|2.614997|2.411159|3.395679|0.064004|2.801526|4.828284|3.162410|3.021406|3.597566|0.092585|3.188728|4.649143|3.849200|3.396534|3.567481|2.245050|2.036590|2.029430|2.284840|6.732411|5.535632|8.789946|17.561510|8.909740|5.640530|4.225628|4.006387|4.754901|7.229135|0.051107|0.055881|0.049192|0.050793|0.055043|0.068677|0.087603|0.054444|0.051605|0.059226|0.058732|0.051328|0.054505|0.067317|0.056479|0.066309|0.140001|0.123994|0.210476|0.211193|0.302868|0.500000| |2.083693|2.346045|2.194756|2.356312|2.828419|3.215454|2.829078|4.080722|0.074048|3.684275|6.286881|4.775875|4.245794|7.408199|0.263962|6.809652|7.751879|6.351117|6.327815|7.770588|4.763352|4.286642|3.528561|5.206393|9.532848|4.616667|4.003785|4.091938|5.624884|8.843494|17.772436|9.022166|5.675480|4.990864|0.058076|0.057556|0.052250|0.054250|0.060112|0.082120|0.130662|0.103868|0.101973|0.139281|0.095654|0.087178|0.089368|0.186776|0.116014|0.136276|0.110389|0.117908|0.091005|0.113099|0.103672|0.096981|0.500000| |1.676456|1.861022|1.791998|1.935517|2.248503|2.409709|2.144452|3.000053|0.055858|2.538297|4.373278|3.051416|2.927077|3.909618|0.124128|3.724234|4.835918|4.355435|4.266281|4.657668|3.108286|3.092145|2.500621|3.334088|5.668038|3.255279|3.189501|3.556789|4.949211|5.625598|8.959748|17.705693|8.926518|5.673934|0.046384|0.046352|0.042987|0.045246|0.050850|0.066585|0.090951|0.078210|0.077859|0.100970|0.067244|0.064589|0.065359|0.112506|0.082500|0.087303|0.081180|0.082539|0.075105|0.091336|0.090159|0.091066|0.219930|0.500000| |1.541304|1.700502|1.655298|1.787341|2.041794|2.143419|1.923277|2.659837|0.050005|2.194266|3.779264|2.565427|2.514509|3.096474|0.091383|2.878269|3.941147|3.518347|3.311740|3.500903|2.317279|2.257018|1.979194|2.435987|4.906280|3.084020|3.323768|4.082307|5.615528|4.898337|5.630454|8.898119|17.724542|8.881838|0.042029|0.043106|0.039887|0.042186|0.047502|0.060569|0.077424|0.058995|0.057775|0.069830|0.054514|0.051323|0.052567|0.076955|0.061412|0.066547|0.078193|0.076174|0.079409|0.094502|0.102089|0.112934|0.124688|0.213760|0.500000| 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