Version2.0 2020-07-31T03:08:25Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 15-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOc1ccc(cc1)c2nc(on2)C[NH+]3CCC[C@H]3C(=O)NCC(F)(F)F C54991940 RHF 6-31G(d) (6D,7F) CCOc1ccc(cc1)c2nc(on2)C[NH+]3CCC[C@H]3C(=O)NCC(F)(F)F C01[X(C18H22F3N4O3)] 144 C1 464 CCOc1ccc(cc1)c1noc(n1)C[NH+]1CCC[C@H]1C(=O)NCC(F)(F)F CCOc1ccc(cc1)c1noc(n1)C[NH+]1CCC[C@H]1C(=O)NCC(F)(F)F CCOc1ccc(cc1)c2noc(C[NH+]3CCC[C@H]3C(=O)NCC(F)(F)F)n2 InChIKey=HMISPFCZSLEFSH-AWEZNQCLSA-O InChI=1S/C18H21F3N4O3/c1-2-27-13-7-5-12(6-8-13)16-23-15(28-24-16)10-25-9-3-4-14(25)17(26)22-11-18(19,20)21/h5-8,14H,2-4,9-11H2,1H3,(H,22,26)/p+1/t14-/m0/s1 InChI=1/C18H21F3N4O3/c1-2-27-13-7-5-12(6-8-13)16-23-15(28-24-16)10-25-9-3-4-14(25)17(26)22-11-18(19,20)21/h5-8,14H,2-4,9-11H2,1H3,(H,22,26)/p+1/t14-/m0/s1/fC18H22F3N4O3/h22,25H/q+1 CCOc1ccc(cc1)c2nc(on2)C[NH+]3CCC[C@H]3C(=O)NCC(F)(F)F C01[X(C18H22F3N4O3)] 144 C01 464 CCOc1ccc(cc1)c1noc(n1)C[NH+]1CCC[C@H]1C(=O)NCC(F)(F)F CCO[C]1[CH][CH][C]([CH][CH]1)[C]1[N]OC(=[N]1)C[NH]1CCC[C@H]1[C]([NH]CC(F)(F)F)=O CCO[C]1[CH][CH][C]([CH][CH]1)[C]2[N]OC(=N2)C[NH]3CCC[C@H]3C(=O)NCC(F)(F)F InChIKey=XXXZPGBVRNLGFK-AWEZNQCLSA-N InChI=1S/C18H22F3N4O3/c1-2-27-13-7-5-12(6-8-13)16-23-15(28-24-16)10-25-9-3-4-14(25)17(26)22-11-18(19,20)21/h5-8,14,25H,2-4,9-11H2,1H3,(H,22,26)/t14-/m0/s1 InChI=1/C18H22F3N4O3/c1-2-27-13-7-5-12(6-8-13)16-23-15(28-24-16)10-25-9-3-4-14(25)17(26)22-11-18(19,20)21/h5-8,14,25H,2-4,9-11H2,1H3,(H,22,26)/t14-/m0/s1/f/h22H 2660.1973390385 -1434.9328942 1-A 17365.2341 104 360 464 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -26.43520 -26.43469 -26.43397 -20.79136 -20.69155 -20.66351 -15.85487 -15.74497 -15.73505 -15.70189 -11.59883 -11.51674 -11.49128 -11.46968 -11.46306 -11.45079 -11.42776 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425.3444 434.0897 462.9861 475.5113 493.4275 517.8225 540.7804 547.9157 575.3240 586.3192 593.2445 611.6658 672.7706 688.3582 708.0379 726.2609 747.9496 771.8809 788.5746 829.1210 838.8671 868.2284 888.4357 891.6582 899.0690 926.8126 931.4529 937.0208 956.7873 979.9888 988.8860 999.7947 1014.0226 1022.9624 1050.9158 1057.4237 1081.1660 1093.8512 1103.0265 1108.2906 1111.2837 1119.5711 1136.3696 1149.6169 1160.0290 1164.7079 1187.1850 1211.9539 1227.8650 1239.2156 1246.5228 1298.9065 1301.4241 1311.2049 1319.9312 1329.8708 1335.1128 1356.6273 1379.4940 1394.8152 1402.6298 1433.4027 1434.3951 1442.1250 1452.1519 1453.2602 1466.5407 1471.5439 1476.7401 1491.1445 1509.3387 1513.1410 1536.1868 