Version2.1 2021-01-20T05:25:07Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 05-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCC[C@H](C)C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)NCc3cccc(c3)n4cccc4 C39694037 RHF 6-31G(d) (6D,7F) CCC[C@H](C)C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)NCc3cccc(c3)n4cccc4 C01[X(C26H37N4O2)] 201 C1 554 CCC[C@@H](C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)NCc1cccc(c1)n1cccc1)C CCC[C@@H](C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)NCc1cccc(c1)n1cccc1)C CCC[C@H](C)C(=O)N1C[C@@H](C(=O)NCc2cccc(c2)n3cccc3)C4(CC[NH2+]CC4)C1 InChIKey=VUQUTWWYLVVDIQ-REWPJTCUSA-O InChI=1S/C26H36N4O2/c1-3-7-20(2)25(32)30-18-23(26(19-30)10-12-27-13-11-26)24(31)28-17-21-8-6-9-22(16-21)29-14-4-5-15-29/h4-6,8-9,14-16,20,23,27H,3,7,10-13,17-19H2,1-2H3,(H,28,31)/p+1/t20-,23-/m0/s1 InChI=1/C26H36N4O2/c1-3-7-20(2)25(32)30-18-23(26(19-30)10-12-27-13-11-26)24(31)28-17-21-8-6-9-22(16-21)29-14-4-5-15-29/h4-6,8-9,14-16,20,23,27H,3,7,10-13,17-19H2,1-2H3,(H,28,31)/p+1/t20-,23-/m0/s1/fC26H37N4O2/h27-28H/q+1 CCC[C@H](C)C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)NCc3cccc(c3)n4cccc4 C01[X(C26H37N4O2)] 201 C01 554 CCC[C@@H](C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)NCc1cccc(c1)n1cccc1)C CCC[C@@H](C(=O)N1C[C@H](C2(C1)CC[NH2]CC2)C(=O)NC[C]1[CH][CH][CH][C]([CH]1)[N@@]1[CH]=[CH][CH]=[CH]1)C CCC[C@H](C)C(=O)N1C[C@@H](C(=O)NC[C]2[CH][CH][CH][C]([CH]2)n3cccc3)C4(CC[NH2]CC4)C1 InChIKey=RGFBSTCYSBSWJM-REWPJTCUSA-N InChI=1S/C26H37N4O2/c1-3-7-20(2)25(32)30-18-23(26(19-30)10-12-27-13-11-26)24(31)28-17-21-8-6-9-22(16-21)29-14-4-5-15-29/h4-6,8-9,14-16,20,23H,3,7,10-13,17-19,27H2,1-2H3,(H,28,31)/t20-,23-/m0/s1 InChI=1/C26H37N4O2/c1-3-7-20(2)25(32)30-18-23(26(19-30)10-12-27-13-11-26)24(31)28-17-21-8-6-9-22(16-21)29-14-4-5-15-29/h4-6,8-9,14-16,20,23H,3,7,10-13,17-19,27H2,1-2H3,(H,28,31)/t20-,23-/m0/s1/f/h28H 3415.5218835724 -1373.4776161 1-A 16505.8598 118 436 554 |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| -20.63756 -20.60120 -15.84148 -15.73382 -15.70034 -15.67783 -11.46023 -11.44217 -11.43501 -11.42287 -11.38663 -11.38627 -11.38190 -11.37545 -11.37069 -11.36872 -11.36861 -11.36773 -11.36710 -11.36697 -11.34742 -11.33773 -11.33477 -11.33352 -11.32921 -11.32872 -11.32708 -11.31124 -11.29557 -11.28431 -11.27791 -11.27126 -1.50824 -1.48139 -1.47368 -1.43235 -1.36078 -1.34904 -1.26815 -1.25157 -1.20323 -1.19243 -1.17114 -1.16313 -1.13905 -1.10719 -1.10472 -1.09887 -1.08960 -1.05449 -1.03525 -1.02935 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2.5513 1.3023 1.7276 1.7830 2.0184 2.4493 2.2433 2.1810 1.5099 1.4096 2.0869 1.9436 2.0513 1.3997 1.1285 1.9700 1.3209 2.2776 1.3683 1.6870 2.0821 1.2853 1.1947 1.3524 1.4233 1.2541 1.4185 1.8249 1.2704 1.5622 2.5356 1.4402 1.3056 1.3690 1.5160 1.5519 1.6267 1.7255 3.0323 1.3744 1.2569 1.5189 1.2976 1.3008 1.4836 2.3366 1.3716 2.5865 1.1111 1.1109 1.0805 1.0873 1.0639 1.0939 1.0443 1.0572 1.0595 2.5714 1.0904 1.0882 2.3763 1.2088 1.1608 1.7707 3.8943 5.5954 1.1537 4.4579 10.9361 9.3092 1.0697 1.0758 1.0665 1.0408 1.0850 1.0442 1.0848 1.0830 1.0632 1.0848 1.0652 1.0795 1.0637 1.1029 1.1019 1.0733 1.0641 1.0901 1.0993 1.1054 1.1037 1.1029 1.1039 1.0920 1.1113 1.1098 1.0900 1.0927 1.0977 1.0907 1.0896 1.0961 1.1005 1.1054 1.0622 1.0896 1.0796 0.0003 0.0007 0.0010 0.0031 0.0044 0.0052 0.0066 0.0067 0.0123 0.0151 0.0167 0.0170 0.0359 0.0393 0.0547 0.0515 0.0586 0.0793 0.0924 0.0875 0.0805 0.0505 0.1056 0.0688 0.0812 0.0967 0.1183 0.1580 0.3006 0.1910 0.2308 0.3547 0.1731 0.3979 0.2924 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6.9409 6.9564 6.7818 6.7601 6.9338 6.9956 7.0820 7.1177 7.1277 7.1434 7.0903 7.2882 7.3162 7.2994 7.3821 7.4790 7.5116 7.5097 7.6075 7.7466 7.8021 8.3421 8.9058 9.6294 0.7072 1.3635 0.6866 6.6420 2.6018 1.0413 