Version2.1 2021-01-18T22:31:25Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 04-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCNC(=O)[C@@H](c1ccccc1)N(c2cccc(c2)Cl)C(=O)CCC3CCCCC3 C36481635 RHF 6-31G(d) (6D,7F) CCCCNC(=O)[C@@H](c1ccccc1)N(c2cccc(c2)Cl)C(=O)CCC3CCCCC3 C01[X(C27H35Cl1N2O2)] 195 C1 554 CCCCNC(=O)[C@H](N(c1cccc(c1)Cl)C(=O)CCC1CCCCC1)c1ccccc1 CCCCNC(=O)[C@H](N(c1cccc(c1)Cl)C(=O)CCC1CCCCC1)c1ccccc1 CCCCNC(=O)[C@H](N(C(=O)CCC1CCCCC1)c2cccc(Cl)c2)c3ccccc3 InChIKey=MNWNMSXDYUTCGN-AREMUKBSSA-N InChI=1S/C27H35ClN2O2/c1-2-3-19-29-27(32)26(22-13-8-5-9-14-22)30(24-16-10-15-23(28)20-24)25(31)18-17-21-11-6-4-7-12-21/h5,8-10,13-16,20-21,26H,2-4,6-7,11-12,17-19H2,1H3,(H,29,32)/t26-/m1/s1 InChI=1/C27H35ClN2O2/c1-2-3-19-29-27(32)26(22-13-8-5-9-14-22)30(24-16-10-15-23(28)20-24)25(31)18-17-21-11-6-4-7-12-21/h5,8-10,13-16,20-21,26H,2-4,6-7,11-12,17-19H2,1H3,(H,29,32)/t26-/m1/s1/f/h29H CCCCNC(=O)[C@@H](c1ccccc1)N(c2cccc(c2)Cl)C(=O)CCC3CCCCC3 C01[X(C27H35Cl1N2O2)] 195 C01 554 CCCCNC(=O)[C@H](N(c1cccc(c1)Cl)C(=O)CCC1CCCCC1)c1ccccc1 CCCCNC(=O)[C@H](N([C]1[CH][CH][CH][C]([CH]1)Cl)C(=O)CCC1CCCCC1)[C]1[CH][CH][CH][CH][CH]1 CCCCNC(=O)[C@@H]([C]1[CH][CH][CH][CH][CH]1)N([C]2[CH][CH][CH][C](Cl)[CH]2)C(=O)CCC3CCCCC3 InChIKey=MNWNMSXDYUTCGN-AREMUKBSSA-N InChI=1S/C27H35ClN2O2/c1-2-3-19-29-27(32)26(22-13-8-5-9-14-22)30(24-16-10-15-23(28)20-24)25(31)18-17-21-11-6-4-7-12-21/h5,8-10,13-16,20-21,26H,2-4,6-7,11-12,17-19H2,1H3,(H,29,32)/t26-/m1/s1 InChI=1/C27H35ClN2O2/c1-2-3-19-29-27(32)26(22-13-8-5-9-14-22)30(24-16-10-15-23(28)20-24)25(31)18-17-21-11-6-4-7-12-21/h5,8-10,13-16,20-21,26H,2-4,6-7,11-12,17-19H2,1H3,(H,29,32)/t26-/m1/s1/f/h29H 3369.3728711240 -1760.9893576 1-A 20755.1540 122 432 554 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 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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| 8.8024 16.6556 17.4817 25.3415 30.8737 36.3618 41.8204 46.6236 61.2611 64.8138 66.5481 88.2694 94.7404 104.7952 112.8047 123.5617 125.2394 154.5668 172.3006 179.7295 216.2235 218.4035 223.4163 236.4711 244.9489 263.4653 269.4779 273.9646 287.9567 322.5495 347.8178 352.5207 381.2405 424.0817 448.0733 451.5874 458.1854 458.7510 472.3895 481.9092 483.6032 501.0207 503.8800 509.2201 549.8143 581.1558 609.6037 635.3725 644.8934 678.0763 710.2162 734.4374 771.5527 780.9756 782.8450 795.1227 808.8127 829.5732 850.0995 861.3854 865.0817 870.2961 877.1307 900.7256 912.5477 919.2192 945.2130 957.9927 964.5085 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3208.2409 3214.4585 3218.0328 3224.2958 3225.2655 3226.5191 3228.9805 3233.3244 3233.7707 3238.3068 3260.1537 3262.3273 3265.4615 3281.1970 3296.0529 3297.1177 3350.8064 3361.6618 3374.1727 3376.4096 3387.2106 3403.2017 3403.6542 3408.3131 3422.4463 3875.9370 4.0751 4.0711 3.0302 8.6863 5.4997 3.1892 4.4074 3.7754 3.9593 3.0127 3.1730 3.7621 4.4082 5.6346 3.0834 2.9942 2.2162 5.0499 4.2664 2.9773 4.0796 4.5803 3.7721 3.8001 1.8499 2.1449 1.6901 4.1461 5.3235 6.0051 2.1163 4.4075 4.3332 4.3883 2.4643 6.9588 2.9677 2.9262 3.0837 1.6916 2.4956 3.7613 3.0227 3.3951 3.4323 2.5684 2.8075 2.4665 5.4304 6.3772 5.6892 4.6226 5.1573 2.0922 2.9161 1.0910 2.6237 2.1315 2.4937 1.5090 1.8928 1.3741 2.5197 2.0254 2.1754 2.3952 4.2849 1.8131 1.2511 2.0413 2.0553 1.4103 1.5452 1.3082 1.9799 2.2522 1.4392 2.1009 1.7617 3.0984 5.9030 5.8937 2.7889 1.3681 1.7760 1.3794 1.6837 1.8626 2.1026 2.2899 1.9162 2.0086 1.4351 1.8550 2.1223 2.5019 2.4120 2.1865 2.5998 2.5821 2.3733 2.6189 1.7038 1.6359 1.5849 1.3933 1.1836 1.2778 