Version2.0 2019-11-15T14:15:29Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 13-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1cc(ccc1c2ccc(nn2)N3CCC(CC3)C(=O)N4CCC(CC4)(C(=O)N)[NH+]5CCCCC5)F C40919373 RHF 6-31G(d) (6D,7F) c1cc(ccc1c2ccc(nn2)N3CCC(CC3)C(=O)N4CCC(CC4)(C(=O)N)[NH+]5CCCCC5)F C01[X(C27H36F1N6O2)] 210 C1 612 Fc1ccc(cc1)c1ccc(nn1)N1CCC(CC1)C(=O)N1CCC(CC1)(C(=O)N)[NH+]1CCCCC1 Fc1ccc(cc1)c1ccc(nn1)N1CCC(CC1)C(=O)N1CCC(CC1)(C(=O)N)[NH+]1CCCCC1 NC(=O)C1(CCN(CC1)C(=O)C2CCN(CC2)c3ccc(nn3)c4ccc(F)cc4)[NH+]5CCCCC5 InChIKey=AWJYZRLWEFZLQW-UHFFFAOYSA-O InChI=1S/C27H35FN6O2/c28-22-6-4-20(5-7-22)23-8-9-24(31-30-23)32-16-10-21(11-17-32)25(35)33-18-12-27(13-19-33,26(29)36)34-14-2-1-3-15-34/h4-9,21H,1-3,10-19H2,(H2,29,36)/p+1 InChI=1/C27H35FN6O2/c28-22-6-4-20(5-7-22)23-8-9-24(31-30-23)32-16-10-21(11-17-32)25(35)33-18-12-27(13-19-33,26(29)36)34-14-2-1-3-15-34/h4-9,21H,1-3,10-19H2,(H2,29,36)/p+1/fC27H36FN6O2/h34H,29H2/q+1 c1cc(ccc1c2ccc(nn2)N3CCC(CC3)C(=O)N4CCC(CC4)(C(=O)N)[NH+]5CCCCC5)F C01[X(C27H36F1N6O2)] 210 C01 612 Fc1ccc(cc1)c1ccc(nn1)N1CCC(CC1)C(=O)N1CCC(CC1)(C(=O)N)[NH+]1CCCCC1 Fc1ccc(cc1)[C@H]1NN[C@@H](C=C1)N1CC[C@H](CC1)C(=O)N1CC[C@](CC1)(C(=O)N)[NH]1CCCCC1 NC(=O)[C@@]1(CCN(CC1)C(=O)[C@@H]2CCN(CC2)[C@H]3NN[C@@H](C=C3)c4ccc(F)cc4)[NH]5CCCCC5 InChIKey=JUJLLVGHOLKTRS-BJKOFHAPSA-N InChI=1S/C27H40FN6O2/c28-22-6-4-20(5-7-22)23-8-9-24(31-30-23)32-16-10-21(11-17-32)25(35)33-18-12-27(13-19-33,26(29)36)34-14-2-1-3-15-34/h4-9,21,23-24,30-31,34H,1-3,10-19H2,(H2,29,36)/t23-,24+/m0/s1 InChI=1/C27H40FN6O2/c28-22-6-4-20(5-7-22)23-8-9-24(31-30-23)32-16-10-21(11-17-32)25(35)33-18-12-27(13-19-33,26(29)36)34-14-2-1-3-15-34/h4-9,21,23-24,30-31,34H,1-3,10-19H2,(H2,29,36)/t23-,24+/m0/s1/f/h29H2 3692.8754953776 -1619.0593786 1-A 38413.3133 132 480 612 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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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 11.0567 14.7844 21.0131 30.1329 35.8958 52.3330 58.0155 59.6349 72.5220 80.9907 91.8316 103.9821 108.6880 126.8405 156.1077 161.2012 175.1338 184.5572 218.8388 235.5659 247.1071 248.3435 271.3215 280.0643 300.2287 317.0720 322.5591 333.1777 351.5541 369.0055 369.6367 388.4177 403.9213 418.7262 425.6468 433.1596 450.8584 465.0341 469.7178 476.6563 483.2991 487.3389 501.9655 512.8533 520.4054 527.5192 533.4161 539.5927 576.3356 597.6141 604.9525 632.2147 639.1738 663.5376 690.5119 695.4079 709.0218 718.8210 759.3061 764.0569 791.4584 794.1601 838.6053 841.2623 869.0805 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1705.5027 1754.4430 1790.5515 1805.6026 1820.5411 1824.0227 1949.1966 1959.3910 3139.6840 3164.6046 3187.1072 3197.7575 3200.2888 3205.3550 3206.5264 3214.4190 3216.9559 3223.1450 3225.4317 3239.2847 3253.6041 3272.1533 3273.9641 3275.5252 3285.1525 3297.6025 3301.9891 3304.9136 3321.3927 3322.6247 3335.4718 3366.6530 3368.0773 3369.0942 3375.4793 3397.4184 3398.2162 3400.4643 3404.4433 3415.9160 3417.3472 3694.1199 3827.2176 3976.4434 4.8726 5.5219 5.0769 5.1990 6.7013 4.3392 4.7184 4.9727 4.1161 4.7911 4.9258 3.6564 6.5788 4.7665 4.4156 4.5602 5.0128 4.2119 3.8489 2.5146 3.3908 4.4153 2.4422 3.1130 3.6280 3.5802 3.9873 2.4237 3.2152 2.0828 2.3996 2.0341 5.1394 3.0206 2.1080 2.1719 2.9786 3.0378 4.4057 3.0329 2.8492 3.1784 4.0160 3.6175 2.6741 2.8749 4.1658 2.2537 3.1658 2.9111 2.6952 1.7076 3.7306 3.2339 2.8711 5.3364 6.0524 2.4357 3.8074 2.8874 5.2585 3.9503 3.1423 5.1352 1.9929 4.3011 3.2013 2.4809 1.5154 2.0093 6.4208 2.6555 2.5313 1.2609 1.5688 1.7045 1.7105 2.4034 2.4168 3.1587 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1.7323 2.4695 1.7922 2.3597 1.7535 1.8270 1.7614 1.8080 1.8030 1.8089 1.7900 5.1162 13.5783 13.6306 2.4093 11.1902 12.5331 26.3230 19.7183 6.2475 6.3432 6.4422 6.4799 6.4720 6.4451 6.4998 6.5945 6.5104 