Version2.0 2020-07-18T21:06:53Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 23-May-2020 #N HF/6-31G(d) OPT=(MaxStep=1,RFO) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1ccc(cc1)C(=O)Nc2ccc(cc2)[C@@H]3[C@@H](N(C(=O)O3)Cc4cccc(c4)C)C(=O)NC5CC5 C35752835 RHF 6-31G(d) (6D,7F) Cc1ccc(cc1)C(=O)Nc2ccc(cc2)[C@@H]3[C@@H](N(C(=O)O3)Cc4cccc(c4)C)C(=O)NC5CC5 C01[X(C29H29N3O4)] 189 C1 598 Cc1ccc(cc1)C(=O)Nc1ccc(cc1)[C@H]1OC(=O)N([C@H]1C(=O)NC1CC1)Cc1cccc(c1)C Cc1ccc(cc1)C(=O)Nc1ccc(cc1)[C@H]1OC(=O)N([C@H]1C(=O)NC1CC1)Cc1cccc(c1)C Cc1ccc(cc1)C(=O)Nc2ccc(cc2)[C@H]3OC(=O)N(Cc4cccc(C)c4)[C@H]3C(=O)NC5CC5 InChIKey=UEDLVJJCQLKLDG-CLJLJLNGSA-N InChI=1S/C29H29N3O4/c1-18-6-8-22(9-7-18)27(33)30-23-12-10-21(11-13-23)26-25(28(34)31-24-14-15-24)32(29(35)36-26)17-20-5-3-4-19(2)16-20/h3-13,16,24-26H,14-15,17H2,1-2H3,(H,30,33)(H,31,34)/t25-,26-/m1/s1 InChI=1/C29H29N3O4/c1-18-6-8-22(9-7-18)27(33)30-23-12-10-21(11-13-23)26-25(28(34)31-24-14-15-24)32(29(35)36-26)17-20-5-3-4-19(2)16-20/h3-13,16,24-26H,14-15,17H2,1-2H3,(H,30,33)(H,31,34)/t25-,26-/m1/s1/f/h30-31H Cc1ccc(cc1)C(=O)Nc2ccc(cc2)[C@@H]3[C@@H](N(C(=O)O3)Cc4cccc(c4)C)C(=O)NC5CC5 C01[X(C29H29N3O4)] 189 C01 598 Cc1ccc(cc1)C(=O)Nc1ccc(cc1)[C@H]1OC(=O)N([C@H]1C(=O)NC1CC1)Cc1cccc(c1)C C[C]1[CH][CH][C]([CH][CH]1)C(=O)N[C]1[CH][CH][C]([CH][CH]1)[C@H]1OC(=O)N([C@H]1C(=O)NC1CC1)C[C]1[CH][CH][CH][C]([CH]1)C C[C]1[CH][CH][C]([CH][CH]1)C(=O)N[C]2[CH][CH][C]([CH][CH]2)[C@H]3OC(=O)N(C[C]4[CH][CH][CH][C](C)[CH]4)[C@H]3C(=O)NC5CC5 InChIKey=UEDLVJJCQLKLDG-CLJLJLNGSA-N InChI=1S/C29H29N3O4/c1-18-6-8-22(9-7-18)27(33)30-23-12-10-21(11-13-23)26-25(28(34)31-24-14-15-24)32(29(35)36-26)17-20-5-3-4-19(2)16-20/h3-13,16,24-26H,14-15,17H2,1-2H3,(H,30,33)(H,31,34)/t25-,26-/m1/s1 InChI=1/C29H29N3O4/c1-18-6-8-22(9-7-18)27(33)30-23-12-10-21(11-13-23)26-25(28(34)31-24-14-15-24)32(29(35)36-26)17-20-5-3-4-19(2)16-20/h3-13,16,24-26H,14-15,17H2,1-2H3,(H,30,33)(H,31,34)/t25-,26-/m1/s1/f/h30-31H 3614.9104587574 -1577.9218168 1-A 28051.7882 128 470 598 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.60303 -20.53801 -20.53453 -20.52207 -15.60982 -15.59381 -15.59168 -11.38915 -11.36566 -11.35239 -11.31844 -11.29541 -11.29229 -11.26835 -11.26296 -11.25980 -11.25671 -11.25223 -11.25203 -11.24748 -11.24740 -11.24545 -11.24384 -11.24292 -11.24077 -11.24068 -11.24035 -11.23524 -11.23412 -11.23339 -11.23225 -11.22947 -11.22913 -11.22834 -11.22656 -11.22564 -1.48224 -1.40772 -1.40266 -1.36663 -1.26745 -1.26219 -1.25286 -1.17730 -1.16434 -1.16113 -1.13397 -1.08131 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929.4479 942.0821 944.4444 960.0821 961.2751 968.1931 990.1869 992.5459 1008.7327 1012.3346 1025.5535 1061.2150 1069.7051 1078.5970 1082.7328 1088.8243 1094.4666 1100.6725 1109.0440 1113.5934 1114.0418 1115.8400 1118.1391 1119.9016 1138.4810 1173.6163 1174.1012 1194.8930 1200.1113 1203.2338 1206.3422 1212.3308 1216.0890 1222.6093 1235.0964 1253.2853 1259.2216 1281.0594 1287.9271 1295.3227 1308.8409 1311.4292 1313.5859 1318.3390 1319.3701 1326.8728 1329.8343 1337.9938 1347.4929 1367.7235 1376.0652 1378.2420 1383.2634 1405.0064 1433.8562 1454.0839 1462.4447 1463.9473 1475.1012 1522.7578 1532.4448 1538.9100 1552.8229 1563.1119 1565.9424 1567.8703 1568.7582 1587.2278 