1.5440 2.1072 1.7391 1.3679 1.7035 1.3888 1.3753 2.1726 1.1997 1.3240 1.2014 1.3284 1.3477 1.1796 1.0712 1.6347 1.2787 1.3994 1.4121 1.4699 1.4487 1.4656 1.5346 1.5874 1.6233 1.4266 1.3131 1.7099 1.9861 2.4709 1.0998 2.1026 1.0897 1.0979 1.0612 1.0937 1.1068 1.0831 1.0941 1.0417 1.0923 2.4364 1.1049 1.0942 2.1381 1.9761 5.6690 5.1659 5.7000 5.1668 11.9747 8.8654 1.0834 1.0709 1.0662 1.0673 1.0661 1.0764 1.0607 1.0591 1.0405 1.0788 1.0933 1.0678 1.0940 1.0755 1.0996 1.0863 1.0954 1.0987 1.0995 1.0974 1.1037 1.1023 1.0990 1.0869 1.0958 1.0883 1.0894 1.0937 1.0903 1.0977 1.0955 1.0950 1.0940 1.0953 1.0782 0.0002 0.0007 0.0005 0.0033 0.0031 0.0025 0.0045 0.0048 0.0088 0.0075 0.0083 0.0173 0.0233 0.0365 0.0231 0.0269 0.0205 0.0711 0.0746 0.0567 0.1124 0.1287 0.1109 0.1252 0.0654 0.0877 0.0723 0.1833 0.2601 0.3681 0.1508 0.3227 0.3711 0.4650 0.2915 0.8361 0.3671 0.3628 0.4054 0.2315 0.3439 0.5563 0.4522 0.5187 0.6113 0.5111 0.6147 0.5867 1.3306 1.7276 1.6908 1.4691 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9.5435 0.3154 0.1954 0.1246 0.1612 0.3470 1.1203 1.7593 2.6933 3.1355 0.0369 1.6284 1.0061 0.8449 2.3926 3.4979 3.2863 1.4134 1.1941 0.6845 0.7467 1.1893 0.2308 0.6688 2.3548 0.3990 9.5985 5.0630 0.4563 4.4982 8.5659 1.6731 5.4355 0.7996 33.2756 4.7290 2.8440 2.5934 16.4687 0.3451 42.9331 38.0250 8.1173 11.7289 18.2059 8.6165 17.8015 2.4141 7.5059 5.8405 0.3006 4.6929 10.9254 17.6308 27.6823 54.5109 3.4667 49.1545 16.7288 6.0541 1.6511 1.9333 1.5346 14.4451 28.9638 1.7473 23.9022 3.5145 4.8852 0.2821 0.3760 0.8299 1.1194 3.2516 0.8266 1.4873 5.3487 2.2373 9.3215 1.6329 1.8883 3.3598 2.2152 0.9054 1.4111 0.5840 3.5528 5.4727 1.2187 1.5261 0.7607 5.5078 1.4793 0.3445 1.7908 18.3685 1.2487 0.4390 10.3986 6.4738 3.8382 36.3394 7.1433 1.3410 8.8414 13.5965 1.1373 3.6265 0.6878 12.5304 7.0365 157.7378 56.0398 185.9918 40.5775 18.4185 25.5152 5.0242 10.0739 12.4683 20.6512 72.4363 1.0041 1.7662 6.1840 18.0699 57.2309 14.0436 30.5026 11.1334 10.9230 0.8358 10.9069 18.3396 23.2948 0.6551 11.2104 87.6633 46.2667 6.3930 10.8209 0.8103 1.2417 1.4345 4.7272 1.3868 1.4223 9.3792 5.3907 4.4875 88.0691 0.3046 8.9524 15.2686 460.3308 32.2662 2.2225 64.6970 1.3911 355.6318 261.7449 8.6481 14.5998 19.1635 26.3425 12.4360 10.0765 61.8474 43.1512 30.2019 19.9117 18.0903 15.9516 71.7476 36.8629 54.0808 68.9441 38.9618 39.8349 151.3308 22.0906 85.4273 60.9926 34.6909 11.7797 31.6091 6.1961 2.4395 29.3757 11.6456 30.4799 8.0679 2.3088 0.9497 2.3066 30.1862 0.2563 0.2995 0.2160 3.0055 0.6402 1.3083 2.4747 6.4393 0.8202 2.0777 1.3185 0.1717 0.5917 2.2954 0.7522 0.3881 0.0799 2.0169 1.8518 1.4240 0.9754 0.9483 0.3077 1.0970 0.0956 1.0407 0.5392 8.7246 3.3851 0.5195 0.3384 0.8027 1.7056 1.3943 0.8854 4.9238 0.0805 0.0883 0.7863 1.1487 0.8053 1.7469 1.2128 1.4264 0.2469 0.6848 0.9940 0.5176 0.9105 4.1604 2.6856 0.6966 5.6588 0.9869 1.5548 0.2004 5.0979 7.3714 1.9328 1.5144 11.0940 1.0085 0.6685 5.3263 1.3434 2.9578 1.5371 1.2691 2.1520 2.9091 6.9812 0.5098 0.9478 0.5894 1.0880 0.6390 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791.06 836.15 877.08 914.16 927.86 975.60 1021.84 1056.69 1110.09 1123.65 1126.34 1144.00 1163.70 1193.57 1223.10 1239.34 1244.66 1252.16 1262.00 1295.94 1312.95 1322.55 1359.95 1378.34 1387.71 1392.57 1401.32 1445.06 1468.85 1482.15 1509.02 1511.94 1521.14 1529.59 1556.01 1561.13 1571.16 1573.19 1595.56 1598.17 1609.53 1623.25 1628.07 1630.43 1636.24 1641.10 1654.66 1671.88 1693.76 1708.69 1710.45 1715.79 1719.18 1734.34 1748.40 1750.64 1760.38 1795.91 1815.23 1855.98 1874.39 