1.1864 1.7604 1.8948 7.4696 2.6931 0.2952 0.2213 9.6007 7.0759 10.8196 3.6581 7.9934 0.1788 5.0427 1.2049 3.7455 9.9065 0.0851 0.8236 0.0834 2.9302 6.6255 5.1687 9.1443 15.2465 5.0437 3.9943 0.4964 3.0343 41.5816 38.8039 3.8501 4.7595 1.9105 13.7168 17.3200 2.6409 0.1368 14.5778 0.9579 6.6327 5.5270 2.8259 11.1652 17.0891 9.3767 14.4985 6.9362 1.8602 9.7225 12.8880 0.7750 16.1201 130.7082 8.5508 2.8788 2.2025 33.2280 2.4517 12.7038 6.1705 2.1065 0.3094 2.5491 1.1008 10.4243 7.5698 1.0567 0.0937 0.7005 5.4483 17.3095 8.2287 5.9989 1.4381 2.3474 3.1526 15.6347 0.5479 0.8913 3.3263 2.5201 8.6825 3.8508 6.5857 1.1715 2.5747 44.0801 7.9486 6.0665 15.5838 11.6954 5.4801 11.0453 4.6563 14.6911 7.8374 5.0805 34.3938 1.3232 15.5597 2.3244 3.3887 97.3993 53.4462 85.3561 0.8342 1.6930 43.2980 19.0218 11.3924 1.1913 18.4385 23.1347 45.5733 12.1945 5.1193 141.1420 38.9289 19.8701 12.1107 1.5529 0.4122 55.0932 3.2501 36.5040 7.5624 2.8818 10.7150 9.6506 62.3142 1.4199 8.5278 272.2123 41.5860 8.3350 4.8712 8.5970 5.3187 3.8178 5.2372 6.5798 8.3498 4.3747 5.6500 16.0752 6.5198 18.1035 117.3038 13.5477 82.3937 235.4059 2.5941 42.5461 112.8110 67.5546 309.0278 185.4065 44.4176 37.6112 34.0836 25.7089 18.7490 26.4180 1.9287 10.5974 14.4874 11.1695 29.5139 34.6520 2.4907 102.9455 45.3402 2.9487 4.0624 25.0618 49.1617 7.0402 5.5320 7.5609 19.9119 19.7028 5.4259 6.8474 2.9309 10.2209 7.9184 6.8505 9.5329 0.5484 0.0323 0.4910 188.2979 101.6333 48.1429 0.5865 2.5569 1.7998 0.2256 1.1323 1.0992 0.7523 0.4512 3.7918 0.9354 2.7130 0.1732 1.6876 3.2586 0.8160 0.4740 0.6892 1.2299 2.5123 0.9722 0.5940 0.3143 1.6859 1.1212 1.2007 0.6067 2.2490 0.8077 2.3239 0.7316 1.4503 0.6009 0.7119 4.4433 1.0791 1.7009 1.3153 2.0667 0.8670 0.7723 1.0123 1.1990 1.3482 1.3754 1.6134 0.5720 0.8123 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44.4446 31.2315 49.9907 39.2866 50.1572 39.4662 63.5618 79.5652 184.0922 91.1888 70.1091 93.9898 7.8972 112.5652 91.4148 45.3818 41.1896 0.7292 0.7338 0.7398 0.6017 0.7387 0.7451 0.6870 0.6426 0.7045 0.7496 0.7490 0.5965 0.7118 0.7450 0.6924 0.6933 0.5650 0.6962 0.7500 0.5304 0.1345 0.7302 0.3989 0.4608 0.7120 0.0354 0.2266 0.2456 0.6797 0.6800 0.1717 0.2997 0.2205 0.1691 0.7378 0.5075 0.4810 0.7352 0.7435 0.7458 0.5181 0.5627 0.5215 0.1147 0.3478 0.5627 0.7496 0.6879 0.7255 0.3074 0.3500 0.1823 0.7496 0.2078 0.2565 0.3715 0.0425 0.3297 0.1240 0.2970 0.3977 0.6912 0.1808 0.1954 0.0556 0.2917 0.7455 0.7010 0.7495 0.2540 0.7493 0.5165 0.3375 0.4648 0.7334 0.7500 0.3645 0.2563 0.5666 0.2041 0.5934 0.0907 0.5383 0.4101 0.4889 0.1982 0.6816 0.7396 0.6606 0.6159 0.7369 0.7492 0.7230 0.3813 0.3132 0.7468 0.6989 0.2361 0.2964 0.7482 0.5074 0.4130 0.7425 0.7225 0.7483 0.3330 0.6314 0.1610 0.6900 0.6229 0.6686 0.7477 0.5342 0.4789 0.5224 0.1734 0.3650 0.7070 0.4787 0.7432 0.3910 0.2025 0.7408 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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 61 62 63 64 65 66 67 68 69 6 6 6 6 1 6 6 8 7 6 6 1 6 6 6 6 7 1 1 6 6 6 8 7 6 6 6 6 6 6 6 7 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 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 1.00783 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 8409.5496 23315.5003 26295.4214 0.99987 -0.01298 0.00915 0.01314 0.99976 -0.01755 -0.00892 0.01767 0.99980 1 0.01030 0.00371 0.00329 0.21461 0.07741 0.06863 16.04 22.43 28.28 49.92 57.03 61.23 86.87 99.93 109.23 121.46 128.04 150.42 176.36 182.42 204.95 211.22 263.29 269.62 286.64 307.17 330.41 346.39 358.49 380.49 387.71 392.38 405.01 436.31 481.66 485.31 493.93 517.93 533.47 545.80 556.54 610.74 634.92 657.84 687.43 707.66 711.36 722.99 755.75 823.67 877.08 900.71 955.43 974.64 980.75 998.93 1048.66 1067.04 1114.35 1122.55 1155.65 1188.21 1194.59 1208.73 1229.35 1236.23 1245.94 1269.16 1278.28 1291.31 