1600.6559 1607.3062 1630.9369 1632.1437 1638.4568 1643.2891 1656.7505 1666.3001 1667.5944 1685.3243 1697.9928 1699.2179 1711.0662 1766.5308 1792.3014 1792.8435 1816.7384 1820.0652 1823.3730 1956.2103 1967.1485 2038.2754 3203.3337 3206.9430 3238.9943 3252.1412 3255.4094 3261.2876 3267.5960 3280.7454 3286.3465 3312.2940 3314.3164 3328.2901 3341.6145 3342.7506 3343.3879 3351.6610 3358.6620 3359.8228 3362.5105 3365.2808 3378.1103 3380.8703 3392.0860 3407.8551 3408.8279 3414.4640 3453.7127 3859.9552 3892.4974 5.2471 4.8835 4.7225 4.8146 3.4829 1.1007 3.6945 1.1369 3.8707 3.6337 4.0005 4.8015 6.2353 5.1833 5.7465 4.9923 4.6966 5.0409 5.4458 5.2881 5.2147 6.9147 4.6904 3.4804 5.1634 5.7060 5.4492 4.6678 2.8886 5.2762 6.5525 3.2603 4.6594 3.7432 3.4409 4.1899 4.1277 3.1381 3.0583 4.2744 2.7813 2.2260 1.6054 3.0560 4.5649 1.3164 3.2134 3.4084 3.7927 5.2238 5.1048 6.0850 6.6259 5.4262 5.8559 5.9508 3.8571 3.1743 3.9074 3.2970 4.3399 1.2094 3.0525 5.1237 6.3106 2.0155 3.4657 2.2134 1.4341 2.1953 2.2373 1.8845 2.1855 1.3783 2.0425 3.2943 3.5912 3.9490 1.5897 2.5872 1.3758 2.1318 1.4985 3.5164 2.2811 1.3773 1.5195 2.1455 2.0158 1.7347 1.5879 1.6382 2.0741 1.7390 3.1466 1.5353 1.5519 1.3980 2.6513 1.8700 1.9581 1.3655 2.8046 6.4148 2.2594 2.5442 1.2170 2.0453 1.6568 2.3973 1.3672 1.4286 1.1705 1.8647 1.8089 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3.8394 13.5945 0.4523 0.3772 8.2442 13.3570 5.5391 0.0523 5.5991 12.8226 8.2821 3.0185 6.2917 2.4504 1.1756 6.6726 1.3929 0.2745 3.6473 11.1027 10.8968 121.8740 20.7778 6.8618 84.8040 7.8079 8.1914 6.7293 12.4795 18.5093 5.4149 0.1337 2.0976 20.3094 8.9775 8.7049 22.7439 4.5071 7.1374 2.0073 2.7323 56.4790 10.1212 40.1370 23.6074 19.2642 15.5344 4.2660 16.7475 4.0209 6.9436 12.4498 14.2274 21.9475 14.1407 14.5443 26.5503 14.9267 8.5985 3.5341 16.6928 4.1747 1.7716 3.0954 0.4864 0.3170 1.7138 1.7266 0.1662 2.8703 4.6529 2.7656 1.8883 2.6217 3.9459 4.0469 2.3008 40.3945 9.7967 21.1290 0.2825 31.6739 98.0232 21.1461 44.6337 1.1922 32.8795 1.6817 18.4315 33.3324 6.4720 28.6354 19.7840 40.4514 18.2159 38.1510 63.1983 38.0142 131.3609 12.7590 68.4202 93.6171 531.1232 18.6999 6.7505 2.0083 27.9194 34.7259 134.6719 12.8937 37.8465 108.5836 13.3179 111.1961 62.2060 92.9127 114.9237 4.9942 1.8142 4.8522 4.4480 7.3141 7.4986 18.1330 17.7108 10.3036 69.5757 61.6471 201.2481 548.4096 7.1594 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1574.69 1583.62 1595.67 1602.21 1602.86 1605.44 1608.75 1611.29 1638.02 1688.57 1689.27 1719.18 1726.69 1731.19 1735.66 1744.27 1749.68 1759.06 1777.03 1803.20 1811.74 1843.16 1853.04 1863.68 1883.13 1886.85 1889.96 1896.80 1898.28 1909.07 1913.33 1925.07 1938.74 1967.85 1979.85 1982.98 1990.21 2021.49 2063.00 2092.10 2104.13 2106.29 2122.34 2190.91 2204.85 2214.15 2234.17 2248.97 2253.04 2255.82 2257.09 2283.67 2302.99 2312.56 2346.55 2348.29 2357.37 2364.33 2383.69 2397.43 2399.30 2424.81 2443.03 2444.80 2461.84 2541.64 2578.72 2579.50 2613.88 2618.67 2623.43 2814.55 2830.29 2932.62 4608.88 4614.08 4660.19 4679.11 4683.81 4692.27 4701.34 4720.26 4728.32 4765.65 4768.56 4788.67 4807.84 4809.47 4810.39 4822.29 4832.37 4834.04 4837.90 4841.89 4860.35 4864.32 4880.46 4903.14 4904.54 4912.65 4969.12 5553.61 