1881.81 1884.37 1886.97 1906.47 1933.41 1938.64 1970.12 1981.51 2008.26 2022.52 2025.44 2034.11 2045.72 2071.84 2074.17 2074.67 2084.02 2093.50 2116.20 2127.56 2155.70 2168.63 2173.99 2189.23 2195.55 2201.43 2208.10 2234.66 2242.61 2255.52 2266.95 2272.89 2283.15 2318.95 2334.97 2344.23 2351.84 2354.08 2356.09 2360.66 2363.08 2363.68 2365.81 2379.94 2381.33 2387.09 2401.90 2406.77 2468.80 2554.66 2569.00 2588.61 2607.04 2766.54 2788.45 4533.42 4566.27 4574.30 4575.82 4578.41 4579.49 4582.76 4595.34 4603.57 4615.94 4624.89 4630.03 4639.04 4640.44 4642.24 4645.78 4652.03 4652.67 4659.20 4690.63 4693.76 4698.27 4720.91 4742.29 4743.82 4821.06 4836.68 4854.68 4857.90 4873.44 4896.45 4897.10 4903.80 4924.14 5576.61 0.618084 0.648389 0.649333 0.550025 -1760.371274 -1760.340969 -1760.340025 -1760.439333 3.330807D-04 MUNgauss RevisionA2.0 retrievium 18-Jan-2021 DUDE CCCCNC(=O)[C@@H](c1ccccc1)N(c2cccc(c2)Cl)C(=O)CCC3CCCCC3 C36481635 RHF 6-31G(d) (6D,10F) C1 454.238706 |X|Y|Z| 83.652785 112.505046 33.165411 67.833766 23 6 7 22 1 |36.858105| |12.467146|36.858105| |7.481363|12.455710|36.858105| |4.878073|7.502650|12.495193|36.858105| |3.814258|4.993249|7.781550|13.118633|53.358707| |3.052390|3.839328|5.130876|7.794927|19.275181|36.858105| |2.871186|3.645158|4.499867|6.854277|11.561355|15.823917|73.516695| |2.580487|3.052090|3.931011|5.004927|10.672221|12.407451|14.109739|36.858105| |2.640832|3.072611|4.020377|4.854576|10.367018|8.954872|10.588057|17.657656|0.500000| |2.434182|2.796061|3.531104|4.173391|8.018630|7.532043|10.476336|12.512992|0.250639|36.858105| |2.249002|2.495035|3.098095|3.425184|6.206020|5.110081|7.407718|7.604721|0.206422|13.704067|36.858105| |2.077936|2.256044|2.720317|2.909059|4.928835|3.913888|6.042852|5.023380|0.134591|7.892423|13.758167|36.858105| |2.056346|2.238377|2.652685|2.847165|4.662310|3.734015|6.033024|4.419326|0.112056|6.830648|7.945910|13.754321|36.858105| |2.196089|2.449047|2.911195|3.236380|5.303153|4.426976|7.379587|4.983343|0.117803|7.910717|6.901528|7.955938|13.755590|36.858105| |2.399287|2.761688|3.385691|3.993574|6.996849|6.436700|10.408392|7.454248|0.157308|13.706574|7.961829|6.876085|7.925345|13.751106|36.858105| |2.220163|2.594695|3.155087|3.947492|7.206744|7.719440|12.002652|12.980938|0.259065|7.608336|5.726895|4.175422|3.745707|4.148043|5.654254|53.358707| |1.972096|2.273980|2.674025|3.257965|5.521275|5.564409|9.943050|7.519711|0.160008|6.553643|5.139169|4.092424|3.857944|4.357601|5.695697|18.122791|36.858105| |1.943927|2.260667|2.597045|3.204582|5.144288|5.154206|10.541792|5.710669|0.123471|5.224217|4.063069|3.467119|3.491223|4.146083|5.301885|10.576974|13.735050|36.858105| |1.729912|1.976266|2.218842|2.643410|4.090243|3.806215|7.605198|4.146809|0.095467|4.131378|3.457355|3.140090|3.257535|3.800662|4.408115|6.981133|7.947138|13.751160|36.858105| |1.588179|1.783603|2.000608|2.319279|3.605232|3.239073|6.115430|3.700941|0.088425|3.848766|3.440572|3.217362|3.298969|3.652310|3.990274|6.156698|6.850178|7.910375|13.759068|36.858105| |1.605860|1.793205|2.039090|2.344577|3.737677|3.344738|6.011863|4.096673|0.099618|4.313398|4.034690|3.705480|3.610674|3.805170|4.165774|7.018214|7.965630|6.901256|7.997380|13.780429|36.858105| |1.770732|1.994887|2.317708|2.704907|4.482116|4.141431|7.160766|5.570627|0.132755|5.602800|5.112770|4.285963|3.939795|4.149794|4.887223|10.673785|13.732995|7.929595|6.885867|7.909846|13.787487|36.858105| |1.432987|1.570780|1.767130|1.973242|3.092971|2.638749|4.647690|3.172165|0.081427|3.408328|3.461567|3.375321|3.246715|3.202233|3.276882