1324.95 1332.64 1337.30 1370.09 1376.48 1377.91 1394.75 1418.76 1425.93 1440.50 1451.44 1476.82 1496.59 1506.65 1521.59 1535.76 1566.96 1570.98 1577.97 1580.27 1600.40 1613.16 1613.70 1617.95 1623.18 1633.25 1648.85 1658.50 1666.28 1684.46 1700.03 1714.55 1728.50 1746.44 1757.75 1763.56 1773.66 1779.27 1789.12 1843.00 1870.84 1880.09 1896.48 1905.58 1917.77 1923.72 1938.69 1976.90 1984.74 2011.26 2025.39 2044.33 2046.22 2071.57 2080.11 2089.93 2092.74 2093.49 2097.52 2104.60 2119.60 2122.29 2139.59 2156.91 2181.44 2201.21 2208.38 2226.12 2226.73 2230.94 2243.81 2245.81 2254.58 2256.03 2263.58 2286.71 2294.57 2323.25 2331.24 2344.63 2350.09 2355.27 2359.31 2364.36 2365.03 2366.86 2372.02 2381.57 2382.64 2386.56 2413.74 2414.76 2431.61 2439.66 2457.93 2578.97 2608.17 2615.39 2775.13 2809.21 4568.72 4587.13 4596.84 4606.23 4625.82 4636.14 4645.75 4659.30 4664.65 4670.02 4670.34 4679.55 4693.76 4702.23 4709.67 4711.85 4724.46 4727.40 4728.53 4744.53 4760.12 4765.06 4768.31 4776.36 4800.29 4812.65 4850.62 4871.91 4892.67 4919.03 4920.91 4938.17 4973.19 4979.74 5252.86 5358.91 5597.96 0.653477 0.682704 0.683648 0.589641 -1372.824139 -1372.794912 -1372.793968 -1372.887975 3.153010D-04 MUNgauss RevisionA2.0 retrievium 20-Jan-2021 DUDE CCC[C@H](C)C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)NCc3cccc(c3)n4cccc4 C39694037 RHF 6-31G(d) (6D,10F) C1 437.291652 |X|Y|Z| 57.445008 41.490366 107.165393 63.448015 24 6 7 20 4 |36.858105| |12.462467|36.858105| |7.501709|12.444901|36.858105| |4.839220|7.367912|12.336658|36.858105| |4.562074|6.864799|8.874368|17.563587|0.500000| |4.157287|6.021368|7.417587|12.433538|0.247260|36.858105| |3.805870|4.913251|7.694553|12.518145|0.246489|7.643587|36.858105| |3.424615|4.188437|6.139604|7.989857|0.163928|6.721378|15.836275|73.516695| |3.355090|4.104998|5.749978|7.679547|0.205410|5.209750|13.959877|15.228676|53.358707| |3.319875|4.031496|5.119585|6.366376|0.208740|4.437543|7.511418|9.398598|17.802234|36.858105| |2.700957|3.085040|3.721928|4.267286|0.130093|3.327905|5.149772|7.462489|11.008164|12.385301|36.858105| |2.418277|2.774334|3.272011|3.865977|0.118272|3.176234|4.611169|6.905416|9.132414|8.861203|17.533627|0.500000| |2.603496|2.900849|3.610675|3.993430|0.112022|3.170814|5.266227|8.268525|11.022086|7.769113|12.188683|0.246693|36.858105| |2.772822|3.197140|4.196493|4.989967|0.131881|3.936167|7.848513|12.614681|17.952964|7.900812|8.012695|0.195263|12.377832|36.858105| |2.153419|2.353926|2.811302|3.082223|0.086315|2.609343|3.868525|6.496093|7.000213|5.001705|7.401869|0.201506|12.388793|7.466223|36.858105| |2.021301|2.166821|2.582498|2.752336|0.074755|2.387589|3.445864|6.140508|5.730247|3.830259|4.830260|0.129067|7.454585|6.017456|12.490155|36.858105| |2.108968|2.205840|2.620698|2.671976|0.072069|2.289013|3.265829|5.802259|5.285959|3.588958|4.340983|0.108818|6.454517|5.098957|7.688929|12.711661|53.358707| |1.985006|2.055502|2.420023|2.444271|0.065285|2.135561|2.950028|5.375306|4.579932|3.070881|3.554168|0.091074|4.913902|4.279980|5.679827|9.208429|25.704933|0.500000| |2.016528|2.091270|2.435504|2.465462|0.067567|2.116737|2.923331|5.092053|4.730173|3.375866|4.177060|0.104951|5.719516|4.320153|6.965652|9.186329|25.605003|0.332274|0.500000| |2.512434|2.618282|3.207250|3.174622|0.084270|2.622761|3.948976|6.927595|6.423774|4.228854|4.824438|0.112960|7.434899|6.015350|6.493782|7.612322|17.255448|0.255443|0.253794|36.858105| |2.785998|2.975873|3.690561|3.723133|0.102213|2.930961|4.639794|7.471464|8.424421|6.018223|7.383677|0.152509|12.323902|7.486806|7.588142|6.492873|10.444708|0.157623|0.192452|12.499185|36.858105| |2.594152|2.858070|3.265190|3.498160|0.107925|2.796444|3.860789|5.783163|7.074164|7.502447|12.482335|0.246057|7.314702|5.042041|5.715295|4.074843|5.376071|0.090800|0.113014|4.310981|6.422344|36.858105| |2.866