Version2.1 2020-08-30T21:02:43Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 06-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc(cc1)c2nc(on2)C[NH+]3CCc4c([nH]cn4)[C@H]3c5ccccn5 C11936332 RHF 6-31G(d) (6D,7F) c1ccc(cc1)c2nc(on2)C[NH+]3CCc4c([nH]cn4)[C@H]3c5ccccn5 C01[X(C20H19N6O1)] 132 C1 443 c1ccc(nc1)[C@H]1[NH+](CCc2c1[nH]cn2)Cc1onc(n1)c1ccccc1 c1ccc(nc1)[C@H]1[NH+](CCc2c1[nH]cn2)Cc1onc(n1)c1ccccc1 C1Cc2nc[nH]c2[C@H]([NH+]1Cc3onc(n3)c4ccccc4)c5ccccn5 InChIKey=LIWJNLKPIWOSIT-LJQANCHMSA-O InChI=1S/C20H18N6O/c1-2-6-14(7-3-1)20-24-17(27-25-20)12-26-11-9-15-18(23-13-22-15)19(26)16-8-4-5-10-21-16/h1-8,10,13,19H,9,11-12H2,(H,22,23)/p+1/t19-/m1/s1 InChI=1/C20H18N6O/c1-2-6-14(7-3-1)20-24-17(27-25-20)12-26-11-9-15-18(23-13-22-15)19(26)16-8-4-5-10-21-16/h1-8,10,13,19H,9,11-12H2,(H,22,23)/p+1/t19-/m1/s1/fC20H19N6O/h23,26H/q+1 c1ccc(cc1)c2nc(on2)C[NH+]3CCc4c([nH]cn4)[C@H]3c5ccccn5 C01[X(C20H19N6O1)] 132 C01 443 c1ccc(nc1)[C@H]1[NH+](CCc2c1[nH]cn2)Cc1onc(n1)c1ccccc1 [CH]1[CH][CH][C]([N][CH]1)[C@H]1[NH](CC[C]2=C1[NH][CH]=[N]2)CC1=[N][C]([N]O1)[C]1[CH][CH][CH][CH][CH]1 [CH]1[CH][CH][C]([CH][CH]1)[C]2[N]OC(=N2)C[NH]3CCc4nc[nH]c4[C@H]3[C]5[CH][CH][CH][CH][N]5 InChIKey=SVKSMXHQGHPUTQ-LJQANCHMSA-N InChI=1S/C20H19N6O/c1-2-6-14(7-3-1)20-24-17(27-25-20)12-26-11-9-15-18(23-13-22-15)19(26)16-8-4-5-10-21-16/h1-8,10,13,19,26H,9,11-12H2,(H,22,23)/t19-/m1/s1 InChI=1/C20H19N6O/c1-2-6-14(7-3-1)20-24-17(27-25-20)12-26-11-9-15-18(23-13-22-15)19(26)16-8-4-5-10-21-16/h1-8,10,13,19,26H,9,11-12H2,(H,22,23)/t19-/m1/s1/f/h23H 2433.9701107724 -1169.7470979 1-A 10430.9649 94 349 443 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.79266 -15.85040 -15.74422 -15.73988 -15.70630 -15.70162 -15.65799 -11.48991 -11.46297 -11.46233 -11.44005 -11.42905 -11.42342 -11.41244 -11.40254 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359.16203 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 18.5570 19.3372 29.5591 44.0965 65.2281 70.4331 91.1339 109.6805 116.8630 145.7568 188.3122 211.3102 229.4239 242.8036 290.0761 320.3431 327.5085 359.6918 365.1109 396.1032 435.1864 450.5674 460.2390 482.8252 501.8466 520.4071 524.7904 545.9109 563.8412 577.4272 674.6127 675.8398 693.3541 723.5002 730.8619 735.2322 762.0716 768.3505 790.7624 815.8429 826.4444 856.8306 864.9423 891.9256 914.8246 931.8430 964.0555 973.2915 984.3640 1008.5099 1015.5194 1022.3258 1046.0488 1050.6116 1071.9912 1072.1871 1091.3722 1096.5360 1101.4891 1116.1717 1116.3607 1117.7194 1129.6479 1140.3874 1143.8617 1150.7413 1151.8489 1166.5151 1186.8178 1189.3408 1202.2494 1214.4011 1216.8769 1219.6086 1234.3393 1258.3185 1305.0171 1311.2114 1319.5922 1329.6016 1342.2645 1347.9825 1368.0509 1382.0933 1413.4832 1441.1872 1453.2699 1472.2589 1480.0418 1496.9042 1507.8482 1524.2522 1538.8681 1562.9892 1580.0482 1600.0578 1609.1359 1611.9637 1616.0872 1621.5221 1627.6908 1634.4328 1648.5514 1652.0588 