|5.056191|4.768693|4.228668|4.773589|7.035273|10.919350|7.046834|448.794386| |2.193891|2.563765|3.067055|3.814798|6.608907|6.329508|10.172205|7.959767|0.211005|5.113342|4.305127|3.318190|2.982656|3.213341|4.082592|18.892007|7.755352|5.793263|4.196544|3.753516|4.172187|5.717520|25.848409|36.858105| |2.416501|2.843319|3.460628|4.305622|7.515494|6.506940|9.763191|7.305688|0.226472|4.663243|4.034290|3.122915|2.788215|2.970571|3.719873|11.614303|5.377364|4.405039|3.377519|3.053248|3.335800|4.306969|21.802015|15.834793|73.516695| |1.898030|2.181157|2.504704|3.014154|4.830720|4.350554|7.658269|5.013153|0.132944|3.831799|3.396064|2.784957|2.555581|2.724061|3.287695|10.458106|6.659211|5.470286|4.277725|3.911238|4.293859|5.495013|26.914817|12.540816|14.196757|36.858105| |1.839490|2.093734|2.358821|2.769885|4.262282|3.577709|6.254014|3.874388|0.108862|3.057385|2.802313|2.354726|2.163055|2.272117|2.666284|6.831881|4.351412|3.853786|3.231887|3.014387|3.240245|3.864147|21.895560|7.529740|12.252958|12.463452|36.858105| |1.620421|1.820857|2.002869|2.305707|3.442293|2.844605|5.107965|3.025048|0.083620|2.530027|2.354024|2.043279|1.906179|1.994357|2.280455|5.141764|3.589389|3.349750|2.987737|2.841784|2.986404|3.345475|20.850343|4.868156|7.899040|7.413522|12.409062|36.858105| |1.569529|1.747619|1.891543|2.136962|3.110874|2.482749|4.435409|2.569342|0.072292|2.177748|2.048764|1.800442|1.684578|1.752704|1.979493|4.119307|2.830899|2.684512|2.429513|2.315274|2.408951|2.655192|17.309803|3.782716|6.635371|4.881253|7.561675|12.398547|36.858105| |1.402502|1.546158|1.651449|1.842373|2.649653|2.103143|3.794294|2.168290|0.060449|1.892992|1.795039|1.607451|1.518716|1.575446|1.751070|3.421987|2.434780|2.358038|2.206273|2.130540|2.187485|2.334038|16.088367|2.978684|5.147605|3.725378|4.888039|7.468512|12.443611|36.858105| |1.307892|1.431038|1.536009|1.700880|2.473483|1.969621|3.526106|2.076673|0.057953|1.846127|1.776590|1.603637|1.509873|1.550685|1.705724|3.291491|2.389980|2.286091|2.179571|2.162288|2.249630|2.367218|16.994543|2.798091|4.739673|3.510946|4.324310|6.378598|7.531755|12.450903|36.858105| |1.335571|1.468876|1.592069|1.780263|2.627366|2.133629|3.832396|2.293320|0.063243|2.044164|1.962728|1.766416|1.661717|1.708908|1.885170|3.743515|2.793527|2.654236|2.554135|2.571129|2.696765|2.815769|20.304777|3.158205|5.135342|4.173619|4.852614|7.475467|6.468729|7.554420|12.452114|36.858105| |1.477629|1.638585|1.804081|2.042059|3.075335|2.533525|4.497131|2.784866|0.077215|2.417195|2.309099|2.032525|1.886250|1.942183|2.179621|4.718607|3.444230|3.148108|2.919387|2.915813|3.147109|3.439955|22.928279|4.171643|6.609006|6.045188|7.427041|12.394387|7.568546|6.453861|7.516619|12.433684|36.858105| |17.553098|8.779172|5.459423|4.050439|4.385002|2.680321|4.587675|2.287280|0.064495|2.164658|2.005182|1.869416|1.862707|1.989235|2.153863|2.735937|1.809377|1.800601|1.618565|1.487022|1.494082|1.631932|10.751239|1.996970|3.875943|1.757130|1.714687|1.528550|1.490769|1.342526|1.249901|1.270703|1.394470|0.500000| |17.538816|8.774926|6.780214|4.506694|5.028414|2.980359|4.953900|2.558869|0.072472|2.481341|2.312527|2.167925|2.162803|2.300693|2.473756|2.966481|1.952331|1.921157|1.719673|1.586991|1.606837|1.765758|11.560339|2.117175|4.094064|1.829838|1.754891|1.549932|1.491338|1.338042|1.257448|1.290695|1.426829|0.301696|0.500000| |17.537466|8.774439|6.776468|4.506313|5.027285|2.945178|4.836964|2.545835|0.073906|2.379599|2.232636|2.051604|1.997830|2.101888|2.296357|2.990934|1.934225|1.882231|1.672708|1.546790|1.577543|1.747944|11.367519|2.198361|4.