708|3.086954|3.466234|3.518611|0.108427|2.771190|3.726844|5.570383|6.478583|6.645572|7.999548|0.164202|5.889460|4.397311|4.555997|3.566855|5.010467|0.086196|0.106033|4.222757|6.241837|15.878603|73.516695| |2.200284|2.393251|2.662124|2.857850|0.087224|2.393877|3.120714|4.851355|5.416637|5.157488|7.773637|0.207883|5.587477|4.063402|5.328311|3.842879|4.937712|0.084752|0.107313|3.661712|4.866030|14.075098|15.150897|53.358707| |2.042299|2.168133|2.341583|2.439813|0.073972|2.082135|2.583850|4.086726|4.255879|3.870315|4.989582|0.132546|4.061378|3.149938|3.979267|3.160666|4.245269|0.074976|0.094708|3.127442|3.907309|7.791485|12.314863|17.818891|36.858105| |1.980721|2.053516|2.222577|2.253782|0.066718|1.927453|2.406228|3.878240|3.899952|3.370697|4.234964|0.108405|3.849377|2.958447|3.860801|3.240652|4.598673|0.081452|0.107218|3.345497|4.034174|6.067267|10.810734|10.439812|12.531014|36.858105| |1.917118|1.949329|2.065798|2.052912|0.060562|1.772434|2.144980|3.479992|3.374046|2.868462|3.366357|0.086247|3.110749|2.509700|3.059917|2.692764|3.905124|0.071197|0.090012|2.893256|3.359501|4.520748|8.742490|6.971284|7.533973|13.724328|36.858105| |1.821949|1.823194|1.931424|1.892763|0.054956|1.646608|1.984875|3.270413|3.072330|2.525472|2.905242|0.074339|2.822360|2.313551|2.812254|2.586799|3.871891|0.071960|0.090575|2.845118|3.149567|3.655640|7.076280|5.354857|5.008332|7.917134|13.751859|36.858105| |1.787912|1.789197|1.924938|1.887036|0.054071|1.642760|2.016350|3.363153|3.128910|2.508281|2.927084|0.074735|2.984945|2.419880|3.059226|2.903384|4.490900|0.083808|0.109113|3.203784|3.411612|3.549408|6.681820|5.124607|4.411806|6.808477|7.903696|13.745597|36.858105| |1.841733|1.871171|2.052773|2.041969|0.058388|1.765566|2.231564|3.722767|3.539772|2.828417|3.452562|0.087928|3.626538|2.818602|3.866633|3.634994|5.668508|0.102382|0.145591|3.866412|4.139926|4.178388|7.507220|6.137909|5.006673|7.902722|6.895200|7.991665|13.766000|36.858105| |1.933973|2.001960|2.208682|2.240365|0.065049|1.918436|2.458677|4.028919|4.010757|3.324947|4.299464|0.109612|4.290499|3.186260|4.588992|3.939663|5.754762|0.099956|0.142823|3.970157|4.625846|5.616796|9.535546|9.024438|7.544327|13.765666|7.994693|6.927791|7.933967|13.760450|36.858105| |1.773425|1.799955|1.997278|1.987778|0.055919|1.731980|2.210542|3.763041|3.477218|2.670595|3.230880|0.082991|3.624679|2.858635|4.047998|4.139871|6.843092|0.126906|0.190184|4.301514|4.189832|3.621800|6.356907|5.140075|3.859043|5.154527|4.552528|5.152115|7.798613|13.381428|7.884640|53.358707| |1.807038|1.808862|2.011670|1.966757|0.054573|1.716410|2.187550|3.772899|3.374636|2.526426|2.941840|0.074659|3.387975|2.767155|3.637720|3.940695|7.055842|0.138989|0.190203|4.582850|4.117957|3.189548|5.759798|4.308714|3.171722|4.011748|3.747966|4.326697|6.164260|7.680798|5.359012|18.958183|36.858105| |1.694981|1.704862|1.906139|1.879248|0.051631|1.661297|2.113409|3.715022|3.225372|2.351210|2.715892|0.070246|3.207701|2.702303|3.575921|4.173834|7.531270|0.163115|0.197528|4.475058|3.754911|2.818013|4.963764|3.813670|2.735046|3.271748|3.019756|3.349686|4.381552|5.302491|4.219188|11.689525|13.996795|36.858105| |1.605857|1.638665|1.833472|1.845336|0.051022|1.641586|2.088513|3.667025|3.223273|2.360848|2.796458|0.074156|3.292229|2.746302|3.930974|4.630562|7.572056|0.159224|0.202271|4.139483|3.611031|2.878788|4.897559|4.030514|2.864137|3.373771|3.010170|3.234437|4.141007|5.298416|4.460528|11.689466|8.498618|13.340110|36.858105| |1.648609|1.691165|1.884349|1.907755|0.053479|1.683263|2.145549|3.696328|3.371747|2.545776|3.108310|0.082496|3.548920|2.842647|4.282255|4.583212|7.110982|0.135297|0.196998|4.059419|3.837818|3.332279|5.603723|4.842921|3.512767|4.325216|3.719969|3.969073|5.269450|7.661917|6.249761|18.951334|8.572238|8.494506|13.988760|36.858105| |17.563002|8.785646|5.468925|4.015562|