6.5277 6.5536 6.5954 6.8668 6.9151 6.9198 6.9249 7.0005 7.0250 6.8452 7.0381 7.0931 7.1165 6.9706 7.2898 7.2859 7.4080 7.3198 7.4225 7.4165 7.5735 7.4826 7.5499 7.5374 8.6623 9.0783 10.2582 1.5866 0.3748 0.7206 2.8259 2.3820 1.0841 8.1997 1.5896 0.0367 3.5360 0.0799 3.2143 1.0527 3.5087 2.2102 5.6425 5.1055 0.9151 2.8204 2.7673 1.1444 2.2760 6.0579 3.6872 3.0412 10.8862 0.5622 6.9102 21.7386 8.0230 75.8892 79.1760 9.8644 0.9654 25.6165 29.0130 3.8421 0.0858 3.3109 0.4627 10.4904 12.2136 3.9745 2.0539 6.4282 17.0679 3.9500 0.5756 11.2560 9.0540 13.2858 51.2742 15.3350 6.5854 10.4150 3.7193 2.3950 9.6752 4.8232 14.3734 10.9935 0.0493 2.1438 5.1759 13.4769 8.1941 33.6569 10.5485 0.3447 2.9165 13.1985 14.5118 15.8313 5.4693 91.9518 4.6096 7.6296 2.4882 13.3671 46.7516 16.7268 13.6634 13.4121 3.3043 11.1865 0.4754 19.8070 2.1840 19.0486 0.6199 42.4911 3.7037 32.0800 1.7117 22.6906 27.4098 0.0588 12.8804 40.9103 1.4076 3.2763 3.3450 0.2449 8.4953 54.0254 13.4694 21.2897 102.8457 13.7438 5.0963 9.0762 24.6548 21.1860 1.4585 16.5653 10.5289 198.8173 77.2219 109.2600 4.2065 38.5949 94.7070 25.3027 34.9862 6.9607 24.6850 26.6141 14.9111 2.7692 80.7684 9.2506 22.5320 14.9345 0.2131 40.8890 31.5168 7.0892 25.9417 15.4363 8.2755 39.7285 22.4353 6.4780 25.6580 34.3631 16.4364 19.7012 57.8466 150.4227 55.0416 199.3112 29.3525 0.6734 1.0839 5.7444 9.6098 390.7282 13.0181 200.8551 10.3277 22.9521 22.6044 13.4181 5.0484 1.2072 20.1535 24.1942 10.6906 10.6606 138.5540 118.2947 16.9326 324.5470 321.5270 44.1800 37.5356 17.4200 60.0164 12.1055 76.7776 16.0971 19.2380 6.5907 26.1609 41.3599 29.7953 50.1043 36.6391 5.9227 8.4575 19.2851 20.2223 13.7330 30.4587 12.7732 4.7365 2.9753 4.8560 8.7303 7.5087 14.7112 2.8340 8.8809 3.9142 7.3138 6.6702 1.1838 22.8452 123.0176 84.1890 1.3308 0.6237 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12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 7209.1479 65683.6939 70048.0860 0.99995 0.00949 -0.00181 -0.00951 0.99989 -0.01152 0.00170 0.01154 0.99993 1 0.01201 0.00132 0.00124 0.25034 0.02748 0.02576 15.91 21.27 30.23 43.35 51.65 75.30 83.47 85.80 104.34 116.53 132.13 149.61 156.38 182.50 224.60 231.93 251.98 265.54 314.86 338.93 355.53 357.31 390.37 402.95 431.96 456.20 464.09 479.37 505.81 530.92 531.82 558.85 581.15 602.45 612.41 623.22 648.68 669.08 675.82 685.80 695.36 701.17 722.22 737.88 748.75 758.98 767.47 776.35 829.22 859.83 870.39 909.62 919.63 954.68 993.49 1000.54 1020.12 1034.22 1092.47 1099.31 1138.73 1142.62 1206.57 1210.39 1250.41 1256.58 1257.41 1282.13 1290.94 1299.65 1306.56 1326.29 1327.63 1340.20 1362.09 1374.29 1394.85 1403.84 1436.27 1449.09 1463.01 1475.49 1487.31 1500.25 1527.59 1547.90 1569.52 1576.33 1581.35 1588.14 1600.98 1604.73 1611.12 1619.49 1631.29 1632.50 1640.82 1658.12 1663.38 1681.75 1687.61 1714.59 1736.65 1738.58 1768.78 1770.96 1786.99 1802.61 1835.90 1841.50 1848.82 1850.85 1864.96 1874.38 1895.39 1922.85 1929.27 1934.56 1985.73 1997.56 2006.15 2010.45 2013.51 2034.85 2037.48 2052.23 2053.70 2067.87 2074.99 2086.39 2098.84 2120.15 2136.60 2147.78 2163.38 2166.48 2179.71 2185.40 2190.05 2195.08 2196.70 2204.00 2218.00 2222.28 2223.75 2237.28 2254.67 2258.18 2264.03 2264.09 2299.21 2321.97 2338.80 2344.19 2347.22 2352.09 2360.84 2363.14 2364.46 2366.88 2370.98 2377.72 2382.11 2393.65 2396.27 2399.07 2453.84 2524.25 2576.20 2597.86 2619.35 2624.36 2804.46 2819.13 4517.30 4553.16 4585.54 4600.86 4604.50 4611.79 4613.48 4624.83 4628.48 4637.39 4640.68 4660.61 4681.21 4707.90 4710.50 4712.75 4726.60 4744.51 4750.83 4755.03 4778.74 4780.52 4799.00 4843.86 4845.91 4847.38 4856.56 4888.13 4889.28 4892.51 4898.23 4914.74 4916.80 5315.01 5506.51 5721.22 0.667188 0.697174 0.698118 0.602199 -1618.392191 -1618.362205 -1618.361261 -1618.457180 3.217139D-04 MUNgauss RevisionA1.9 retrievium 