362332|1.900931|1.862364|1.635392|1.594497|1.420226|1.324526|1.346353|1.492266|0.301728|0.301621|0.500000| |8.861858|17.516957|8.861807|6.899974|6.321468|3.753219|6.599594|2.952692|0.080368|2.755504|2.428669|2.222506|2.250441|2.504208|2.808475|3.445911|2.263413|2.294541|2.020468|1.809664|1.797427|1.979379|12.589949|2.464845|4.747568|2.118168|2.011887|1.766450|1.686015|1.502689|1.393140|1.436009|1.593720|0.212886|0.210735|0.172963|0.500000| |8.861926|17.517858|8.856321|6.900115|6.320276|3.684615|6.332898|2.933164|0.082330|2.619312|2.337469|2.098702|2.067650|2.255423|2.558355|3.484398|2.235692|2.229662|1.946078|1.751225|1.757091|1.954689|12.344450|2.594814|5.177728|2.229929|2.177469|1.895235|1.838377|1.621079|1.485364|1.513298|1.685831|0.212873|0.172970|0.210752|0.303907|0.500000| |6.884098|8.864911|17.485770|8.863687|9.662276|4.744122|7.158518|3.864010|0.115412|3.408836|3.086770|2.683592|2.548553|2.722072|3.142883|4.249769|2.602250|2.472095|2.113580|1.929820|1.993465|2.283019|14.003224|3.109479|6.426336|2.529582|2.423078|2.041495|1.943997|1.686490|1.568611|1.616698|1.839513|0.140622|0.169290|0.204253|0.173806|0.212004|0.500000| |6.855874|8.834752|17.521421|8.892849|9.706342|4.908208|7.569688|3.918731|0.110431|3.736375|3.313687|2.963979|2.922996|3.204293|3.655479|4.188277|2.650802|2.565682|2.213126|2.011632|2.055821|2.326190|14.382137|2.897062|5.661842|2.372608|2.202733|1.884483|1.767370|1.555131|1.461920|1.524465|1.722972|0.140209|0.203336|0.168682|0.211499|0.173505|0.303026|0.500000| |4.518861|6.814940|8.834887|17.622695|12.597056|7.250642|13.210432|4.647132|0.118442|4.082147|3.284931|2.857638|2.891684|3.393429|4.180545|5.123748|3.249142|3.324129|2.766279|2.389038|2.366260|2.682475|15.872552|3.530501|6.732517|2.866428|2.595974|2.203238|2.030275|1.772340|1.640898|1.726275|1.962212|0.108185|0.119387|0.110968|0.205352|0.169829|0.173543|0.212717|0.500000| |4.536106|6.870671|8.824977|17.530334|12.387483|6.717591|11.328029|4.532318|0.123842|3.648915|3.049652|2.594099|2.519964|2.827633|3.447484|5.218456|3.153280|3.124289|2.576932|2.252558|2.268246|2.610249|15.337875|3.924153|8.107771|3.150643|2.975351|2.464517|2.310862|1.974212|1.795205|1.862282|2.137211|0.108703|0.111280|0.119560|0.171656|0.207564|0.210732|0.173646|0.303384|0.500000| |3.775874|4.672142|7.337348|9.059598|26.064506|9.480082|10.940840|7.534545|0.243646|5.738983|4.807442|3.744799|3.398744|3.686252|4.679053|6.898124|3.814209|3.419244|2.766223|2.504366|2.653981|3.209484|17.992078|4.782881|10.133068|3.476464|3.126774|2.506531|2.282484|1.936228|1.817328|1.922151|2.259721|0.087636|0.102021|0.105578|0.115763|0.121018|0.216994|0.191069|0.181293|0.200883|0.500000| |2.206781|2.427448|3.011942|3.284021|5.932928|4.723452|6.770281|7.106486|0.227266|8.910962|17.696633|8.937138|5.653065|4.965185|5.653380|7.701669|4.787850|3.699240|3.148680|3.166288|3.780165|4.877109|26.837642|4.527759|7.740467|3.545117|2.973573|2.465744|2.152031|1.869770|1.857028|2.045437|2.432631|0.054628|0.062489|0.061810|0.064596|0.063858|0.085859|0.087843|0.085146|0.082930|0.134142|0.500000| |1.941672|2.071499|2.462301|2.574053|4.253092|3.287535|5.129538|4.106189|0.115069|5.628867|8.924915|17.716332|8.907060|5.650200|4.953548|4.849977|3.486839|2.974456|2.750165|2.872977|3.330879|3.761713|25.759132|2.961607|5.018956|2.545916|2.198454|1.928108|1.714374|1.539921|1.547726|1.698064|1.940845|0.048747|0.056333|0.053724|0.056344|0.053756|0.068460|0.074183|0.069652|0.064614|0.091342|0.215993|0.500000| |1.910306|2.047010|2.374113|2.498301|3.955288|3.100630|5.118458|3.537050|0.091647