1669.2704 1697.0429 1746.1488 1783.8110 1787.8643 1801.5345 1810.2982 1821.3523 1859.0472 3227.2290 3273.6460 3274.8563 3285.1214 3294.3655 3337.8218 3362.5946 3372.6060 3383.2063 3383.2179 3393.2163 3394.7631 3402.0866 3402.5238 3407.2014 3417.8750 3462.3156 3555.3586 3901.0503 5.8237 5.8420 3.9610 4.3330 5.6461 4.9533 8.3408 5.7401 6.2891 4.3916 3.5001 3.9772 5.1846 6.9999 3.2523 4.1751 3.7235 4.0997 4.9490 5.7275 3.5734 2.9150 3.4792 4.8216 3.4653 1.3764 5.2261 4.1079 3.8500 3.0754 6.0477 6.4466 4.4324 3.0158 4.0897 5.2623 3.0849 3.6063 4.1397 2.6416 4.8091 1.3834 3.0762 2.8647 4.0169 3.8387 1.2476 2.8309 2.3211 1.4281 1.5499 1.8821 6.6639 9.2240 5.2678 1.5400 6.1282 7.1343 2.3691 2.4130 1.4494 1.6295 2.4723 3.5679 1.3447 1.6225 2.0248 5.1174 2.3484 1.7187 2.5594 1.9280 1.7087 2.4628 2.4817 3.1043 1.1563 1.8951 1.2753 1.4729 1.7033 1.6831 1.5094 1.7560 1.5249 1.7397 2.1871 1.5461 1.4573 1.5487 1.4497 1.7803 2.1374 2.6823 1.5772 1.6498 2.2786 1.4364 2.0699 1.4281 1.2559 1.1330 1.1646 2.0891 2.3562 4.0289 7.9005 5.6432 5.9341 5.3904 5.2416 7.3912 10.5228 1.0678 1.0666 1.0872 1.0928 1.0616 1.1125 1.1110 1.0881 1.0912 1.0914 1.0942 1.0918 1.0959 1.0965 1.0968 1.0994 1.1009 1.0790 1.0829 0.0012 0.0013 0.0020 0.0050 0.0142 0.0145 0.0408 0.0407 0.0506 0.0550 0.0731 0.1046 0.1608 0.2431 0.1612 0.2524 0.2353 0.3125 0.3887 0.5295 0.3987 0.3487 0.4342 0.6622 0.5142 0.2196 0.8480 0.7213 0.7212 0.6041 1.6216 1.7349 1.2554 0.9301 1.2871 1.6760 1.0555 1.2544 1.5251 1.0359 1.9353 0.5984 1.3559 1.3427 1.9807 1.9639 0.6832 1.5800 1.3251 0.8558 0.9417 1.1590 4.2962 5.9987 3.5667 1.0430 4.3006 5.0542 1.6935 1.7712 1.0643 1.1994 1.8589 2.7338 1.0367 1.2659 1.5828 4.1028 1.9489 1.4324 2.1796 1.6753 1.4907 2.1584 2.2277 2.8959 1.1603 1.9196 1.3084 1.5341 1.8081 1.8019 1.6644 1.9763 1.7950 2.1289 2.7215 1.9745 1.8808 2.0445 1.9420 2.4370 2.9822 3.8607 2.3199 2.4887 3.4761 2.1990 3.1851 2.2124 1.9605 1.7832 1.8648 3.3594 3.8683 6.8363 14.1927 10.5797 11.1756 10.3075 10.1207 14.4462 21.4270 6.5522 6.7347 6.8699 6.9488 6.7882 7.3025 7.4014 7.2919 7.3587 7.3601 7.4231 7.4135 7.4731 7.4793 7.5022 7.5669 7.7754 8.0362 9.7095 1.1691 0.1040 0.1210 0.0785 0.0354 1.4288 5.9376 3.0348 1.6725 2.9212 3.6618 7.8360 8.1324 0.7400 3.9375 2.3216 3.9996 4.4784 3.6579 2.2486 15.5764 0.1526 4.5013 24.7552 2.2606 132.3778 4.8729 5.2485 4.5223 8.4959 3.9361 0.1825 2.5744 0.6132 2.9704 4.2575 13.7843 26.3220 9.0763 61.0544 9.5860 45.6131 8.6274 5.4842 19.5960 6.0847 0.0560 4.7657 12.7249 5.3480 23.1088 10.4965 1.0110 40.2505 8.9203 2.9985 0.7631 16.7466 1.2004 75.7523 10.3949 21.4942 1.1872 22.4379 0.0057 4.2763 5.3048 2.5700 0.7887 1.4989 6.8745 4.1682 13.9186 15.4972 4.4266 12.8438 10.3495 1.2796 15.8112 3.5006 5.2906 4.4608 5.9183 13.8055 5.3239 8.7971 61.9319 13.1368 2.2131 53.5849 25.6135 37.5770 106.8883 52.5583 120.3405 66.8307 48.0678 26.7056 23.8110 41.2860 23.5101 10.0383 