0.108965|3.644862|3.204714|5.180064|3.921723|2.907071|2.414920|0.060929|2.302924|2.424030|1.942439|1.823693|2.578155|0.049731|0.050716|2.212190|2.438365|2.356310|4.614737|2.769689|1.915305|1.853715|1.813096|1.724328|1.678770|1.713048|1.794697|2.235248|1.667666|1.564260|1.486442|1.528922|0.500000| |17.542685|8.774618|6.808741|4.465277|0.111590|3.993624|3.678460|6.146814|4.329696|3.032063|2.517325|0.062957|2.497799|2.695602|2.087561|1.996283|2.851249|0.055361|0.055246|2.500431|2.692305|2.390462|4.635100|2.785040|1.897979|1.860378|1.799338|1.729139|1.716008|1.771095|1.840965|2.351381|1.778583|1.683845|1.587820|1.612889|0.301896|0.500000| |17.535407|8.765781|6.786100|4.502967|0.121197|3.686521|3.731696|5.898517|4.678049|3.485830|2.870774|0.070145|2.766970|2.863669|2.268653|2.122712|3.062099|0.058479|0.060177|2.717199|3.051425|2.821750|5.702572|3.219852|2.210577|2.165747|2.108800|2.007511|1.963907|2.012899|2.107605|2.619260|1.967257|1.823213|1.712904|1.766287|0.301833|0.301461|0.500000| |8.887149|17.559481|8.827157|6.669152|0.168194|6.648156|4.481321|7.091298|4.978131|3.515661|2.751998|0.070427|2.605537|2.915874|2.162601|2.007588|2.751100|0.052773|0.053123|2.354236|2.620423|2.529116|4.751659|2.945523|1.966268|1.858116|1.765547|1.656625|1.629241|1.703037|1.816895|2.243337|1.655265|1.574797|1.522094|1.563530|0.213999|0.211005|0.173203|0.500000| |8.857701|17.508526|8.846141|6.842352|0.208998|5.492099|4.601004|6.747440|5.549744|4.296442|3.240093|0.081091|2.921852|3.141356|2.370135|2.140261|2.944065|0.055547|0.057544|2.537412|2.953532|3.060213|5.925020|3.477065|2.320554|2.162262|2.054334|1.896013|1.836974|1.915408|2.072601|2.474027|1.805459|1.688618|1.632818|1.703484|0.212614|0.172931|0.210909|0.303847|0.500000| |7.022792|8.902939|17.482880|8.820408|0.211323|5.456922|7.244292|10.084064|8.493560|5.789723|4.203376|0.098432|4.105891|4.563763|3.090606|2.816864|3.980516|0.074037|0.075750|3.706499|4.422395|3.747971|7.317905|4.031801|2.597300|2.490108|2.308091|2.155928|2.151497|2.300563|2.478384|3.029212|2.248175|2.102534|2.003708|2.070152|0.142303|0.173513|0.208710|0.173992|0.210577|0.500000| |6.808499|8.827615|17.538056|8.855764|0.174401|6.856838|7.033744|11.687077|6.915708|4.265966|3.304310|0.081818|3.368780|3.996384|2.685656|2.544819|3.542083|0.067826|0.066451|3.192436|3.493877|2.893822|5.398593|3.277881|2.133257|2.056350|1.918229|1.818543|1.833186|1.955232|2.073839|2.629809|1.970988|1.890119|1.808328|1.833069|0.139822|0.202076|0.166635|0.212593|0.173420|0.303713|0.500000| |4.029928|5.429944|6.797025|8.793433|0.173808|17.605146|6.901977|12.773680|6.342726|3.827916|3.006713|0.079544|2.988449|3.743791|2.497289|2.347706|3.086664|0.059508|0.057803|2.603238|2.817058|2.544711|4.497390|2.992377|1.927596|1.812240|1.673699|1.572320|1.581564|1.698475|1.823689|2.293164|1.686707|1.646339|1.619131|1.642148|0.097581|0.113439|0.098400|0.170025|0.129571|0.140618|0.205536|0.500000| |4.414624|6.615259|6.682216|8.794037|0.215297|17.592486|5.535018|8.720239|5.747354|3.881461|2.973934|0.079076|2.781118|3.289857|2.325778|2.130063|2.805836|0.053623|0.053607|2.343340|2.616068|2.591426|4.629830|3.052262|1.984239|1.834348|1.705989|1.584402|1.567365|1.666667|1.805485|2.209629|1.607880|1.549249|1.527586|1.570971|0.111241|0.115077|0.105087|0.228829|0.171904|0.137421|0.166687|0.300464|0.500000| |3.391358|4.583309|5.430491|8.774627|0.211452|17.558333|7.012241|11.263150|6.996639|4.393036|3.367124|0.092304|3.174695|3.993912|2.662486|2.414686|3.078199|0.058540|0.058078|2.533755|2.829062|2.779822|4.774802|3.289405|2.083646|1.908262|1.741398|1.610418|1.607830|1.737805|1.901385|2.323334|1.677262|1.631796|1.630868|1.675988|0.084808|0.090497|0.086018|0.136691|0.123072|0.122813|0.140789|0.302162|0.302450|0.500000| |3.167995|3.944646|4.725396|6.281563|0.230100|4.654316|6.565763|8.443798|12.251277|