5600.44 0.570666 0.601945 0.602889 0.499040 -1577.351151 -1577.319872 -1577.318928 -1577.422777 3.483113D-04 MUNgauss RevisionA2.0 retrievium 18-Jul-2020 DUDE Cc1ccc(cc1)C(=O)Nc2ccc(cc2)[C@@H]3[C@@H](N(C(=O)O3)Cc4cccc(c4)C)C(=O)NC5CC5 C35752835 RHF 6-31G(d) (6D,10F) C1 483.215807 |X|Y|Z| 54.504408 37.876393 153.773656 68.217227 31 6 7 8 27 3 1 |36.858105| |12.614907|36.858105| |7.557782|13.665884|36.858105| |5.019739|7.891450|13.814426|36.858105| |4.416276|6.795013|7.919771|13.683525|36.858105| |5.007614|7.893939|6.902355|7.962372|13.732338|36.858105| |7.539340|13.735557|7.981644|6.897890|7.911246|13.739734|36.858105| |3.278109|4.428608|5.073254|7.699234|12.705054|7.488508|5.003331|36.858105| |2.939274|3.807827|4.548922|6.749719|8.077968|5.314853|4.020304|15.895225|73.516695| |2.906245|3.755469|3.975059|5.237471|7.866676|6.553157|4.456651|13.927683|14.983622|53.358707| |2.392802|2.941175|3.105489|3.883233|5.038063|4.439004|3.362840|7.664394|11.761079|18.428099|36.858105| |2.189863|2.619709|2.697669|3.215945|3.997859|3.770197|2.994886|5.203858|8.097465|10.830908|13.717390|36.858105| |1.890516|2.204766|2.271820|2.646490|3.135767|2.973730|2.465168|3.921405|6.546290|7.063428|7.919223|13.771294|36.858105| |1.770970|2.054025|2.143537|2.503719|2.903706|2.698777|2.259529|3.677939|6.509701|6.168908|6.809298|7.908596|13.746924|36.858105| |1.875484|2.201647|2.335086|2.787582|3.245271|2.921941|2.409997|4.319036|8.041693|6.989054|7.932361|6.908149|7.988796|13.701345|36.858105| |2.165802|2.613312|2.803971|3.477019|4.229326|3.664305|2.896256|6.254118|11.636236|10.538796|13.679534|7.943140|6.884242|7.883907|13.782402|36.858105| |1.553686|1.767182|1.835856|2.096803|2.362856|2.225697|1.918605|2.857731|5.124199|4.541844|4.426417|5.037701|7.618108|12.643978|7.516910|5.004281|36.858105| |1.508977|1.704831|1.750746|1.975964|2.230015|2.140892|1.860414|2.636420|4.626770|4.227898|3.996438|4.797459|7.329617|8.965144|5.644196|4.213554|17.577618|0.500000| |1.461297|1.649285|1.730735|1.967004|2.161606|2.011949|1.759501|2.579521|4.718027|3.949664|3.669044|4.045285|5.442944|7.275620|5.591748|4.100431|12.284430|0.247262|36.858105| |1.435285|1.612395|1.684879|1.900683|2.081666|1.951988|1.718599|2.446356|4.409063|3.761371|3.423397|3.919471|5.240975|6.069712|4.597432|3.621580|8.732874|0.227975|17.592042|0.500000| |1.336616|1.493529|1.560130|1.752390|1.907680|1.792092|1.586726|2.233529|4.103485|3.351710|3.004097|3.212991|4.078266|5.234434|4.455090|3.386746|8.376640|0.196317|13.257154|0.253258|53.358707| |1.351157|1.512084|1.573393|1.768526|1.939034|1.830441|1.615383|2.276958|4.188358|3.418623|3.073315|3.211145|4.029942|5.390004|4.811567|3.568595|8.421507|0.192259|8.274437|0.167176|18.989820|36.858105| |1.273855|1.415781|1.469726|1.638797|1.782794|1.691374|1.506410|2.064415|3.809419|3.049660|2.666072|2.732350|3.281149|4.156289|3.936939|3.080139|5.615845|0.139293|5.528191|0.123763|11.321296|16.089845|73.516695| |1.475768|1.668473|1.731285|1.965005|2.196369|2.076015|1.804339|2.628119|4.786741|4.052952|3.794281|3.997957|5.265800|7.892713|6.630012|4.509507|13.477054|0.261170|8.215592|0.165264|11.798855|14.210364|15.212065|73.516695| |1.234658|1.367428|1.431979|1.594174|1.707461|1.602905|1.437315|1.966357|3.635735|