24.1947 27.4360 8.4202 22.1954 27.1223 6.3147 21.8371 53.0195 20.3890 14.9634 163.3143 11.2657 4.4423 6.9724 5.3770 3.0046 7.0932 0.2636 0.0735 5.6906 3.0946 15.6177 2.0833 3.9433 10.9789 4.2865 3.8133 0.6103 147.5118 96.0224 0.5403 3.7327 6.7279 2.1246 6.9428 4.9051 1.8318 1.8870 1.5127 0.1481 0.2456 0.4109 0.9789 3.7903 1.9153 2.2830 2.5993 4.1949 0.8138 1.2981 2.4065 0.0760 0.4632 0.9743 1.8063 0.6635 0.9939 0.6550 1.6948 1.1295 4.0212 5.5714 0.9249 1.1820 6.4222 2.1821 0.4321 4.9833 1.7141 0.5343 3.1675 3.8496 0.4820 1.6611 2.1183 8.8900 2.3505 3.4789 3.1920 0.4893 0.3954 1.5470 7.6529 11.2919 16.6240 3.4395 30.2345 15.4039 5.6809 7.3783 1.1106 2.7116 10.8731 7.1543 0.6031 1.1350 2.3569 1.8482 1.2323 1.1222 3.1955 2.7938 6.5756 9.4890 17.1161 6.8424 4.3931 12.5148 1.7429 6.2435 7.9464 1.1721 5.0131 2.3423 9.5375 3.1107 29.1897 5.1410 3.2599 12.5494 4.2711 9.2818 17.9882 39.2041 7.7302 5.2809 9.1677 5.2140 10.5413 16.0485 0.9856 14.3538 11.7611 1.0665 1.3623 23.8362 99.3879 10.9000 15.2708 11.7177 240.8797 31.3602 16.5660 109.1131 34.6788 51.7695 121.2624 131.9467 37.0108 55.8605 41.0836 128.7402 12.3359 80.2398 82.6648 40.4337 78.8149 176.4906 168.4054 116.6834 20.3385 41.7178 0.7046 0.7274 0.7464 0.7221 0.7499 0.7431 0.7255 0.7368 0.7497 0.4886 0.7422 0.4754 0.5512 0.5584 0.3474 0.7330 0.5282 0.2043 0.4626 0.5284 0.0603 0.7494 0.6370 0.4964 0.4066 0.6847 0.3148 0.7311 0.7304 0.7392 0.6257 0.7495 0.6782 0.6857 0.1315 0.7391 0.3429 0.5355 0.3430 0.4381 0.0909 0.5846 0.7430 0.6676 0.4518 0.1793 0.7471 0.1714 0.5219 0.6598 0.2976 0.7494 0.4921 0.3867 0.0790 0.3408 0.1196 0.1100 0.7413 0.5438 0.4734 0.3956 0.1400 0.0608 0.7392 0.2131 0.3958 0.4777 0.3424 0.3677 0.1359 0.2186 0.2413 0.3275 0.4703 0.6909 0.1622 0.1137 0.3777 0.6848 0.3971 0.3476 0.4411 0.7496 0.6292 0.7363 0.5048 0.3768 0.4689 0.3538 0.3438 0.3032 0.4579 0.3319 0.6413 0.7053 0.6725 0.6725 0.2831 0.7447 0.3081 0.6409 0.7452 0.6168 0.3735 0.1994 0.1898 0.3791 0.6186 0.3653 0.4154 0.2646 0.5073 0.1270 0.5701 0.1893 0.3806 0.0511 0.6899 0.7190 0.7421 0.7412 0.5516 0.3734 0.4538 0.7052 0.1178 0.1128 0.1271 0.2834 0.1676 0.2459 0.8267 0.8422 0.8548 0.8386 0.8571 0.8526 0.8409 0.8485 0.8569 0.6565 0.8520 0.6445 0.7107 0.7166 0.5156 0.8459 0.6913 0.3393 0.6325 0.6914 0.1138 0.8568 0.7782 0.6635 0.5781 0.8129 0.4788 0.8446 0.8442 0.8501 0.7698 0.8568 0.8082 0.8135 0.2324 0.8500 0.5107 0.6975 0.5108 0.6093 0.1667 0.7379 0.8525 0.8007 0.6224 0.3041 0.8553 0.2926 0.6859 0.7950 0.4587 0.8567 0.6596 0.5577 0.1464 0.5083 0.2137 0.1982 0.8514 0.7045 0.6426 0.5669 0.2455 0.1146 0.8500 0.3514 0.5671 0.6466 0.5102 0.5376 0.2393 0.3588 0.3888 0.4934 0.6397 0.8172 0.2791 0.2042 0.5483 0.8129 0.5684 0.5158 0.6121 0.8569 0.7724 0.8481 0.6709 0.5474 0.6384 0.5227 0.5117 0.4654 0.6282 0.4984 0.7815 0.8272 0.8042 0.8042 0.4412 0.8537 0.4711 0.7812 0.8540 0.7630 0.5438 0.3325 0.3191 0.5497 0.7643 0.5351 