|4.929883|5.647390|8.909759|17.716157|8.909368|5.639422|4.229904|3.234927|3.001799|2.893942|2.978586|3.210769|3.362713|24.236677|2.561115|4.287162|2.251052|1.937647|1.734083|1.545950|1.407771|1.405636|1.541246|1.727977|0.048467|0.056118|0.051538|0.057397|0.052559|0.063462|0.072701|0.070788|0.062010|0.080291|0.124258|0.214511|0.500000| |2.121425|2.355708|2.726462|3.006678|4.696146|3.857321|6.747812|4.065789|0.097311|5.638696|4.966757|5.652189|8.915506|17.716669|8.935299|4.807526|3.786935|3.820333|3.653648|3.479133|3.462414|3.600487|23.730745|2.830695|4.672657|2.463897|2.081696|1.856129|1.642476|1.490554|1.465458|1.609698|1.806081|0.053927|0.061989|0.055838|0.068047|0.060197|0.069926|0.083359|0.089781|0.073448|0.089362|0.107730|0.124133|0.214749|0.500000| |2.478340|2.919644|3.531208|4.355043|7.331551|7.126841|13.099031|6.882828|0.141961|8.911039|5.655244|4.955934|5.647593|8.934267|17.746834|7.528034|5.669827|5.916203|4.794095|4.045620|3.979304|4.542785|24.587148|4.094982|6.618282|3.333062|2.702005|2.320564|2.014788|1.783565|1.720017|1.896720|2.182358|0.062154|0.070382|0.065001|0.084158|0.075440|0.088634|0.104101|0.133317|0.104455|0.127755|0.124185|0.107573|0.124211|0.216138|0.500000| |2.098290|2.489010|2.851459|3.644272|5.728576|5.927506|13.811029|5.741206|0.123126|4.950885|3.754855|3.197704|3.249254|3.932620|5.141605|9.750759|8.961141|17.763482|8.872519|5.627475|4.970569|5.656735|27.420915|5.751004|8.137148|5.218893|3.836636|3.299752|2.697389|2.354072|2.231185|2.535286|2.980443|0.054005|0.057184|0.055994|0.070769|0.068570|0.074251|0.077200|0.107249|0.099715|0.101911|0.095305|0.076336|0.077968|0.102488|0.172121|0.500000| |1.686980|1.927312|2.127019|2.524155|3.785613|3.439170|7.066860|3.544786|0.083038|3.528714|2.979734|2.763105|2.922072|3.432664|3.877440|5.659444|5.652147|8.929531|17.723981|8.943605|5.675705|4.959196|31.612574|3.572440|5.308104|3.665398|2.906753|2.749314|2.284479|2.106120|2.065202|2.388190|2.657927|0.044173|0.046542|0.045037|0.055303|0.052847|0.055822|0.058822|0.074561|0.068711|0.070536|0.075585|0.067886|0.073529|0.095088|0.120755|0.213842|0.500000| |1.471409|1.638084|1.814069|2.072260|3.159465|2.761543|5.212337|3.074763|0.075180|3.228006|2.964491|2.861290|2.977899|3.244520|3.398347|4.906364|4.942558|5.628216|8.882235|17.747942|8.926458|5.639814|53.781164|3.110570|4.641118|3.274185|2.639588|2.556228|2.123474|1.993620|2.040525|2.414749|2.655725|0.038499|0.040926|0.039775|0.046325|0.044689|0.048600|0.050789|0.059509|0.056014|0.061215|0.076257|0.072349|0.076844|0.088263|0.095745|0.123641|0.214551|0.500000| |1.756002|1.958353|2.288836|2.621482|4.384645|3.907816|6.461623|5.463386|0.140169|5.525194|5.599492|4.592804|3.952420|3.924937|4.500303|9.822164|8.915532|5.645043|4.961970|5.637333|8.918379|17.759136|53.820204|5.601624|7.776168|5.251936|3.852870|3.294141|2.646180|2.313756|2.371984|2.803366|3.463206|0.044805|0.048710|0.048582|0.053408|0.053244|0.063597|0.063971|0.070900|0.070179|0.089945|0.159044|0.115368|0.093891|0.093035|0.111901|0.124458|0.107685|0.124178|0.500000| |1.762143|1.995677|2.286243|2.687380|4.319862|3.835548|6.657708|4.653065|0.124273|3.791766|3.487772|2.889486|2.624060|2.744006|3.240973|9.615147|6.931019|5.335023|4.404844|4.302327|5.028638|6.574083|31.756339|8.953376|10.919146|17.583045|8.766284|6.648315|4.425428|3.552953|3.550707|4.433060|6.622517|0.045379|0.047616|0.049075|0.053974|0.056115|0.064214|0.061133|0.071505|0.076410|0.087525|0.102071|0.074096|0.064431|0.068634|0.089062|0.131221|0.102119|0.099346|0.180822|0.500000| |1.865767|2.158492|2.444612|2.