2.887190|2.503347|2.634840|3.174339|3.809906|3.440798|2.780445|5.151478|0.130209|7.496697|0.183884|17.856302|7.765389|11.816196|9.492842|36.858105| |1.186998|1.307073|1.363212|1.505776|1.606441|1.518190|1.371392|1.825348|3.334935|2.686810|2.296171|2.469562|2.952356|3.335636|2.940327|2.460861|4.327493|0.117806|6.094350|0.182397|10.539415|5.193377|8.127285|7.324590|12.573926|36.858105| |1.153483|1.265157|1.307573|1.434844|1.538292|1.471807|1.334330|1.731626|3.120642|2.572283|2.186078|2.394457|2.876042|3.149240|2.714374|2.297226|4.092477|0.119848|5.158853|0.161754|8.545511|4.689269|7.491600|6.889904|7.537948|13.662171|36.858105| |1.105601|1.205417|1.242159|1.353082|1.442904|1.387219|1.267414|1.604671|2.874421|2.375119|1.985541|2.184258|2.565447|2.704257|2.351139|2.045795|3.320088|0.098407|4.001676|0.128924|5.985037|3.521804|5.747314|5.488618|5.021673|7.930197|13.814615|36.858105| |1.088460|1.183882|1.225516|1.332504|1.408523|1.347226|1.235986|1.560044|2.806502|2.286501|1.892255|2.062990|2.374541|2.482049|2.198886|1.942922|2.936876|0.084559|3.600759|0.115958|5.150744|3.043780|4.984715|4.817268|4.435010|6.851450|7.926807|13.699511|36.858105| |1.115439|1.216722|1.269531|1.386947|1.458262|1.380775|1.263856|1.624891|2.954134|2.361842|1.958440|2.106410|2.411514|2.563126|2.307693|2.034273|3.010010|0.083581|3.861082|0.122357|5.476975|3.156979|5.140478|4.942022|4.994991|7.847317|6.822596|7.905752|13.766403|36.858105| |1.165738|1.279593|1.341009|1.477187|1.559153|1.466163|1.331783|1.760109|3.228946|2.560457|2.155319|2.299064|2.673016|2.944308|2.657454|2.287214|3.569722|0.096080|4.907775|0.150639|7.306685|3.943336|6.312935|5.923103|7.566967|13.772096|7.963180|6.918447|7.982440|13.649331|36.858105| |1.084756|1.177870|1.233319|1.341117|1.395106|1.317147|1.213744|1.541331|2.810737|2.213441|1.806623|1.921183|2.143940|2.248371|2.069143|1.865008|2.535244|0.069645|3.149680|0.097382|4.323311|2.602893|4.295080|4.178184|3.783765|5.006544|4.426788|5.006733|7.540069|12.605038|7.557532|36.858105| |1.525993|1.732682|1.850949|2.130427|2.310478|2.095341|1.826248|2.804319|5.302439|4.169285|3.846584|3.971369|4.878121|6.425680|5.938978|4.477684|7.383190|0.153528|12.413268|0.244897|10.524585|5.991360|8.101192|10.668821|6.128819|4.974463|3.998541|3.304293|3.176836|3.589490|4.566323|3.109954|36.858105| |1.492264|1.690529|1.816023|2.089594|2.242224|2.021346|1.769475|2.715819|5.264209|3.921856|3.530974|3.461246|4.040398|5.328752|5.597099|4.295951|5.905715|0.125624|7.990149|0.164846|9.377973|6.012095|8.634812|10.152660|5.969596|4.492288|3.578286|2.960943|2.860774|3.254348|4.158592|2.878262|15.904044|73.516695| |1.604008|1.827791|1.967652|2.275718|2.451415|2.199121|1.915659|2.975008|5.599192|4.410957|4.005039|4.191536|4.904204|5.672968|5.237058|4.382708|5.644028|0.129536|7.813699|0.208063|7.150365|4.274903|6.151066|7.891672|4.581492|4.219768|3.525953|3.090057|3.081757|3.500944|4.196643|3.163340|14.078166|15.032132|53.358707| |1.685761|1.928971|2.119534|2.477192|2.606538|2.278083|1.989006|3.173358|6.184141|4.490426|3.893189|3.810550|4.053690|4.495723|4.634123|4.269878|4.164257|0.098480|5.031854|0.133099|5.321477|3.416592|5.179770|6.311338|3.606153|3.334991|2.835412|2.558745|2.605675|2.968967|3.437415|2.826764|7.