1545.3383 1548.6318 1581.7836 1582.4732 1593.2270 1595.7582 1622.6213 1628.3578 1629.6237 1633.7395 1639.0073 1643.7251 1645.5653 1667.1882 1673.4476 1693.7859 1742.0602 1750.2525 1774.4073 1807.5651 1866.2085 1940.0953 3214.9388 3223.0903 3243.2002 3248.4640 3258.6368 3283.1932 3290.1591 3291.1998 3293.5379 3303.4652 3308.5633 3314.7519 3326.7307 3354.7369 3361.9977 3368.5174 3390.5263 3397.8866 3408.8993 3420.3427 3559.3600 3866.4828 7.5233 5.4854 5.1300 5.0257 4.7072 5.3625 6.5689 7.5399 5.7041 6.2562 5.1125 4.8452 1.7645 3.6063 4.8491 3.6550 4.9885 4.7788 4.3529 3.7887 1.2872 5.6429 3.7383 3.3702 5.3452 4.4279 2.6064 5.2068 4.2302 3.1721 4.6520 4.5100 3.8188 2.3868 1.9510 6.8790 2.7066 2.8102 4.8093 3.2603 6.1549 6.2938 8.2446 5.2179 4.0215 3.6189 4.5933 5.7050 4.7551 2.5860 4.3184 1.1213 6.6914 1.2314 2.1190 1.7559 2.2098 2.4052 2.5701 2.4218 5.2682 2.2023 6.5680 3.2806 1.3501 2.4825 2.7317 1.3405 2.4021 2.5775 2.9087 3.9086 4.0712 3.7749 4.4635 1.4754 2.3112 2.2707 1.5143 1.2210 1.3367 4.7982 1.2341 1.9510 1.6352 2.5882 1.8572 1.2675 1.0974 2.6785 4.8875 1.9675 1.7365 1.6242 1.9151 1.6402 1.3928 1.4009 1.3838 1.3956 1.6741 1.7938 1.7677 1.5776 2.1090 1.6224 1.1166 1.0401 1.0997 1.1136 1.1438 1.0579 1.1398 1.1323 1.2593 2.2127 7.2201 2.1431 7.0041 5.1875 10.5074 8.9337 1.0523 1.0409 1.0717 1.0645 1.1101 1.0630 1.0643 1.1029 1.0655 1.1058 1.0995 1.1005 1.0922 1.1121 1.1093 1.1067 1.0903 1.0907 1.0967 1.0944 1.0779 1.0796 0.0004 0.0011 0.0023 0.0031 0.0044 0.0066 0.0115 0.0166 0.0209 0.0334 0.0315 0.0353 0.0149 0.0517 0.0755 0.0804 0.1404 0.1408 0.1742 0.1550 0.0592 0.2905 0.2199 0.2266 0.3875 0.3719 0.2529 0.5550 0.4696 0.4006 0.6197 0.6470 0.6033 0.4113 0.3451 1.3415 0.5482 0.5827 1.0601 0.8695 1.7183 1.8590 2.5622 1.7199 1.4117 1.3259 1.8604 2.3653 2.1119 1.2026 2.0229 0.5340 3.3865 0.6295 1.0962 0.9471 1.2504 1.3858 1.5136 1.4672 3.2481 1.4331 4.3269 2.2594 0.9518 1.7795 1.9769 0.9753 1.7740 1.9610 2.2649 3.0989 3.2539 3.1346 3.8628 1.3106 2.0911 2.0788 1.5052 1.2184 1.3540 4.9253 1.2860 2.0490 1.7732 2.9020 2.1288 1.4692 1.3285 3.2470 5.9889 2.4445 2.1608 2.0582 2.4434 2.1074 1.8247 1.8803 1.8667 1.9404 2.3555 2.5347 2.6059 2.3277 3.1541 2.4342 1.7322 1.6249 1.7207 1.7513 1.8104 1.6840 1.8185 1.8543 2.0778 3.7401 12.9099 3.8681 12.9929 9.9861 21.5609 19.8120 6.4079 6.3709 6.6418 6.6181 6.9449 6.7509 6.7878 7.0390 6.8097 7.1097 7.0910 7.1246 7.1215 7.3743 7.3876 7.3991 7.3848 7.4195 7.5085 7.5434 8.0455 9.5089 0.3904 3.0921 0.9270 2.0853 1.5085 0.4098 0.1298 0.8016 5.3062 