15-Nov-2019 DUDE c1cc(ccc1c2ccc(nn2)N3CCC(CC3)C(=O)N4CCC(CC4)(C(=O)N)[NH+]5CCCCC5)F C40919373 RHF 6-31G(d) (6D,10F) C1 495.288340 |X|Y|Z| 184.572350 58.025663 31.287436 69.457462 31 6 7 26 5 |36.858105| |13.757967|36.858105| |8.025241|13.839498|36.858105| |6.879084|7.904352|13.808745|36.858105| |7.958983|6.868118|8.017113|13.791953|36.858105| |13.696946|7.879028|6.894662|7.887950|13.666769|36.858105| |7.583678|5.030266|4.481427|5.050080|7.632120|12.802911|36.858105| |6.288987|4.334497|3.696255|3.872866|5.080276|7.495480|13.478936|36.858105| |4.370244|3.322117|2.950303|3.120111|3.936822|5.068107|8.017640|14.062554|36.858105| |3.759223|2.971938|2.754010|3.015095|3.843241|4.582523|7.130066|8.063661|13.501256|36.858105| |4.003977|3.177810|3.033211|3.460282|4.608276|5.259384|8.333483|7.029693|8.055081|14.627497|53.358707| |5.271171|3.996136|3.828501|4.533405|6.709546|7.989788|14.613144|8.073033|7.009758|8.347196|19.683636|53.358707| |2.953652|2.442070|2.291840|2.481578|3.021644|3.429482|4.678918|5.215153|7.801439|13.592726|11.172376|7.309950|53.358707| |2.617903|2.222857|2.133956|2.338714|2.809971|3.049483|3.938546|3.996735|5.118990|7.884232|9.748734|6.540814|17.839731|36.858105| |2.202081|1.910574|1.832594|1.973728|2.298594|2.475260|3.042136|3.161927|3.934619|5.124968|6.233445|4.750204|10.616100|12.483418|36.858105| |2.037515|1.781188|1.708579|1.829655|2.109469|2.265400|2.745911|2.929119|3.649309|4.445497|5.232623|4.139502|8.927684|7.532473|12.375991|36.858105| |2.207870|1.905888|1.801866|1.912117|2.216332|2.436232|3.004489|3.375415|4.421184|5.106665|5.498060|4.369560|10.552334|6.555959|7.624892|12.442467|36.858105| |2.627546|2.215711|2.087313|2.241157|2.668162|2.980155|3.862329|4.443625|6.320113|7.847810|7.541000|5.666889|17.754402|7.858832|6.603351|7.588624|12.493568|36.858105| |1.776340|1.576480|1.513167|1.603022|1.813602|1.935994|2.278488|2.424913|2.914004|3.346163|4.051720|3.363488|6.041108|4.916418|7.562170|12.512482|7.574540|4.932024|36.858105| |1.725514|1.533951|1.461159|1.531721|1.721739|1.853766|2.167193|2.345630|2.812361|3.104504|3.701834|3.131350|5.446351|4.124539|5.769228|8.011822|6.908557|4.482602|15.905901|73.516695| |1.623225|1.457466|1.412882|1.501430|1.683613|1.768971|2.045015|2.127443|2.481828|2.847582|3.595341|3.040572|4.879407|4.152395|5.968030|7.618491|5.038849|3.814200|13.777611|15.157495|53.358707| |1.459259|1.322739|1.282059|1.351642|1.497623|1.570116|1.785442|1.859899|2.131552|2.373794|3.014538|2.614711|3.908985|3.192012|4.221833|4.983452|3.878792|3.043554|7.855103|12.671816|17.952420|36.858105| |1.380383|1.259887|1.226902|1.293553|1.424336|1.482249|1.667389|1.712302|1.930829|2.151853|2.794033|2.452345|3.455951|2.876267|3.689418|3.915273|3.113085|2.586664|5.268395|8.595479|10.566083|12.409951|36.858105| |1.367376|1.252834|1.230781|1.307406|1.438344|1.479330|1.656218|1.674651|1.870494|2.109286|2.799138|2.463358|3.345172|2.854301|3.542767|3.654186|2.868870|2.476487|4.446744|6.849101|8.831259|7.385729|12.341179|36.858105| |1.513502|1.376820|1.355762|1.453511|1.615966|1.658862|1.879357|1.886158|2.125398|2.461550|3.294238|2.844853|3.974558|3.557755|4.522823|4.543993|3.339721|2.907386|5.197461|7.345598|10.604693|6.557011|7.602495|12.362455|36.858105| |1.605703|1.448781|1.419915|1.523794|1.708338|1.767538|2.030951|2.068242|2.376257|2.770716|3.617085|3.066971|4.632998|4.113128|5.465493|6.354115|4.288902|3.555090|7.533456|9.438693|17.939889|7.895784|6.593182|7.466963|12.438538|36.858105| |1.272536|1.173403|1.158165|1.230524|1.345477|1.374253|1.524808|1.539407|1.703462|1.899791|2.531095|2.253953|2.962772|2.470396|2.930760|3.124048|2.548834|2.236426|3.668568|5.779017|6.792567|5.716662|7.223040|12.295429|7.582114|5.977807|36.858105| |1.249846|1.157202|1.149166|1.225813|1.336636|1.353791|1.493231|1.493164|1.638122|1.830991|2.472772|2.216