17.588193|8.784311|0.227431|5.713173|6.051037|4.222214|3.299080|4.138150|0.073823|0.080318|3.431342|4.516419|6.251407|9.772659|6.494065|3.663858|3.092542|2.665688|2.331047|2.283623|2.538522|2.980541|3.245317|2.242673|2.100728|2.128960|2.297513|0.078770|0.079632|0.090211|0.098216|0.120756|0.138107|0.108709|0.107134|0.115346|0.133460|0.500000| |3.839616|4.620620|5.785296|6.362770|0.212203|4.282638|6.574318|8.444266|12.286931|17.636610|8.793123|0.176255|6.357037|6.055298|4.285140|3.445184|4.638331|0.081696|0.090528|4.147541|5.955057|7.366663|13.950655|6.676867|3.898982|3.467664|3.023524|2.662247|2.609750|2.885328|3.347996|3.650410|2.565838|2.346514|2.309521|2.492660|0.092089|0.094780|0.115842|0.106703|0.140234|0.198360|0.127834|0.103208|0.107655|0.112011|0.301567|0.500000| |2.784672|3.146091|4.186165|4.713560|0.117922|3.826147|7.435086|14.211833|12.513581|5.817045|5.690323|0.140486|8.592301|17.657274|6.241178|6.047238|7.389475|0.131314|0.121794|6.758238|7.060245|4.114906|6.726178|4.648460|2.770389|2.685670|2.326498|2.192383|2.321914|2.682700|2.930255|3.795763|2.781899|2.767937|2.763669|2.775907|0.067134|0.076996|0.079601|0.080197|0.083413|0.125772|0.116735|0.105839|0.088462|0.105373|0.130066|0.138510|0.500000| |2.471353|2.856975|3.610655|4.425825|0.118820|3.754491|6.523384|11.182214|12.350982|6.423672|6.810808|0.196542|8.763360|17.498001|7.219306|5.822077|6.152583|0.108575|0.108053|4.796965|5.500921|4.444929|6.718361|5.208520|2.973737|2.749634|2.332070|2.145855|2.239182|2.603710|2.951285|3.609062|2.535948|2.516424|2.619574|2.707161|0.061038|0.066889|0.069862|0.074210|0.078551|0.104566|0.096321|0.099186|0.087398|0.110914|0.155250|0.135924|0.303649|0.500000| |2.039045|2.256699|2.672961|3.018128|0.085041|2.619233|3.776512|6.389542|6.706571|4.758969|6.727988|0.215228|8.778233|6.985844|17.565320|8.986924|7.629327|0.127218|0.142751|4.874886|5.503699|5.032617|7.061603|6.703195|3.685325|3.430824|2.759284|2.517831|2.687643|3.299613|3.903641|4.637507|3.065223|3.057705|3.408834|3.679595|0.051449|0.054875|0.058879|0.058364|0.063368|0.079607|0.070909|0.069309|0.064713|0.075944|0.117945|0.109587|0.157820|0.223299|0.500000| |2.046929|2.209739|2.574668|2.770730|0.078952|2.357981|3.318363|5.503811|5.834347|4.502235|6.839792|0.186545|8.793341|5.474541|17.574285|8.924251|9.405024|0.144389|0.203504|5.675688|6.764485|6.279435|8.691705|8.812472|4.792367|4.742294|3.571876|3.237679|3.558131|4.721672|5.984196|6.581354|4.058418|3.868540|4.387006|5.160420|0.051750|0.054779|0.060385|0.056263|0.062478|0.079036|0.067802|0.062383|0.059422|0.066513|0.108007|0.111563|0.131096|0.145908|0.304173|0.500000| |2.052738|2.215905|2.676434|2.882481|0.076654|2.532362|3.711271|6.898948|5.984745|3.752073|4.420991|0.119390|6.670860|6.564549|8.749115|17.620756|12.437003|0.224929|0.180823|6.947508|5.720947|3.598789|5.698082|4.530156|2.761650|2.783166|2.369520|2.281412|2.519795|3.040000|3.251300|4.628736|3.346254|3.578338|3.834219|3.686523|0.051241|0.056846|0.059221|0.057497|0.060086|0.079860|0.074480|0.070122|0.061971|0.071443|0.090499|0.092829|0.201131|0.183315|0.214056|0.173520|0.500000| |1.814985|1.932590|2.255103|2.396914|0.065568|2.124149|2.909848|5.203914|4.694132|3.230576|4.020890|0.111604|5.447635|4.587083|8.772402|17.631398|12.410246|0.223626|0.225559|5.590566|4.885701|3.565220|5.570244|4.819133|3.002730|3.108060|2.597696|2.519615|2.855932|3.586508|3.820426|5.721200|3.917983|4.328755|5.209137|5.036897|0.045966|0.049829|0.052767|0.050151|0.053238|0.067549|0.061816|0.058093|0.053234|0.060029|0.079800|0.081587|0.126863|0.129321|0.212322|0.217011|0.301119|0.500000| |2.579820|2.709481|3.397015|3.375497|0.086879|2.814521|4.353354|8.060144|6.759163|4.109630|4.394379|0.105678|6.607316|6.506277|5.689236|6.929336|12.442634|0.225889|0.180598|17.637353|8.715388|3.747757|6.494095|4.353250|2.734009