0.5870 0.4185 0.6731 0.2253 0.7262 0.3183 0.5514 0.0972 0.8165 0.8365 0.8520 0.8514 0.7110 0.5438 0.6243 0.8271 0.2108 0.2027 0.2255 0.4417 0.2871 0.3947 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 6 6 6 6 6 6 6 7 6 8 7 6 7 1 6 6 6 6 7 1 6 7 6 1 6 6 6 6 6 7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 14.00307 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 14.00307 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 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 3861.9094 16234.4588 17589.8818 0.99995 -0.00945 0.00190 0.00937 0.99928 0.03666 -0.00225 -0.03664 0.99933 1 0.02243 0.00534 0.00492 0.46732 0.11117 0.10260 26.70 27.82 42.53 63.45 93.85 101.34 131.12 157.81 168.14 209.71 270.94 304.03 330.09 349.34 417.35 460.90 471.21 517.52 525.31 569.90 626.14 648.27 662.18 694.68 722.05 748.75 755.06 785.44 811.24 830.79 970.62 972.38 997.58 1040.96 1051.55 1057.84 1096.45 1105.48 1137.73 1173.82 1189.07 1232.79 1244.46 1283.28 1316.23 1340.71 1387.06 1400.35 1416.28 1451.02 1461.11 1470.90 1505.03 1511.60 1542.36 1542.64 1570.24 1577.67 1584.80 1605.92 1606.19 1608.15 1625.31 1640.76 1645.76 1655.66 1657.25 1678.36 1707.57 1711.20 1729.77 1747.25 1750.81 1754.74 1775.94 1810.44 1877.63 1886.54 1898.60 1913.00 1931.22 1939.45 1968.32 1988.52 2033.69 2073.55 2090.93 2118.25 2129.45 2153.71 2169.46 2193.06 2214.09 2248.79 2273.34 2302.13 2315.19 2319.26 2325.19 2333.01 2341.88 2351.58 2371.90 2376.94 2401.71 2441.67 2512.32 2566.51 2572.34 2592.01 2604.62 2620.52 2674.75 4643.26 4710.05 4711.79 4726.56 4739.86 4802.38 4838.02 4852.43 4867.68 4867.70 4882.08 4884.31 4894.84 4895.47 4902.20 4917.56 4981.50 5115.37 5612.74 0.403511 0.423129 0.424073 0.351801 -1169.343587 -1169.323969 -1169.323025 -1169.395297 2.424015D-04 MUNgauss RevisionA2.0 retrievium 30-Aug-2020 DUDE c1ccc(cc1)c2nc(on2)C[NH+]3CCc4c([nH]cn4)[C@H]3c5ccccn5 C11936332 RHF 6-31G(d) (6D,10F) C1 359.162034 |X|Y|Z| 89.823739 39.268864 28.646296 46.576764 27 6 7 8 20 6 1 |36.858105| |13.721251|36.858105| |7.941017|13.795244|36.858105| |6.878191|7.935545|13.673513|36.858105| |7.942785|6.863913|7.904437|13.709386|36.858105| |13.756910|7.924598|6.861465|7.933590|13.758558|36.858105| |4.493011|5.082158|7.670404|12.956475|7.701523|5.086837|36.858105| |3.717922|3.881384|5.064775|7.594102|6.537392|4.431812|13.774165|53.358707| |3.064796|3.279187|4.204343|5.474577|4.615539|3.460746|9.241183|20.455660|36.858105| |3.031290|3.402073|4.503111|5.387329|4.188710|3.258737|9.063074|11.982610|14.582530|73.516695| |3.753879|4.456901|6.580717|7.824895|5.195441|3.942305|14.823045|11.654165|8.866097|24.596579|53.358707| |2.508471|2.618307|3.165301|3.878631|3.543221|2.818372|5.382976|10.465185|12.732875|14.062588|7.264722|36.858105| |2.287303|2.366233|2.792540|3.332875|3.120232|2.554144|4.324998|7.711370|7.531948|10.280926|5.859333|12.690327|53.358707| |2.397807|2.439885