426|2.817191|2.359570|2.716923|2.840372|2.343335|2.110364|3.169949|4.976113|5.575576|4.319583|5.117694|8.049506|6.589699|5.135902|15.890681|73.516695| |1.214772|1.122022|1.104172|1.167116|1.271873|1.303709|1.442667|1.469329|1.625375|1.787406|2.356209|2.109454|2.779087|2.257640|2.660699|2.922178|2.458943|2.135471|3.505071|5.738840|6.251385|5.747059|6.557682|7.651508|5.333841|4.963864|14.225415|15.195388|53.358707| |1.305921|1.203880|1.185739|1.256849|1.373544|1.406621|1.558798|1.562391|1.722634|1.931234|2.597556|2.316897|2.996731|2.550782|3.060825|2.991842|2.435525|2.164598|3.458301|5.541118|6.094567|4.909079|7.658706|12.317053|7.564418|4.901707|7.721418|11.790799|7.483370|53.358707| |1.349843|1.240948|1.217684|1.287881|1.410146|1.451530|1.613567|1.620236|1.791732|2.011334|2.697305|2.399028|3.132948|2.678391|3.261987|3.100555|2.520702|2.232363|3.601793|5.829225|6.199607|4.925243|7.727125|9.343047|6.921304|4.701210|5.764548|8.867937|6.162971|25.716199|0.500000| |1.188550|1.102615|1.085585|1.143765|1.239953|1.269282|1.393494|1.401837|1.533431|1.690164|2.265481|2.047118|2.586984|2.141437|2.510957|2.501332|2.114182|1.886601|2.894468|4.828756|4.875691|4.157021|6.141863|7.435467|4.900305|3.730079|6.597806|10.189095|7.496047|17.135905|0.259524|36.858105| |1.144952|1.067057|1.051513|1.104568|1.191137|1.217159|1.326379|1.328135|1.440231|1.578659|2.130309|1.943787|2.383167|1.962605|2.256044|2.193282|1.889913|1.714102|2.471703|4.182912|3.971802|3.252848|4.405011|4.895900|3.795969|2.997141|4.365238|7.315814|5.217313|10.362022|0.203159|12.496136|36.858105| |1.144677|1.070441|1.061063|1.119085|1.204133|1.221042|1.324039|1.312161|1.412786|1.555854|2.127863|1.951565|2.325237|1.930898|2.174552|2.080262|1.793327|1.656496|2.272350|3.789520|3.608549|2.816521|3.612917|4.264411|3.615458|2.822113|3.916440|7.099593|4.527713|8.764961|0.167907|7.555738|12.474883|36.858105| |1.248643|1.162540|1.154436|1.225182|1.326447|1.342565|1.464387|1.441865|1.557748|1.739691|2.398882|2.183203|2.612985|2.219293|2.508309|2.344887|1.981397|1.839001|2.523949|4.113234|4.046690|3.032741|3.878992|4.854267|4.422628|3.264701|4.175508|7.717889|4.570222|10.392955|0.204435|6.555603|7.619150|12.476044|36.858105| |1.304082|1.207412|1.198314|1.277334|1.392546|1.411344|1.553755|1.535540|1.675432|1.889197|2.591651|2.328254|2.883920|2.482286|2.866942|2.729071|2.242202|2.054305|2.976371|4.721088|5.009479|3.724958|4.913651|7.264067|6.491160|4.274858|5.982687|11.320343|5.883967|17.056209|0.260256|7.707846|6.509273|7.519472|12.489875|36.858105| |5.315813|8.176450|14.357487|8.168782|5.314937|4.657887|3.415390|2.952067|2.452093|2.310971|3.419087|4.133756|2.690487|1.862194|1.627929|1.527786|1.601405|1.823909|1.369347|2.357761|1.752820|1.177926|1.132462|1.137627|1.244427|1.295968|1.075708|1.901840|1.399061|1.498463|0.031344|1.013810|0.985518|0.996185|1.078794|1.114752|97.533100| |17.726691|8.994771|5.702276|4.956368|5.644154|8.878062|6.967271|6.899565|4.727831|3.849127|5.296750|6.579390|4.138110|2.638282|2.242758|2.081188|2.287772|2.710236|1.821443|3.175966|2.245979|1.487195|1.401468|1.376242|1.516551|1.613994|1.276445|2.216673|1.664358|1.786172|0.037797|1.196524|1.152311|1.145779|1.246190|1.301101|9.646362|0.500000| |8.854946|17.745626|8.963868|5.644650|4.951961|5.607125|4.086805|3.760298|2.978257|2.646115|3.761617|4.538911|3.026111|2.025507|1.770732|1.660700|1.780310|2.039347|1.485820|2.588791|1.871487|1.257016|1.198955|1.187561|1.295548|1.360083|1.113787|1.949530|1.454910|1.556969|0.032773|1.053134|1.021791|1.022878|1.105395|1.144066|16.713871|0.215277|0.500000| |4.957502|5.647222|8.959426|17.743678|8.869315|5.610017|4.103336|3.253887|2.730250|2.698997|4.225598|5.320682|3.097080|2.184635|1.860715|1.730876|1.788851|2.074159|1.525044|2.582059|1.961693|1.301171|1.250866|1.272256|1.413184|1.473919|1.203397|2.141955