|2.846271|2.502833|2.455001|2.712417|3.173815|3.265772|4.754535|3.727046|3.775925|3.543994|3.396260|0.062625|0.072473|0.076251|0.068288|0.071588|0.106970|0.096740|0.079119|0.068813|0.075305|0.093687|0.110138|0.236173|0.143278|0.127661|0.131466|0.207862|0.142953|0.500000| |2.501927|2.532138|3.030668|2.892537|0.076909|2.412946|3.435343|6.027500|5.343755|3.644654|4.021958|0.095103|5.443513|4.584392|4.897250|5.596203|12.408926|0.223184|0.225027|17.634166|8.797929|3.845023|7.028669|4.517589|2.962994|3.276393|2.926285|2.965877|3.396365|3.996556|3.881266|6.146543|5.208024|4.956949|4.220923|4.053888|0.061395|0.069596|0.076171|0.063047|0.067924|0.097952|0.084404|0.066883|0.060813|0.064050|0.083967|0.103355|0.140717|0.105415|0.107730|0.128189|0.143013|0.126936|0.301476|0.500000| |2.624878|2.752674|3.268269|3.252595|0.091726|2.608741|3.811271|6.111223|6.656864|5.270772|6.823208|0.143588|8.753522|5.481931|6.740902|5.652182|9.358422|0.143953|0.201394|8.939011|17.594588|7.347282|13.389966|7.676962|4.656666|5.097503|4.120627|3.836270|4.202259|5.283251|6.059340|6.928657|4.819172|4.109299|3.919954|4.379520|0.064798|0.069758|0.080860|0.067327|0.077240|0.108266|0.085027|0.069185|0.066089|0.070121|0.114875|0.151319|0.140859|0.122797|0.138123|0.195794|0.131600|0.127283|0.173421|0.218861|0.500000| |3.301276|3.522584|4.520088|4.343628|0.117639|3.269689|5.330961|8.282805|9.368598|6.602611|6.709866|0.137350|8.749384|7.020224|5.507850|4.878931|7.618866|0.127119|0.142089|8.984057|17.599997|5.919920|11.293524|5.900923|3.589498|3.645302|3.160272|2.964467|3.122842|3.599396|3.943667|4.837919|3.581301|3.253661|3.063580|3.215446|0.078395|0.088092|0.102349|0.083881|0.096107|0.160478|0.117126|0.087076|0.080925|0.085268|0.133465|0.200337|0.190168|0.140320|0.123032|0.138540|0.128435|0.107638|0.213410|0.212079|0.305938|0.500000| |2.061553|2.263941|2.522700|2.771740|0.084380|2.366627|3.058326|4.802160|5.292068|4.882894|7.365192|0.234940|5.385585|4.064581|5.540074|3.900498|4.758843|0.082398|0.101859|3.418349|4.360276|9.368148|10.906500|26.089280|8.998682|5.917071|4.227842|3.389040|3.304982|3.953665|5.519791|4.713088|2.912711|2.654194|2.871354|3.416478|0.053134|0.053570|0.060704|0.057626|0.066853|0.076426|0.063851|0.060357|0.061342|0.067490|0.130767|0.122253|0.093845|0.111287|0.153108|0.185717|0.094359|0.101725|0.084769|0.084833|0.132510|0.107177|0.500000| |1.847925|1.964730|2.106805|2.215973|0.066949|1.930414|2.342483|3.750428|3.797142|3.360897|4.237729|0.119445|3.539568|2.839272|3.629210|2.931714|3.850878|0.069076|0.085604|2.762733|3.317374|5.781356|8.966853|12.629549|17.582823|8.872633|6.272759|4.445351|3.960104|4.432820|6.270302|4.807344|2.890717|2.549647|2.728594|3.346939|0.048498|0.047951|0.054935|0.050118|0.058265|0.063824|0.053732|0.049769|0.051265|0.054181|0.090908|0.091905|0.069785|0.076442|0.096788|0.120991|0.071594|0.079336|0.068184|0.072598|0.105867|0.084552|0.235050|0.500000| |2.141812|2.268583|2.403931|2.482212|0.076322|2.113491|2.556968|4.004164|4.142385|3.843353|4.601623|0.120215|3.660566|2.951486|3.427348|2.785492|3.783879|0.067698|0.082926|2.871563|3.587555|7.100902|12.775703|12.442839|17.614114|8.915103|7.200365|4.753861|3.984988|4.226298|5.675653|4.525233|2.844447|2.458441|2.518380|2.995511|0.056188|0.054657|0.064709|0.056883|0.068465|0.074105|0.060169|0.053972|0.056591|0.058373|0.103082|0.111425|0.072496|0.076907|0.089029|0.109010|0.069189|0.072927|0.070777|0.076514|0.116394|0.095516|0.188919|0.302781|0.500000| |1.912265|1.942974|2.025421|2.011595|0.059892|1.745603|2.063956|3.331765|3.211342|2.758945|3.141934|0.081280|2.825472|2.338930|2.733449|2.400306|3.429088|0.063066|0.077218|2.573943|2.995274|4.187071|8.218063|6.389179|6.979719|8.903190|17.716705|8.935723|5.638727|4.963899|5.665975|4.930566|3.109108|2.584533|2.574272|3.081774|0.050707|0.049483|0.058355|0.048