978205|4.652202|4.270319|8.045085|4.633122|0.116762|3.656199|3.157873|2.646830|2.497975|2.721241|3.286888|9.380440|6.867332|6.471245|5.002866|4.319242|4.443193|5.362885|26.881082|8.962487|11.086772|17.538732|8.816550|6.851686|4.587009|3.664184|3.406359|4.082297|5.498064|0.048286|0.049963|0.051376|0.059036|0.061391|0.067342|0.064346|0.080682|0.086752|0.090175|0.088574|0.066697|0.061403|0.069486|0.095444|0.175813|0.120219|0.099756|0.132059|0.305716|0.500000| |1.974957|2.274629|2.549200|3.032295|4.564866|3.771551|6.665527|3.849238|0.108219|2.985313|2.691190|2.263435|2.098058|2.226905|2.630437|6.442397|3.988636|3.670133|3.046709|2.771055|2.905536|3.425851|19.589977|7.061388|13.060624|8.923216|17.573719|8.861699|7.159940|4.629550|3.853186|4.061216|5.465734|0.051177|0.051775|0.055563|0.060449|0.066684|0.072820|0.064960|0.078244|0.093182|0.092141|0.078591|0.058433|0.052220|0.056989|0.075161|0.106141|0.077666|0.067840|0.093626|0.173692|0.209960|0.500000| |1.832143|2.060948|2.336725|2.684999|4.172107|3.400862|5.731814|3.785335|0.111370|3.014083|2.846841|2.383625|2.151346|2.219070|2.578302|6.397133|3.967159|3.403894|2.892070|2.767330|3.049406|3.667772|21.269630|6.844176|12.235626|8.863740|17.535973|8.826934|6.808018|4.524479|4.173170|4.532807|6.830347|0.047264|0.048631|0.052051|0.054446|0.059342|0.067809|0.060813|0.068889|0.079430|0.087497|0.086169|0.062575|0.053618|0.056081|0.071196|0.092898|0.072067|0.067814|0.106253|0.211561|0.173440|0.305369|0.500000| |1.606988|1.816398|1.982475|2.304300|3.399883|2.845282|5.263927|2.959443|0.079705|2.494761|2.283717|1.997122|1.891630|2.004665|2.295387|5.047107|3.655302|3.578561|3.229543|3.005400|3.053464|3.339373|20.916201|4.603949|7.287013|6.934642|8.895461|17.453112|8.920951|6.848000|5.697706|6.845629|8.906257|0.042280|0.042703|0.044689|0.049424|0.052555|0.055424|0.051828|0.062077|0.068537|0.067556|0.065258|0.051984|0.047870|0.052284|0.065863|0.099138|0.083849|0.075329|0.088343|0.168835|0.210720|0.211252|0.173945|0.500000| |1.657168|1.857930|1.996380|2.267922|3.248727|2.571809|4.633773|2.586965|0.072626|2.170718|2.018434|1.770530|1.665888|1.747074|1.984053|4.077394|2.759948|2.660318|2.382127|2.227490|2.287102|2.527514|16.243660|3.762598|6.805861|4.626777|6.975928|8.820466|17.526915|8.828030|5.491777|4.845546|5.504811|0.043828|0.043407|0.046742|0.049720|0.054879|0.056946|0.051267|0.059715|0.069280|0.065777|0.058542|0.046603|0.042415|0.045620|0.056625|0.075992|0.062847|0.056690|0.069323|0.111402|0.124071|0.218635|0.168812|0.215403|0.500000| |1.571321|1.735893|1.886943|2.104818|3.081993|2.423303|4.241093|2.538878|0.072943|2.155895|2.058636|1.806360|1.673104|1.722750|1.937592|4.004799|2.702066|2.507149|2.262929|2.182640|2.309118|2.569555|16.848072|3.681141|6.652611|4.532507|6.980513|8.847581|17.482800|8.854597|6.785880|5.680179|6.814024|0.041346|0.041488|0.044690|0.046151|0.050649|0.054485|0.049022|0.054973|0.062979|0.063791|0.060866|0.048131|0.042685|0.044626|0.054203|0.069520|0.058719|0.055622|0.072667|0.117021|0.112707|0.180478|0.206347|0.174385|0.303525|0.500000| |1.390331|1.538992|1.634190|1.833883|2.616958|2.090726|3.832912|2.129375|0.058550|1.866361|1.752875|1.576010|1.503249|1.571766|1.747309|3.365815|2.433619|2.413008|2.279355|2.178913|2.194990|2.311970|15.997525|2.889053|4.929843|3.616573|4.508294|6.732368|8.852140|17.493512|8.858248|6.797876|5.665996|0.037091|0.036844|0.038874|0.041836|0.044857|0.045961|0.042749|0.049471|0.054660|0.052558|0.050188|0.041743|0.038748|0.041556|0.049871|0.067399|0.061190|0.056917|0.062631|0.094898|0.103257|0.121543|0.110