834823|12.141872|18.098214|36.858105| |1.649465|1.866653|2.055596|2.361391|2.425202|2.133057|1.897982|2.835728|5.422863|3.944805|3.238969|3.232791|3.333588|3.463974|3.470734|3.349708|3.269479|0.081462|3.871755|0.109229|4.309991|2.767788|4.309816|5.027047|3.053021|2.985478|2.584546|2.420674|2.542458|2.915129|3.220255|2.910626|5.142669|8.186098|10.359971|12.736904|36.858105| |1.545543|1.741348|1.916311|2.196082|2.250692|1.983450|1.768877|2.642408|5.172993|3.633523|3.012367|2.936127|3.094821|3.402502|3.521064|3.287141|3.324942|0.080876|4.063247|0.109021|4.702824|3.017842|4.742516|5.321537|3.433533|3.223922|2.689712|2.462282|2.579159|3.030421|3.494800|3.007917|5.835836|10.293232|10.310051|12.785846|12.715529|36.858105| |17.552386|8.851427|6.777151|4.620469|3.960926|4.282477|5.846133|3.037254|4.984083|3.624308|2.227952|2.026055|1.769796|1.679368|1.791051|2.057753|1.482557|0.039865|1.398999|0.038023|1.752763|1.305624|2.199308|2.524215|1.194257|1.144748|1.109925|1.062565|1.046857|1.074901|1.125002|1.046934|1.465769|2.567648|2.085731|1.616127|1.579180|1.493989|0.500000| |17.584810|8.835217|5.569050|4.169729|3.950899|4.741059|7.231773|3.020421|4.773984|3.765635|2.299854|2.133188|1.848400|1.723428|1.810001|2.074125|1.517859|0.041216|1.419782|0.038807|1.773486|1.320607|2.217303|2.567231|1.201908|1.157711|1.131088|1.085687|1.065489|1.086672|1.133260|1.054025|1.468188|2.546279|2.089757|1.596252|1.557294|1.461740|0.301645|0.500000| |17.544515|8.853664|6.675419|4.586405|3.965417|4.310991|5.909541|3.037381|4.890052|3.704249|2.270645|2.104969|1.826814|1.706285|1.792878|2.052394|1.505045|0.040676|1.427676|0.039165|1.774598|1.308990|2.191095|2.528837|1.209783|1.169505|1.136321|1.093932|1.081639|1.109185|1.154399|1.083670|1.493690|2.588312|2.152838|1.668469|1.652733|1.537422|0.302279|0.301693|0.500000| |7.021173|8.901096|17.701423|8.962572|5.642651|4.966004|5.662534|4.141635|6.996748|4.533531|2.716271|2.391982|2.056821|1.960906|2.130437|2.508797|1.703182|0.045093|1.625034|0.044014|2.005606|1.480842|2.469976|2.867954|1.364705|1.302280|1.246259|1.187527|1.177274|1.222843|1.288441|1.195340|1.746435|3.062610|2.530183|2.019176|1.983151|1.855878|0.194043|0.140638|0.188440|0.500000| |4.092083|5.622790|8.919923|17.750191|8.945132|5.667507|4.967653|7.228572|13.390548|6.617808|3.808933|3.127838|2.621145|2.527552|2.853067|3.543806|2.125442|0.055063|2.022218|0.054055|2.449015|1.807838|2.977047|3.547023|1.645427|1.548576|1.462672|1.376394|1.361951|1.428566|1.527531|1.387022|2.232601|3.926425|3.267118|2.678135|2.559346|2.389651|0.108901|0.095917|0.107759|0.215604|0.500000| |4.096607|5.643798|4.967901|5.643281|8.875987|17.713869|8.967914|6.840780|8.661397|9.732559|4.869515|4.207090|3.259663|2.905824|3.108154|3.893885|2.373095|0.063931|2.102532|0.056623|2.546796|1.924318|3.152613|3.927307|1.657167|1.567721|1.529788|1.437982|1.386108|1.412293|1.501266|1.337059|2.152862|3.668711|3.044962|2.269837|2.100996|1.959642|0.099404|0.113288|0.099975|0.107757|0.124206|0.500000| |6.976591|8.918934|5.659035|4.964730|5.643029|8.943341|17.712032|4.078279|5.974116|5.261149|3.041044|2.790695|2.330598|2.127367|2.236115|2.631704|1.826527|0.049684|1.668785|0.045442|2.061745|1.545647|2.572002|3.064212|1.373477|1.315427|1.288724|