|2.854361|3.469641|3.348993|2.725523|4.388391|8.051436|6.914182|9.143776|5.622857|9.240150|25.482348|0.500000| |1.962417|2.009262|2.307651|2.678615|2.569140|2.173501|3.286355|5.562579|4.990387|7.401051|4.466816|7.825577|17.075503|0.255313|36.858105| |1.790034|1.820490|2.052835|2.339561|2.274856|1.968874|2.762095|4.478760|3.776218|5.879322|3.743429|4.997415|10.263861|0.196094|12.526130|36.858105| |1.773703|1.826943|2.066964|2.316897|2.210013|1.922567|2.736232|4.271679|3.637720|5.969007|3.811935|4.486531|9.166513|0.171420|7.844956|12.795844|36.858105| |1.933574|2.022073|2.327388|2.606966|2.423736|2.083374|3.155531|4.854293|4.275957|7.251461|4.518721|5.074733|10.605086|0.187789|6.951968|7.660116|14.160870|36.858105| |1.802633|1.896131|2.156633|2.350121|2.177700|1.909748|2.762688|4.056009|3.450229|6.150770|4.013668|3.807420|6.866024|0.129337|4.680846|5.291313|8.805274|13.878588|53.358707| |1.833950|1.949577|2.222040|2.384851|2.180890|1.921073|2.788811|3.973563|3.357227|6.209470|4.129217|3.534019|6.004311|0.114137|3.938245|4.203615|6.077636|8.923377|26.065638|0.500000| |1.622207|1.686848|1.886536|2.047228|1.933872|1.719845|2.352315|3.469729|2.878353|5.032057|3.351590|3.226417|5.691352|0.110133|4.279110|5.357083|9.043823|8.751109|19.182604|0.252522|36.858105| |1.603671|1.650737|1.841580|2.024158|1.938380|1.718677|2.329035|3.523584|2.918050|4.936241|3.259122|3.408198|6.203958|0.120655|5.122464|7.474764|13.968496|8.541431|11.799496|0.168263|14.767611|53.358707| |2.245087|2.373035|2.816405|3.243952|2.936014|2.442021|4.176646|6.639358|6.374945|10.563609|6.069192|7.541039|17.028512|0.262483|7.382519|6.195613|7.448189|12.719074|10.125602|0.182297|5.241967|7.030997|36.858105| |2.233559|2.404602|2.889314|3.264981|2.869253|2.392005|4.287592|6.504781|6.621969|12.524625|6.687912|7.467670|12.258774|0.185636|6.216129|5.010213|5.831393|8.856549|8.823285|0.172601|4.639105|6.026212|17.599453|0.500000| |2.550896|2.702472|3.235870|3.764954|3.381494|2.784078|4.789040|7.289886|6.239083|10.469420|6.732204|5.886659|10.535003|0.225346|5.024837|4.615718|5.344790|7.645321|8.273958|0.166472|4.451837|5.730633|12.468215|0.244593|36.858105| |2.643705|2.886876|3.487728|3.855065|3.323644|2.790782|4.751482|6.381374|5.241667|10.119685|7.151164|4.543559|7.013472|0.143425|3.780218|3.532570|4.119131|5.625946|7.260651|0.164932|3.935198|4.810443|7.493650|0.195944|13.817158|36.858105| |2.869084|3.120810|3.681377|3.967598|3.482114|2.995769|4.471823|5.735181|4.273639|7.993625|6.322923|3.643027|5.432483|0.116901|3.094711|2.971848|3.357445|4.198687|5.629544|0.126521|3.303863|4.084874|5.020619|0.130024|8.043216|13.706794|36.858105| |2.993928|3.115272|3.559077|3.978693|3.731208|3.227221|4.276215|5.751016|4.033519|6.974561|5.536507|3.505856|5.305421|0.121341|3.057820|2.990764|3.272616|3.883041|5.046728|0.107569|3.108501|3.976431|4.508712|0.110927|7.051730|7.974662|13.797716|36.858105| |