919|0.201925|0.214875|0.173752|0.500000| |1.367103|1.497528|1.586493|1.750990|2.492023|1.948571|3.501206|1.990664|0.055886|1.747793|1.665489|1.499176|1.417777|1.466436|1.621161|3.074289|2.169259|2.104414|1.971879|1.904399|1.952785|2.080330|14.492831|2.649063|4.681854|3.171076|4.075538|5.463877|8.825407|17.529325|8.812230|5.496473|4.839436|0.036495|0.036136|0.038588|0.040322|0.043788|0.045176|0.041415|0.046675|0.052266|0.050778|0.048242|0.040054|0.036647|0.038638|0.045828|0.058742|0.052604|0.049769|0.057584|0.083805|0.086164|0.111526|0.108714|0.140348|0.212685|0.214993|0.303460|0.500000| |1.224192|1.333169|1.420264|1.563215|2.255041|1.787304|3.215759|1.871376|0.052000|1.685746|1.625681|1.482750|1.405650|1.442878|1.573868|2.928406|2.150629|2.084802|2.018661|2.010794|2.069454|2.140804|15.826706|2.435577|4.132889|2.975418|3.502096|4.797410|5.486706|8.810075|17.529010|8.814245|5.481196|0.032638|0.032745|0.034375|0.036183|0.038402|0.040156|0.037658|0.042130|0.045701|0.045900|0.046924|0.039855|0.036567|0.038111|0.044158|0.056600|0.053708|0.053395|0.059304|0.083802|0.081742|0.089052|0.093715|0.127500|0.123212|0.139294|0.214878|0.211343|0.500000| |1.299429|1.413557|1.521176|1.670156|2.437582|1.922877|3.397661|2.043545|0.057780|1.820431|1.772139|1.599614|1.494434|1.521940|1.668543|3.204919|2.295728|2.160384|2.048030|2.047007|2.161001|2.294662|16.538783|2.727117|4.690361|3.337829|4.142668|5.612746|6.779708|8.855453|17.492994|8.855617|6.766765|0.034438|0.034725|0.036744|0.038028|0.040706|0.043459|0.040264|0.044462|0.048840|0.050231|0.051943|0.043164|0.038687|0.039802|0.046375|0.058407|0.053581|0.053579|0.064964|0.094709|0.087278|0.102217|0.117671|0.131665|0.139399|0.199719|0.173817|0.214779|0.303287|0.500000| |1.322152|1.459362|1.573998|1.769844|2.594531|2.122213|3.874260|2.253699|0.061211|2.018639|1.916590|1.733274|1.649219|1.711514|1.887744|3.687339|2.813415|2.752352|2.693849|2.689397|2.745963|2.807532|20.412218|3.060690|4.918773|4.045796|4.479531|6.738856|5.676386|6.799473|8.860198|17.493845|8.853558|0.035040|0.035504|0.036820|0.039889|0.041768|0.044044|0.041885|0.048114|0.051445|0.052176|0.054791|0.046022|0.042547|0.045088|0.053253|0.073259|0.070890|0.070738|0.075805|0.117411|0.116158|0.107421|0.111094|0.201884|0.126922|0.131428|0.200197|0.139485|0.214981|0.173833|0.500000| |1.265828|1.382871|1.499357|1.662426|2.460422|1.990111|3.552293|2.161828|0.059765|1.962273|1.910042|1.736328|1.630990|1.661887|1.812722|3.493997|2.639989|2.490105|2.437066|2.514489|2.667758|2.739293|20.796710|2.870871|4.665493|3.663125|4.039870|5.467559|4.847614|5.496557|8.813455|17.529708|8.827064|0.033458|0.034139|0.035465|0.037581|0.039359|0.042313|0.040154|0.044853|0.047877|0.050215|0.055387|0.046722|0.042253|0.043508|0.050260|0.065244|0.063148|0.066387|0.076658|0.111892|0.098647|0.094799|0.108943|0.140296|0.106714|0.127081|0.139478|0.123202|0.211529|0.214747|0.303530|0.500000| |1.475465|1.624690|1.796686|2.010434|3.046544|2.473289|4.298423|2.757793|0.078293|2.400540|2.338601|2.054602|1.881361|1.911646|2.134429|4.580916|3.251939|2.893591|2.665506|2.694225|2.976705|3.307196|22.244751|4.057202|6.627377|5.474685|6.873538|8.849151|6.814976|5.667954|6.770950|8.847189|17.476881|0.038577|0.039616|0.041663|0.043594|0.046346|0.051392|0.047748|0.053150|0.058229|0.063133|0.069642|0.055033|0.047919|0.049083|0.058627|0.076000|0.067100|0.068241|0.095899|0.169826|0.130081|0.141993|0.207351|0.174260|0.139793|0.200978|0.131223|0.126857|0.139113|0.199167|0.173721|0.214899|0.500000| 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