|1.551542|1.669701|0.034800|1.118109|1.081318|1.100440|1.204539|1.253991|16.717661|0.107625|0.124639|0.500000| |5.661575|4.952934|5.685164|8.949539|17.761686|8.928121|7.096642|4.741520|3.899870|4.035668|6.954479|10.172600|4.340926|3.034289|2.441609|2.230525|2.311720|2.802449|1.899257|3.169274|2.412262|1.564735|1.488981|1.516095|1.719513|1.819259|1.419451|2.517750|1.816856|1.966023|0.041076|1.296491|1.241528|1.259957|1.396093|1.472915|9.619866|0.124120|0.107566|0.213672|0.500000| |6.839036|4.679515|3.793731|3.771248|4.664353|6.853072|8.782313|17.756114|9.003196|5.681031|6.855228|7.792153|5.700341|3.310799|2.746535|2.601099|3.013171|3.795376|2.209320|3.856235|2.649754|1.727082|1.591837|1.549654|1.723091|1.882296|1.433232|2.469520|1.875144|1.973902|0.041719|1.313063|1.247662|1.229799|1.340873|1.421421|6.860030|0.233569|0.115867|0.087453|0.115915|0.500000| |3.763860|2.966469|2.622834|2.711679|3.280113|4.090898|5.656220|8.973176|17.757033|8.781568|7.781994|6.841876|9.630941|4.631612|3.838302|3.717403|4.786673|6.591540|3.020136|5.318127|3.433734|2.184579|1.954748|1.865596|2.094780|2.363073|1.700299|2.883578|2.229276|2.325253|0.049395|1.529967|1.432823|1.393470|1.525169|1.642173|5.013262|0.116138|0.075932|0.066731|0.089532|0.214529|0.500000| |2.748847|2.329271|2.238576|2.460927|2.969405|3.219704|4.144199|4.029877|4.921722|7.426701|10.533929|7.138686|12.528070|17.658622|8.878251|5.502631|4.920153|5.694668|4.091576|6.322704|4.921795|2.887929|2.697656|2.697328|3.317045|3.611988|2.322731|3.976713|2.871865|3.386081|0.073342|2.092127|1.950710|1.938494|2.243068|2.459397|4.378816|0.076597|0.058733|0.063701|0.089085|0.092151|0.119952|0.500000| |2.542341|2.182297|2.131581|2.373963|2.856440|3.007743|3.814384|3.734306|4.559666|6.769865|9.441268|6.492530|12.280839|17.464707|8.822409|6.745882|5.698830|6.982098|4.505235|6.591203|5.458928|3.079478|2.788451|2.857031|3.637995|4.248587|2.525076|4.359106|3.117583|3.452902|0.072648|2.123753|1.935430|1.924591|2.222713|2.515300|4.195293|0.069865|0.054922|0.062319|0.087826|0.086436|0.113106|0.303936|0.500000| |2.197082|1.903993|1.806957|1.921518|2.222994|2.427381|2.967421|3.139183|3.910028|4.851018|5.760327|4.519259|9.560245|8.878557|17.548873|8.853448|6.898375|5.795674|7.016153|10.763124|7.364193|4.108494|3.644198|3.354661|4.042737|4.615139|2.745379|4.479219|3.437209|4.047893|0.090080|2.477111|2.257127|2.151499|2.455037|2.740892|3.617623|0.062984|0.049373|0.050049|0.064558|0.076596|0.108532|0.216420|0.173607|0.500000| |2.043571|1.797338|1.743224|1.884974|2.173365|2.294907|2.751103|2.778546|3.311280|4.210354|5.495062|4.334824|7.691022|8.910998|17.523164|8.721353|5.507760|4.924772|6.818563|9.061059|8.725741|4.466823|4.109823|4.122893|5.659997|6.448771|3.291601|5.453702|3.930752|4.854210|0.106266|2.816179|2.514384|2.446161|2.899247|3.380758|3.510117|0.057262|0.046324|0.049859|0.064569|0.067705|0.088602|0.214650|0.216103|0.302325|0.500000| |1.993155|1.753076|1.699720|1.836871|2.117014|2.236999|2.689309|2.813904|3.426909|4.199362|5.143879|4.097843|7.911663|6.871075|8.856035|17.537697|8.938400|6.943405|8.875584|10.717741|9.645979|4.684225|3.740448|3.684472|4.742713|7.075647|3.262016|5.370574|4.117832|4.048332|0.083500|2.479026|2.156352|2.069635|2.342562|2.769142|3.425981|0.055897|0.045222|0.048622|0.062926|0.069374|0.094928|0.140552|0.201336|0.174054|0.212014|0.500000| |2.202106|1.898532|1.775912|1.862016|2.145012|2.388181|2.929477|3.353927|4.402691|4.828924|5.142376|4.174360|9.490457|5.749222|6.872027|8.861216|17.609873|8.878844|7.018196|13.284495|6.351277|3.779070|3.068956|2.749547|3.108221|3.817188|2.414264|3.918105|3.192184|3.232765|0.069241|2.082577|1.879840|1.769722|1.941294|2.165281|3.557154|0.064294|0.049635|0.048156|0.061297|0.084371|0.138056|0.129121|0.132007|0.203992|0.140044|0.174809|0.500000| |2.050588|1.789886|1.697