7.1217 0.5142 2.4903 2.2071 2.0455 6.4279 13.1468 3.1340 8.7865 0.7614 1.7601 2.5977 0.5364 13.8769 8.2019 6.7337 17.1260 3.7988 0.2198 7.8355 1.1649 4.5412 1.1786 34.8624 34.3679 66.5798 2.3635 6.0102 18.0082 11.7555 1.9748 8.5697 38.2087 26.6676 19.7117 9.4668 2.6367 6.7532 18.9037 34.8281 6.3628 1.4996 1.4213 22.9879 0.8469 3.1128 57.1733 7.0899 3.2136 2.7403 27.3753 128.9996 74.8502 2.8890 10.5330 0.0425 12.6219 1.0224 0.1126 47.8547 52.2682 14.9915 42.5227 26.5664 24.5264 4.6706 5.4612 5.9962 44.7741 5.6796 131.2999 9.9554 60.4182 10.9731 154.6069 103.0569 293.7081 31.9374 8.5088 1.6950 77.1388 778.6238 7.9675 112.3690 59.5045 91.9642 32.9979 28.8410 72.5830 59.8159 2.2192 100.4501 43.8983 124.4584 150.6643 48.0298 31.3268 25.9810 5.0263 17.7712 22.1875 2.4805 3.8823 22.4864 15.1143 92.5056 119.4930 44.3770 295.8057 55.2290 333.2323 197.9734 273.3753 25.5508 24.5820 7.4647 10.5468 27.9540 1.3882 4.0787 31.2806 8.3754 43.5403 2.7090 4.5843 1.8575 3.3758 0.5625 0.5762 3.0941 4.6240 2.6817 8.2504 153.2736 73.3607 1.2363 2.6671 2.0081 1.2778 0.8516 0.4130 0.9715 0.1562 0.5662 0.4252 1.0329 0.2854 0.6708 0.0983 0.4863 0.4076 1.2527 0.3859 1.9128 0.4952 0.1169 1.2737 0.4347 0.4156 1.0511 1.2174 0.2473 4.0844 1.7256 0.2785 0.7051 1.7056 1.2831 3.7914 2.8404 0.3473 0.0431 0.8638 1.1074 1.4071 5.9913 8.8125 1.0455 2.6353 2.2474 1.4480 1.1439 2.0208 3.4349 10.4713 22.4379 0.6239 8.5806 1.9063 2.1370 0.7544 1.4164 8.5738 11.6405 6.2621 27.5680 2.7023 33.0864 5.0007 2.9517 7.1980 4.0865 0.2695 10.2783 7.3487 9.9167 8.5550 3.5602 5.1030 27.6145 2.0321 2.9093 24.4147 1.3132 44.5876 5.2792 5.6958 4.7601 1.9884 2.4770 0.9568 6.5137 4.3392 14.5814 6.7245 98.7003 5.3349 4.2239 10.6801 2.7914 28.9665 3.6980 8.5216 4.7377 8.7029 11.9806 9.4886 4.2656 46.4700 36.0074 22.9781 8.2337 24.1895 10.5256 12.5905 10.3054 16.7366 6.4498 1.9444 17.6702 8.9518 235.9335 2.3658 51.8906 600.6502 27.1127 4.3842 23.5594 179.3867 121.1094 24.6991 64.1480 46.1621 87.5536 93.9920 75.7334 42.0468 75.4603 128.8599 40.7326 35.0457 56.1642 29.0141 32.2999 40.3960 111.8180 98.6508 15.3229 32.1643 0.7383 0.7446 0.7500 0.7433 0.7430 0.6555 0.7398 0.7496 0.6921 0.7334 0.7430 0.5626 0.7479 0.6233 0.6020 0.1510 0.4415 0.4034 0.1261 0.4519 0.0532 0.0693 0.5012 0.6566 0.7332 0.3490 0.1612 0.7498 0.2288 0.2753 0.1098 0.1675 0.7198 0.3839 0.1871 0.7348 0.6605 0.6435 0.6637 0.2848 0.6856 0.2871 0.6331 0.6491 0.3731 0.6121 0.2791 0.7340 0.2977 0.1056 0.1315 0.7491 0.0492 0.7497 0.7481 0.7473 0.7215 0.4535 0.1221 0.7397 0.2953 0.4225 