1.227887|1.194111|1.213986|1.274190|1.164125|1.710498|2.940754|2.426749|1.828857|1.748005|1.633934|0.150820|0.221624|0.152987|0.124216|0.107772|0.217819|0.500000| |3.068805|3.973566|4.014818|5.030964|7.612689|7.427191|4.943361|9.451576|10.923144|26.098918|9.346047|7.592759|4.906382|4.067968|4.300321|5.770838|3.092540|0.082274|2.697372|0.072747|3.134198|2.333608|3.715535|4.875908|1.995539|1.884092|1.825295|1.701998|1.638120|1.677699|1.798714|1.575105|2.781267|4.602821|4.028432|2.971485|2.684937|2.441949|0.076442|0.082301|0.080004|0.092355|0.123896|0.244769|0.120984|0.500000| |2.289610|2.733799|2.760558|3.229056|4.030438|3.961896|3.170635|4.879824|7.285805|9.965404|8.900193|17.696253|8.936249|5.638220|4.968603|5.641546|4.113023|0.114029|3.456284|0.096278|3.831499|2.782461|4.283959|5.948101|2.367177|2.270760|2.232926|2.077015|1.972660|1.995420|2.137350|1.836065|3.363391|5.243944|4.929157|3.352009|2.987030|2.660892|0.058063|0.062399|0.061476|0.067607|0.085367|0.124593|0.082960|0.230677|0.500000| |1.778180|2.043372|2.082593|2.375560|2.767962|2.683065|2.277109|3.304883|5.494831|5.739501|5.647661|8.965379|17.689762|8.901474|5.657487|4.955999|7.059593|0.222804|5.297027|0.153334|5.484991|3.867782|5.623941|8.608754|3.166601|3.051542|3.065781|2.769748|2.534250|2.521009|2.747553|2.219386|4.430348|6.446510|6.119204|3.646346|3.124372|2.871750|0.046159|0.048611|0.048031|0.052733|0.065039|0.081617|0.060607|0.116281|0.217181|0.500000| |1.754872|2.037516|2.170142|2.562923|2.902981|2.613603|2.199018|3.745866|7.238733|5.663969|5.654371|4.972963|5.670475|8.920940|17.751477|8.975244|6.949588|0.142178|5.573769|0.121832|6.499699|5.443606|8.033441|13.009404|3.703251|3.034586|2.748161|2.346921|2.193962|2.324878|2.722977|2.080776|6.173276|11.630843|6.801187|4.498456|3.339331|3.569277|0.047011|0.046993|0.046601|0.055658|0.073711|0.076203|0.056841|0.098473|0.107835|0.124239|0.500000| |2.240760|2.720065|2.973680|3.751308|4.484387|3.750322|2.970904|6.778379|14.382340|9.576163|8.904740|5.652385|4.965538|5.633949|8.948181|17.815677|4.086425|0.096957|3.522715|0.086624|4.127731|3.225104|5.105452|6.953774|2.564612|2.260645|2.098605|1.877724|1.796547|1.890903|2.122242|1.752353|3.949614|7.104711|5.243975|3.958349|3.160230|3.174377|0.059801|0.059102|0.058548|0.074086|0.108382|0.107651|0.074065|0.144335|0.124064|0.107706|0.216957|0.500000| |1.178530|1.299510|1.355669|1.500898|1.605007|1.515784|1.365769|1.833725|3.387343|2.678299|2.295831|2.393982|2.840852|3.381631|3.119970|2.553986|4.462417|0.115615|5.626480|0.138918|12.726309|7.605778|13.848058|8.896963|17.633561|8.872965|6.724297|4.612788|3.987735|4.301852|5.919532|3.355001|4.745016|8.670594|5.024219|3.051105|2.625895|2.942910|0.031763|0.031949|0.032011|0.035939|0.042911|0.043593|0.036391|0.051549|0.060100|0.078664|0.094482|0.066275|0.500000| |1.248251|1.384073|1.460859|1.631689|1.733637|1.611177|1.445167|2.003122|3.754444|2.900437|2.500152|2.576184|3.032858|3.651257|3.442295|2.812337|4.621548|0.112693|6.708505|0.161267|12.419630|6.397766|10.093658|8.460364|17.585382|8.871470|5.575157|4.187694|3.987307|4.768216|7.325106|3.838480|6.734577|12.853491|6.756585|4.018495|3.359410|3.979040|0.033626|0.033601|0.034012|0.038823|0.047185|0.045912|0.038163|0.055250|0.064105