2.849789|2.883130|3.297646|3.887150|3.802741|3.200304|4.339647|6.454406|4.508153|7.198201|5.397716|4.087237|6.538270|0.162455|3.660525|3.601935|3.836455|4.457823|5.415224|0.109211|3.372528|4.486009|5.247756|0.120182|8.388010|7.013636|8.014536|13.731754|36.858105| |2.632667|2.697850|3.153314|3.770930|3.595389|2.957236|4.554616|7.309499|5.569313|8.491937|5.829329|5.366105|9.668040|0.258476|4.866627|4.669943|5.010007|6.122508|6.704912|0.129453|4.004912|5.433539|7.942267|0.161696|14.416507|8.006919|6.910671|8.022495|14.443939|53.358707| |17.724907|8.912226|5.650906|4.955285|5.649790|8.922833|3.584416|4.198919|2.615183|4.604457|4.229890|2.202263|2.768052|0.059141|1.773989|1.635763|1.621448|1.752494|2.242671|0.046561|1.496822|2.014589|2.000287|0.055199|2.250929|2.331780|2.536629|2.655688|2.526334|3.169503|0.500000| |8.902850|17.731424|8.943512|5.645448|4.948386|5.640822|4.130960|4.429158|2.859953|5.379192|5.261453|2.338012|2.905497|0.060620|1.836748|1.677784|1.695471|1.873522|2.422228|0.051131|1.589966|2.106280|2.167146|0.061444|2.442724|2.645115|2.862576|2.809838|2.568112|3.280527|0.214873|0.500000| |5.646506|8.928411|17.738705|8.893546|5.632271|4.947695|7.076518|6.367665|4.171536|8.545004|10.012160|3.146652|3.777142|0.077196|2.295267|2.038656|2.079247|2.368367|3.017052|0.064150|1.923420|2.530373|2.870881|0.083806|3.262478|3.632449|3.760312|3.453491|3.143043|4.167661|0.124220|0.215494|0.500000| |5.649097|4.949671|5.632509|8.910480|17.747791|8.917107|7.117956|10.115592|4.973207|7.452096|6.547690|3.912380|4.677199|0.104965|2.821659|2.479822|2.360891|2.557981|3.072722|0.061930|2.015100|2.786946|3.107841|0.082683|3.541969|3.323642|3.407960|3.746770|4.054436|5.315875|0.124222|0.107487|0.123977|0.500000| |8.913732|5.639154|4.947018|5.645641|8.929557|17.730227|4.136627|5.260272|3.081070|5.070072|4.494215|2.604466|3.258757|0.071557|2.074348|1.898404|1.837447|1.962568|2.450020|0.049971|1.640118|2.246769|2.262902|0.060976|2.552512|2.517572|2.696718|2.959833|2.996700|3.757894|0.215014|0.124052|0.107452|0.215220|0.500000| |2.301931|2.432755|2.921992|3.436246|3.092365|2.527034|4.632502|7.929842|8.992528|13.331895|6.731739|17.641222|12.386692|0.180766|7.304872|4.693520|4.315276|4.867881|5.102546|0.097223|3.190891|4.554201|6.758030|0.213678|4.979162|4.112119|3.279689|3.068034|3.433729|5.905172|0.056646|0.061301|0.082596|0.092124|0.064882|0.500000| |2.486256|2.535963|3.001930|3.717265|3.563095|2.845538|4.880655|9.795867|9.078299|10.507142|6.164589|17.665758|12.405937|0.225534|7.316345|4.769381|4.007349|4.224349|4.446688|0.083864|2.884668|4.240155|5.562019|0.147311|4.706573|3.738940|3.169184|3.164183|3.734795|6.380715|0.060928|0.062645|0.081081|0.113050|0.074299|0.300071|0.500000| |1.870068|1.935793|2.227135|2.540170|2.395697|2.042355|3.122656|5.101940|4.700997|7.400008|4.389207|7.199003|12.359984|0.180561|17.628610|8.836559|6.965037|6.513818|6.288855|0.109441