794|1.794576|2.056563|2.241170|2.702552|3.035281|3.830836|4.192185|4.674270|3.859941|7.651760|4.905846|5.521343|8.809859|17.560341|8.879136|6.858723|11.791912|6.518904|3.842235|3.012863|2.767436|3.144242|4.091653|2.527946|4.120794|3.391889|3.165640|0.065963|2.050019|1.820464|1.719640|1.877558|2.130907|3.419970|0.058922|0.046687|0.046870|0.059430|0.077080|0.116708|0.108101|0.127730|0.140595|0.122934|0.215939|0.303106|0.500000| |2.552265|2.175510|2.082960|2.267403|2.701251|2.938718|3.743734|4.117162|5.411772|6.761311|7.328715|5.601819|12.304633|7.024809|5.756216|6.808190|8.815661|17.430548|4.523504|7.076066|5.024669|2.940175|2.510449|2.462315|2.924624|3.618299|2.265897|3.846752|2.936656|2.912919|0.060502|1.863392|1.685247|1.640740|1.825330|2.055121|4.104701|0.071705|0.055306|0.058854|0.080297|0.098107|0.147834|0.143577|0.206657|0.133100|0.128608|0.204642|0.173521|0.215090|0.500000| |2.765701|2.313872|2.148307|2.276219|2.700581|3.082219|3.991823|4.920220|7.253565|7.351636|6.879224|5.509079|12.422535|5.683347|4.937930|5.536496|8.922264|17.636479|4.104781|7.040051|4.419368|2.704653|2.316705|2.201558|2.515655|3.004263|2.012516|3.381155|2.649248|2.650593|0.055751|1.725206|1.579427|1.523886|1.673297|1.847680|4.213860|0.080551|0.059448|0.058002|0.077268|0.119768|0.239304|0.127662|0.142848|0.129730|0.108315|0.141986|0.216933|0.214820|0.303133|0.500000| |1.393525|1.268560|1.233044|1.299858|1.434613|1.497384|1.692258|1.762839|2.006292|2.212916|2.818035|2.465387|3.590899|2.878130|3.631415|4.403650|3.584177|2.858259|6.336077|10.478388|12.466121|17.511181|8.742689|6.510687|5.663690|7.029113|6.056190|8.026639|9.340278|5.961576|0.116236|3.904029|3.033037|2.646160|2.795531|3.434250|2.556927|0.039362|0.033522|0.034862|0.041656|0.045712|0.057207|0.072075|0.078780|0.096350|0.105016|0.121031|0.095163|0.102717|0.078268|0.071393|0.500000| |1.461568|1.322923|1.274185|1.334778|1.477060|1.560929|1.775810|1.870646|2.151653|2.360531|2.956434|2.573550|3.885065|3.081353|4.058133|4.773068|3.942624|3.034555|7.699324|15.293906|12.580051|17.705706|8.898873|5.463087|4.943233|5.722548|4.422625|6.240115|6.252584|5.633612|0.119745|3.682574|3.011811|2.587744|2.738763|3.215721|2.634162|0.041658|0.035055|0.035552|0.042568|0.048534|0.062056|0.077837|0.080666|0.115097|0.114266|0.118554|0.111525|0.108833|0.079552|0.076154|0.303667|0.500000| |1.287317|1.181208|1.150109|1.206986|1.320341|1.372759|1.531240|1.575389|1.761631|1.934166|2.512110|2.231905|3.055955|2.486010|3.081267|3.279262|2.733348|2.298925|4.274008|7.397430|7.677067|8.867605|17.582770|8.680683|5.494236|4.928432|6.671894|8.465016|9.468990|9.202522|0.183866|6.650900|4.669736|3.625513|3.658006|4.414890|2.399610|0.036352|0.031355|0.032467|0.038177|0.041005|0.049760|0.065281|0.067033|0.085665|0.092862|0.087400|0.075666|0.074678|0.062029|0.058179|0.213928|0.214028|0.500000| |1.426654|1.299034|1.261067|1.327174|1.463549|1.529647|1.724811|1.770776|2.000211|2.234996|2.900977|2.540885|3.596813|3.018144|3.937900|3.954674|3.148681|2.627532|5.230666|8.705834|9.540614|8.980151|17.533507|8.884739|6.827295|5.761235|5.406285|7.539192|6.564320|10.040173|0.249217|5.747924|4.508698|3.695389|4.045938|4.868547|2.614620|0.040344|0.034354|0.035551|0.042393|0.045633|0.056180|0.079950|0.079516|0.112069|0.123190|0.101344|0.088173|0.082507|0.069671|0.065333|0.174256|0.222312|0.303857|0.500000| |1.484970|1.357659|1.347020|1.451832|1.609406|1.634161|1.837301|1.822170|2.029231|2.352040|3.207389|2.795630|3.716378|3.324479|3.966107|3.938712|3.000052|2.708385|4.201336|6.091371|7.701400|4.914531|5.524603|8.803386|17.643952|8.898501|7.286261|13.483901|6.769961|9.120814|0.161090|4.559408|3.625444|3.641975|4.562424|6.978187|2.788839|0.041049|0.035413|0.039453|0.047867|0.046233|0.055045|0.087044|0.097561|0.097307|0.135942|0.118654|0.076802|0.079113|0.077244|0.065455|0