|0.082231|0.104816|0.073114|0.303132|0.500000| |1.159847|1.273044|1.309695|1.436871|1.550452|1.492067|1.350043|1.746649|3.134101|2.611643|2.229999|2.451186|2.976876|3.285622|2.802916|2.350193|4.395821|0.133306|5.146610|0.153989|9.001588|5.280815|8.531039|7.655969|6.997128|8.894370|17.710048|8.926861|5.637307|4.925222|5.656658|3.541564|3.826324|6.157145|4.497891|2.670680|2.399703|2.491325|0.031000|0.031689|0.031624|0.034558|0.040497|0.043354|0.036334|0.051527|0.063271|0.088563|0.078966|0.059433|0.190395|0.140450|0.500000| |1.077086|1.170236|1.198864|1.299441|1.388184|1.345193|1.233527|1.532829|2.726464|2.275028|1.888969|2.088980|2.438476|2.526652|2.193598|1.927393|3.056877|0.092767|3.490183|0.110912|5.151044|3.186482|5.275372|5.085037|4.091378|5.640169|8.941629|17.708890|8.909161|5.636784|4.974892|4.085087|2.885540|4.628894|3.705547|2.289283|2.176507|2.188325|0.028730|0.029487|0.029600|0.031811|0.036528|0.038862|0.033356|0.045607|0.055730|0.073958|0.060422|0.049159|0.108435|0.096170|0.215293|0.500000| |1.049641|1.136169|1.172896|1.267838|1.335462|1.282724|1.183741|1.466000|2.626436|2.142344|1.753012|1.910939|2.166938|2.226355|1.986022|1.781798|2.569165|0.074382|3.043090|0.096977|4.266097|2.610814|4.321648|4.220500|3.546568|4.939769|5.647415|8.911899|17.703272|8.926466|5.657666|6.973985|2.738770|4.418967|3.692366|2.349514|2.338355|2.337527|0.028032|0.028582|0.029052|0.031366|0.035919|0.036605|0.031853|0.042898|0.051338|0.064453|0.054733|0.045946|0.090745|0.090685|0.124171|0.215590|0.500000| |1.182672|1.300033|1.371872|1.515929|1.589788|1.482237|1.345837|1.800631|3.339688|2.591064|2.174179|2.279143|2.611887|2.907360|2.696430|2.332748|3.429707|0.089445|4.731484|0.138046|6.858221|3.799731|6.125431|5.749404|7.046732|8.951635|5.656229|4.972581|5.667474|8.912222|17.679803|7.046316|4.866351|8.186503|6.126421|3.798060|3.563857|4.058131|0.031780|0.031809|0.032550|0.036732|0.043866|0.041908|0.035605|0.050196|0.058540|0.073045|0.077666|0.060728|0.153675|0.226997|0.124311|0.107845|0.124315|0.500000| |1.042191|1.128726|1.183407|1.284131|1.329907|1.254458|1.159323|1.465607|2.686468|2.088613|1.696097|1.782141|1.974016|2.088684|1.952401|1.764762|2.345783|0.063901|2.877433|0.086185|4.047379|2.484801|4.179169|3.952137|3.617061|4.564181|3.974423|4.326275|5.949696|8.842239|6.621853|17.540203|2.885591|4.893334|3.924619|2.634416|2.697138|2.862612|0.028039|0.028113|0.028898|0.031958|0.036973|0.035294|0.030887|0.041168|0.047191|0.056193|0.055131|0.046485|0.091589|0.104204|0.090498|0.100326|0.154708|0.186349|0.500000| |1.135257|1.236082|1.300941|1.419415|1.471876|1.380742|1.270051|1.630807|2.984103|2.334460|1.904275|2.019237|2.238849|2.340321|2.164852|1.962269|2.594543|0.070392|3.255064|0.100902|4.307384|2.587819|4.218755|4.215755|3.674149|4.619938|3.966131|4.265924|5.807195|8.832459|6.815640|17.546998|3.337573|5.441948|4.793412|3.191202|3.390350|3.473401|0.030406|0.030538|0.031569|0.035064|0.040961|0.038777|0.033699|0.046035|0.053569|0.063943|0.060206|0.051218|0.088692|0.106634|0.090307|0.098637|0.149228|0.197228|0.302357|0.500000| |1.052069|1.137521|1.186184|1.282610|1.332923|1.265649|1.171887|1.460802|2.646327|2.099699|1.700261|1.817226|2.013274|2.077268|1.906330|1.735721|2.317113|0.064571|2.794