|4.211705|6.661559|6.772156|0.180455|4.491327|3.574375|2.897762|2.781409|3.195566|5.580986|0.047076|0.049557|0.062409|0.071799|0.053863|0.224462|0.178096|0.500000| |1.976528|1.999187|2.279271|2.671920|2.617167|2.214102|3.234496|5.603129|4.816234|6.898739|4.270375|7.518958|12.401588|0.221797|17.633623|8.781109|5.627767|5.040127|5.060929|0.089892|3.487033|5.599922|5.507963|0.135035|4.239624|3.297351|2.799666|2.825248|3.389324|5.881470|0.049702|0.050547|0.062224|0.081215|0.059237|0.188342|0.236812|0.300593|0.500000| |1.638439|1.663616|1.858380|2.092415|2.042130|1.790619|2.432873|3.873625|3.227272|5.132267|3.313124|4.180083|7.538083|0.142786|8.966357|17.583404|8.931835|5.778035|6.107227|0.101540|4.831396|9.333644|4.748475|0.115051|3.684945|2.976983|2.554735|2.558827|2.993323|5.022605|0.041883|0.042868|0.051388|0.061485|0.048207|0.114152|0.114046|0.218946|0.208230|0.500000| |1.822187|1.830298|2.046377|2.349041|2.330813|2.024070|2.725800|4.455143|3.600967|5.501297|3.601448|4.564784|9.006405|0.199705|8.803945|17.542633|8.888693|6.178689|6.248890|0.104606|4.694498|8.549593|5.354048|0.118908|4.457667|3.400055|2.960182|3.091684|3.846896|6.679283|0.046351|0.046666|0.055771|0.071441|0.054724|0.113816|0.126278|0.173226|0.215525|0.303124|0.500000| |1.517914|1.579118|1.749594|1.873716|1.773130|1.595892|2.118311|3.070851|2.508049|4.443795|3.023104|2.744906|4.620848|0.090546|3.458512|4.176734|6.048087|5.952717|12.218179|0.211439|17.798870|12.343187|4.133572|0.105778|3.714939|3.460020|3.012214|2.830429|2.983741|4.613497|0.039152|0.041652|0.049681|0.050938|0.042373|0.075884|0.069041|0.095677|0.081220|0.109235|0.105442|0.500000| |2.489026|2.769179|3.354970|3.578868|3.025658|2.574576|4.423454|5.749342|4.909810|10.399011|7.195012|4.305901|6.363939|0.122761|3.574505|3.301444|3.887852|5.338550|7.243246|0.174187|3.872867|4.631507|6.868961|0.209762|8.886378|17.729464|8.857290|5.650916|5.026863|7.751127|0.061325|0.071690|0.100571|0.082849|0.064345|0.114475|0.097453|0.097886|0.086224|0.079017|0.085952|0.095997|0.500000| |2.844873|3.160519|3.667406|3.729215|3.236055|2.871513|4.023355|4.941913|3.660085|7.095827|5.844964|3.125967|4.517633|0.095141|2.673249|2.574582|2.896501|3.539154|4.916313|0.112920|2.954515|3.620133|4.073462|0.110497|5.686099|8.894341|17.734317|8.908558|5.668600|6.768702|0.070546|0.082470|0.106743|0.085661|0.071494|0.080310|0.076525|0.070880|0.067838|0.062791|0.070828|0.076793|0.213016|0.500000| |3.071473|3.145389|3.452782|3.741302|3.615610|3.265718|3.771399|4.959073|3.395654|5.902260|4.820793|2.973906|4.390444|0.099585|2.632740|2.599280|2.802576|3.212116|4.258418|0.090780|2.714932|3.490009|3.597141|0.090685|5.048086|5.646769|8.881377|17.753613|8.905180|7.776302|0.076786|0.079483|0.091781|0.099143|0.084088|0.073348|0.076391|0.067043|0.068739|0.062988|0.075207|0.070137|0.123685|0.212746|0.500000| 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