.127218|0.108576|0.122927|0.139609|0.500000| |1.587007|1.438471|1.413096|1.515127|1.690527|1.741923|1.982570|1.982008|2.238867|2.620205|3.524056|3.023249|4.250229|3.919688|5.121984|4.678985|3.413275|2.999495|5.189665|7.394275|9.637948|5.786263|6.820101|8.845587|17.537993|8.938663|5.543969|8.897830|5.769125|9.833297|0.212642|4.628546|3.816791|3.679535|4.685866|6.454864|2.909623|0.044231|0.037554|0.040797|0.049931|0.050028|0.060952|0.104118|0.108462|0.129402|0.191519|0.129344|0.089821|0.086550|0.082233|0.071739|0.132040|0.130724|0.139011|0.200478|0.300428|0.500000| |1.739949|1.560079|1.532647|1.658826|1.878464|1.939635|2.254388|2.278050|2.636872|3.163384|4.167312|3.462947|5.379048|5.030493|6.605718|7.467646|4.753235|4.083024|7.109338|8.763192|12.407686|5.691300|4.924990|5.506525|8.977907|17.712807|4.645055|7.659834|5.358363|5.605607|0.112137|3.194828|2.676674|2.590287|3.036435|3.852935|3.127915|0.048352|0.040411|0.044528|0.056080|0.056874|0.071812|0.118879|0.151369|0.141762|0.224265|0.260415|0.112883|0.122018|0.118299|0.092844|0.143751|0.127843|0.108283|0.128650|0.217787|0.219585|0.500000| |1.521258|1.380441|1.357343|1.455548|1.622280|1.669517|1.900988|1.937818|2.205364|2.528046|3.305611|2.844543|4.131728|3.519276|4.352332|5.257834|3.875932|3.264587|6.085930|8.274651|12.396358|7.073912|5.794789|6.707030|8.804109|17.490067|6.540275|10.062702|7.729872|6.035545|0.113341|3.568068|2.837369|2.673791|3.011426|3.925202|2.799289|0.042387|0.036064|0.039260|0.047977|0.049370|0.061161|0.086126|0.103025|0.104259|0.134080|0.170324|0.095133|0.107894|0.094531|0.078171|0.208757|0.144091|0.129630|0.133308|0.215333|0.174144|0.304267|0.500000| |1.225176|1.129080|1.106056|1.164919|1.270714|1.310418|1.454282|1.492922|1.659787|1.815289|2.368001|2.115588|2.840355|2.282783|2.725381|3.043071|2.579935|2.199359|3.790605|6.374577|6.746204|6.903595|7.465041|7.039407|4.971424|4.899251|9.210896|10.807897|26.147832|6.867730|0.122112|5.106378|3.653240|3.088047|3.097562|3.850419|2.314251|0.034406|0.029934|0.031496|0.036902|0.038971|0.046813|0.058994|0.063522|0.072773|0.080926|0.085840|0.069043|0.073122|0.061093|0.055894|0.247231|0.154473|0.239815|0.146345|0.122390|0.113590|0.107046|0.151759|0.500000| |1.164253|1.079457|1.065183|1.125858|1.222375|1.248052|1.373585|1.396377|1.535188|1.678943|2.221158|2.002355|2.583231|2.079271|2.397100|2.635175|2.263349|1.994021|3.067088|5.061673|5.227690|4.543118|4.883695|5.617698|4.385475|4.201179|9.517068|13.842829|25.976445|6.071953|0.103934|4.603297|3.403199|3.041849|3.029499|3.788256|2.237493|0.032487|0.028588|0.030630|0.035642|0.036486|0.042933|0.054053|0.059069|0.063010|0.071558|0.076664|0.059734|0.064296|0.056433|0.050848|0.150944|0.105629|0.143496|0.106944|0.119613|0.099309|0.096768|0.136658|0.310935|0.500000| |1.148082|1.068187|1.055327|1.113649|1.204452|1.227218|1.342432|1.347368|1.468176|1.615308|2.172666|1.970826|2.458585|2.026200|2.340313|2.362947|2.010338|1.807203|2.696741|4.475545|4.526318|3.806505|5.202650|6.682405|4.591303|3.576075|7.378587|12.280573|8.371353|12.395606|0.182460|17.641860|8.804417|6.848183|5.852872|7.166104|2.222178|0.032014|0.028331|0.030336|0.035051|0.035107|0.040633|0.054730|0.056510|0.063297|0.072472|0.066173|0.054489|0.054662|0.050085|0.046005|0.103914|0.092681|0.155670|0.128798|0.125244|0.115255|0.085520|0.098729|0.147055|0.148740|0.500000| |1.181704|1.094534|1.073164|1.126600|1.221823|1.257428|1.383405|1.402969|1.540979|1.687718|2.238715|2.020132|2.596457|2.123603|2.516193|2.551801|2.172785|1.911349|3.036028|5.176606|5.111669|4.648936|7.152229|7.149281|4.598424|3.715625|6.308447|8.992482|8.062912|12.271091|0.219644|17.684091|8.820845|5.502678|4.898683|5.603675|2.253903|0.033180|0.029100|0.030503|0.035358|0.036614|0.043030|0.057212|0.057991|0.069696|0.077097|0.069450|0.059938|0.058912|0.052104|0.048753|0.121367|