265|0.086857|3.803986|2.338840|3.878061|3.810352|3.215566|4.158544|3.957305|4.734845|7.225353|8.835037|5.571132|17.578894|2.722669|4.467895|3.808494|2.525550|2.630841|2.650021|0.028174|0.028457|0.029260|0.031963|0.036704|0.035702|0.031325|0.041796|0.048749|0.058397|0.052835|0.045301|0.080856|0.088846|0.090133|0.112737|0.221097|0.141076|0.301879|0.301698|0.500000| |1.636322|1.865865|1.992001|2.295837|2.498986|2.266001|1.970215|3.012977|5.506482|4.591739|4.198293|4.682018|5.624070|5.961017|5.051067|4.322566|5.794239|0.140037|7.538776|0.230749|6.683141|4.009122|5.758456|7.609635|4.196603|4.077268|3.564800|3.187966|3.162032|3.492690|4.024299|3.137093|9.448362|10.910662|26.041564|9.164221|6.821688|5.864819|0.043124|0.043661|0.044933|0.051996|0.066452|0.064478|0.051118|0.087193|0.113926|0.148506|0.126450|0.102620|0.095103|0.119671|0.093103|0.078828|0.077949|0.114604|0.077913|0.096669|0.078548|0.500000| |1.827839|2.120613|2.360814|2.823495|2.982966|2.542630|2.187260|3.762886|7.609965|5.219675|4.546823|4.176583|4.245054|4.743398|5.313948|5.167350|4.096060|0.095809|4.551348|0.116487|4.907235|3.311619|5.065284|6.327052|3.244338|2.939411|2.555643|2.302978|2.310009|2.575045|2.951388|2.446093|6.697337|11.269869|12.224928|17.702878|8.611642|8.648575|0.048708|0.047797|0.049968|0.062096|0.086025|0.069920|0.055250|0.093009|0.099880|0.101825|0.141852|0.135883|0.078284|0.098971|0.068257|0.058066|0.058329|0.089062|0.064025|0.075183|0.061525|0.197872|0.500000| |1.754703|1.991094|2.222258|2.561208|2.581390|2.240009|2.000864|2.986612|5.741835|4.051042|3.211976|3.138543|3.107139|3.152640|3.226730|3.254407|2.896703|0.072979|3.270505|0.091680|3.717102|2.454513|3.874166|4.514692|2.619487|2.557961|2.263997|2.141335|2.239009|2.517900|2.727126|2.538300|4.146400|6.820714|7.650275|8.612240|17.716397|8.556176|0.046626|0.045658|0.049119|0.059936|0.078198|0.060428|0.050784|0.076721|0.081856|0.080451|0.085529|0.086862|0.063939|0.079060|0.059071|0.054246|0.058009|0.082606|0.065976|0.080940|0.064907|0.147549|0.211829|0.500000| |1.569490|1.761485|1.914505|2.168287|2.238864|2.006331|1.798570|2.573669|4.800420|3.646418|2.992614|3.098853|3.255812|3.309240|3.179690|3.026156|3.213960|0.082026|3.880548|0.114953|4.316291|2.711837|4.214072|4.874403|3.098808|3.157751|2.749928|2.624082|2.809178|3.242714|3.494280|3.282265|4.846448|7.416612|9.695225|8.615652|17.703783|8.606921|0.041608|0.041412|0.043839|0.051285|0.064267|0.055282|0.046415|0.070292|0.081009|0.087530|0.084321|0.078166|0.073453|0.093182|0.069850|0.065223|0.072043|0.106154|0.082464|0.109066|0.082650|0.196111|0.171355|0.292529|0.500000| |1.427346|1.594474|1.735450|1.964286|2.020769|1.809342|1.624724|2.343051|4.520868|3.258194|2.709734|2.694547|2.909752|3.225658|3.249571|2.953648|3.308016|0.081135|4.226687|0.114712|5.051381|3.144629|4.964065|5.353639|3.877267|3.688197|2.975548|2.715884|2.894175|3.525792|4.167498|3.527572|5.940475|10.549210|9.652479|8.662923|8.604799|17.734329|0.038381|0.037717|0.039433|0.046733|0.058684|0.050006|0.042037|0.061472|0.068194|0.076509|0.092801|0.078721|0.090831|0.129094|0.075039|0.065941|0.071994|0.141728|0.093735|0.115247|0.083917|0.153851|0.172314|0.170644|0.211735|0.500000| 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