960|0.057466|0.062449|0.051921|0.045560|0.047090|0.047622|0.072604|0.081469|0.060090|0.060701|0.069804|0.086555|0.059672|0.064204|0.063051|0.072023|0.098835|0.080193|0.109346|0.168236|0.216268|0.500000| |1.751264|1.734434|1.812991|1.762754|0.051100|1.546251|1.826234|3.020639|2.781895|2.269828|2.540089|0.065398|2.463571|2.072689|2.434918|2.269916|3.387293|0.063972|0.077805|2.511725|2.738080|3.115651|6.077859|4.481438|4.088072|5.641951|8.933042|17.731372|8.941895|5.673700|4.981512|5.676495|3.723431|2.968774|2.831685|3.339926|0.046426|0.046203|0.053590|0.043925|0.050102|0.055879|0.047552|0.041109|0.041612|0.041895|0.058781|0.066829|0.054975|0.053600|0.061338|0.076137|0.056503|0.061547|0.061256|0.073282|0.089990|0.073049|0.080349|0.103773|0.112780|0.216157|0.500000| |1.697950|1.683076|1.803408|1.754848|0.049862|1.540898|1.870840|3.154264|2.858643|2.248748|2.567965|0.065937|2.663727|2.213951|2.736041|2.681435|4.200793|0.080568|0.101162|2.987105|3.059071|3.002348|5.646321|4.249871|3.532964|4.919829|5.626502|8.883219|17.735474|8.907092|5.642737|9.686527|6.450161|4.580066|4.138692|4.955676|0.044415|0.045614|0.051696|0.042764|0.047657|0.055696|0.048155|0.041497|0.040913|0.041802|0.057082|0.064957|0.059903|0.057088|0.067288|0.086265|0.065495|0.073882|0.071184|0.089760|0.101343|0.078692|0.077891|0.090221|0.090696|0.124021|0.214760|0.500000| |1.941230|2.037866|2.284273|2.360873|0.068333|2.019454|2.651547|4.355287|4.419479|3.627996|4.976953|0.129153|5.142345|3.643914|5.980945|4.855176|6.752965|0.113193|0.169135|4.425195|5.211719|6.168726|9.493509|10.179100|7.009826|8.948875|5.675224|4.985752|5.661560|8.971031|17.784318|9.935216|5.092292|4.292948|4.789581|6.751231|0.049759|0.051508|0.058257|0.051557|0.058370|0.070871|0.059706|0.053312|0.052265|0.056059|0.089574|0.097997|0.091620|0.094616|0.137155|0.244612|0.106770|0.131024|0.100330|0.114423|0.184985|0.117210|0.182512|0.168564|0.143623|0.124424|0.108098|0.124451|0.500000| |1.893397|1.869245|2.064111|1.983182|0.055005|1.723114|2.177210|3.737511|3.325226|2.502849|2.844556|0.071219|3.214127|2.661432|3.282955|3.467498|6.149685|0.120926|0.154225|4.389034|4.026868|3.125535|5.849844|4.129082|3.084144|3.917909|3.832115|4.573567|6.437854|6.933669|4.919503|12.217926|17.808050|8.611257|5.779814|5.897071|0.048549|0.051757|0.057831|0.047252|0.051770|0.064582|0.056153|0.047058|0.045061|0.046380|0.061608|0.072040|0.074603|0.066972|0.077414|0.099724|0.084108|0.093159|0.100074|0.145395|0.131974|0.101149|0.076382|0.077033|0.078743|0.088964|0.111730|0.196999|0.124522|0.500000| |1.660826|1.658395|1.851334|1.810838|0.049322|1.612787|2.031147|3.614138|3.044397|2.185269|2.461957|0.063765|2.908187|2.535694|3.168434|3.761201|6.740440|0.155921|0.160381|4.181992|3.404879|2.511786|4.461498|3.352278|2.395381|2.796740|2.629494|2.906472|3.653022|4.158007|3.444860|7.972398|8.776001|17.778231|8.492411|5.807434|0.042592|0.046227|0.049473|0.042715|0.045282|0.056437|0.051535|0.044756|0.041808|0.043857|0.054429|0.060758|0.073504|0.065657|0.076511|0.092004|0.093431|0.107311|0.101987|0.131916|0.100083|0.084172|0.065141|0.062241|0.060824|0.063812|0.073402|0.108053|0.097115|0.196894|0.500000| |1.509165|1.545667|1.727621|1.751648|0.048257|1.576727|1.986139|3.524805|3.035265|2.196384|2.574422|0.069492|3.023479|2.600021|3.666704|4.445051|6.767089|0.148905|0.164531|3.684847|3.199385|2.591311|4.365434|3.640179|2.564268|2.918976|2.617281|2.767085|3.396201|4.154400|3.698571|7.973409|5.810229|8.493413|17.775915|8.774909|0.038900|0.041607|0.044354|0.040175|0.042676|0.051888|0.047583|0.043373|0.040723|0.043750|0.055573|0.059108|0.073128|0.070215|0.091321|0.110484|0.105199|0.146579|0.091206|0.102053|0.093347|0.076328|0.073487|0.068971|0.063065|0.063427|0.068492|0.094554|0.111861|0.122741|0.194607|0.500000| 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