0.116636|0.252030|0.179838|0.114035|0.120130|0.087075|0.099281|0.164763|0.133480|0.301349|0.500000| |1.078188|1.008257|0.993431|1.040233|1.117108|1.141209|1.237857|1.242405|1.342188|1.458893|1.964138|1.802821|2.189327|1.779583|2.025903|1.992645|1.744105|1.585046|2.242865|3.848051|3.548733|2.938974|3.827649|4.084144|3.215692|2.648447|3.876495|6.524994|4.896455|7.578427|0.147220|8.985993|17.575434|8.786581|5.519671|4.891244|2.101657|0.030168|0.026894|0.028311|0.032252|0.032577|0.037211|0.049020|0.048775|0.056437|0.061748|0.054481|0.048311|0.047043|0.043323|0.040876|0.077777|0.076805|0.117091|0.106540|0.085901|0.088429|0.066002|0.070948|0.096129|0.090989|0.213959|0.215187|0.500000| |1.176245|1.094077|1.074280|1.125614|1.215226|1.247511|1.362075|1.367194|1.485376|1.626362|2.187481|1.993596|2.459421|2.023911|2.342632|2.247695|1.941353|1.755432|2.543679|4.349557|4.029637|3.293374|4.464141|4.616911|3.691098|2.955012|3.877745|6.354098|4.707783|9.332134|0.214734|8.862368|17.511673|8.810901|6.774169|5.659210|2.262405|0.032986|0.029134|0.030517|0.035082|0.035676|0.041118|0.056242|0.054768|0.066167|0.072383|0.060468|0.054209|0.051559|0.047496|0.044974|0.083178|0.086666|0.130277|0.135327|0.095243|0.107178|0.073768|0.076168|0.094545|0.084678|0.173300|0.214689|0.303988|0.500000| |1.100670|1.032193|1.026191|1.083410|1.162784|1.174469|1.269248|1.256369|1.348612|1.481586|2.029832|1.868141|2.205357|1.821984|2.032172|1.969668|1.706930|1.583143|2.139728|3.562545|3.397628|2.651672|3.320603|3.993867|3.399030|2.696964|3.949573|7.475925|4.598252|7.619318|0.137116|6.765720|8.853748|17.535276|8.850990|6.738957|2.172639|0.030536|0.027399|0.029680|0.033843|0.032765|0.036938|0.050525|0.050915|0.055333|0.063091|0.055046|0.046496|0.045817|0.043880|0.040548|0.070776|0.067265|0.093394|0.091189|0.097799|0.092979|0.068865|0.072591|0.085234|0.087990|0.200136|0.139372|0.215378|0.173431|0.500000| |1.113195|1.044476|1.035570|1.089197|1.167266|1.182892|1.275965|1.262158|1.351467|1.480591|2.030074|1.874812|2.193953|1.809545|2.014522|1.912162|1.669827|1.554164|2.068258|3.483232|3.212194|2.487359|3.097015|3.490854|3.069626|2.475442|3.209673|5.790295|3.828834|6.614909|0.134654|5.507547|8.837000|17.590160|8.835392|5.492466|2.193573|0.030958|0.027785|0.029773|0.033828|0.032948|0.037001|0.050887|0.049883|0.055843|0.062375|0.052566|0.046044|0.044401|0.042625|0.039940|0.064882|0.064673|0.086669|0.089567|0.085532|0.088280|0.064075|0.065063|0.073806|0.072362|0.139675|0.123436|0.208700|0.215368|0.303409|0.500000| |1.238561|1.157559|1.155562|1.230099|1.327787|1.334391|1.447133|1.413440|1.515983|1.694206|2.361404|2.163893|2.516613|2.137954|2.361231|2.195789|1.871136|1.763361|2.309538|3.754302|3.638879|2.669096|3.261408|4.038067|3.907723|2.978351|3.648649|7.019155|4.050204|7.590188|0.147967|4.914529|5.521133|8.795914|17.574649|9.000036|2.435007|0.034180|0.030535|0.033741|0.038935|0.036498|0.040989|0.060434|0.060088|0.063689|0.075549|0.061525|0.050670|0.049265|0.048939|0.044651|0.069261|0.067252|0.085325|0.093379|0.116766|0.114242|0.078909|0.077159|0.075876|0.076370|0.131056|0.107946|0.123266|0.138673|0.215274|0.209110|0.500000| |1.299238|1.206581|1.194316|1.265388|1.372769|1.395497|1.526019|1.502820|1.626244|1.819614|2.507990|2.277985|2.736421|2.335113|2.654293|2.425038|2.048673|1.901381|2.604764|4.265275|4.113267|3.050057|3.885977|4.578799|4.311652|3.231533|3.732936|6.631635|4.184904|9.357457|0.216425|5.694906|6.783292|8.823072|17.504617|8.855633|2.505940|0.036104|0.031876|0.034447|0.040041|0.038756|0.044197|0.066367|0.064072|0.073290|0.085647|0.066246|0.056271|0.053368|0.051915|0.048021|0.076385|0.077780|0.100441|0.118537|0.118483|0.134947|0.084364|0.080842|0.080929|0.076475|0.133672|0.127205|0.138730|0.197070|0.173507|0.215639|0.304186|0.500000| 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