0.2310 0.0792 0.7466 0.5539 0.7262 0.7480 0.2342 0.5322 0.4184 0.3889 0.2212 0.7400 0.2494 0.6513 0.2531 0.2117 0.7474 0.2318 0.5336 0.6536 0.7172 0.5950 0.6376 0.3175 0.7441 0.4553 0.7494 0.5540 0.3545 0.7365 0.5614 0.3806 0.7393 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0.8501 0.7099 0.6149 0.7589 0.6596 0.5895 0.6275 0.5209 0.8571 0.6678 0.3952 0.6126 0.8212 0.8571 0.8518 0.8399 0.8054 0.8409 0.7356 0.8368 0.5641 0.3225 0.4893 0.7035 0.2800 0.5761 0.6309 0.3373 0.7297 0.0239 0.1967 0.6804 0.8570 0.2488 0.2078 0.8424 0.2322 0.8569 0.5816 0.5133 0.3248 0.8226 0.7996 0.8313 0.8499 0.8094 0.3422 0.3025 0.2101 0.3584 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 47 48 49 50 6 6 8 6 6 6 6 6 6 6 7 6 8 7 6 7 1 6 6 6 6 1 6 8 7 6 6 9 9 9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 15.99491 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 1.00783 12.00000 15.99491 14.00307 12.00000 12.00000 18.99840 18.99840 18.99840 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 6998.5624 25829.4047 30845.2916 0.99956 -0.02921 0.00589 0.02912 0.99947 0.01423 -0.00630 -0.01405 0.99988 1 0.01238 0.00335 0.00281 0.25787 0.06987 0.05851 12.99 27.09 39.69 46.66 57.34 65.95 78.59 87.96 113.57 136.88 147.02 160.00 172.27 224.49 233.85 277.95 314.41 321.79 374.99 379.14 401.94 425.33 454.57 485.98 504.69 543.20 583.94 611.98 624.56 666.13 684.15 709.93 745.03 778.06 788.33 827.76 843.58 853.55 880.05 967.97 990.39 1018.71 1044.93 1076.13 1110.56 1134.58 1192.92 1206.94 1249.19 1278.26 1282.90 1293.56 1333.48 1340.15 1348.16 1376.60 1409.99 1422.79 1438.48 1458.95 1471.81 1512.03 1521.40 1555.56 1573.81 1587.01 1594.58 1598.89 1610.81 1634.98 1654.04 1669.02 1675.75 1708.09 1743.73 1766.62 1782.95 1793.47 1868.84 1872.46 1886.53 1899.09 1913.39 1920.93 1951.88 1984.78 2006.83 2018.07 2062.35 2063.77 2074.90 2089.32 2090.92 2110.03 2117.22 2124.70 2145.42 2171.60 2177.07 2210.23 2223.40 2228.14 2275.83 2276.83 2292.30 2295.94 2334.59 2342.84 2344.67 2350.59 2358.17 2364.95 2367.60 2398.71 2407.72 2436.98 2506.44 2518.22 2552.98 2600.68 2685.06 2791.36 4625.58 4637.31 4666.24 4673.82 4688.45 4723.78 4733.81 4735.30 4738.67 4752.95 4760.28 4769.19 4786.42 4826.72 4837.16 4846.55 4878.21 4888.80 4904.65 4921.11 5121.13 5563.01 0.435293 0.459752 0.460696 0.375207 -1434.497602 -1434.473142 -1434.472198 -1434.557687 2.867315D-04 MUNgauss RevisionA2.0 retrievium 31-Jul-2020 DUDE CCOc1ccc(cc1)c2nc(on2)C[NH+]3CCC[C@H]3C(=O)NCC(F)(F)F C54991940 RHF 6-31G(d) (6D,10F) C1 399.164401 |X|Y|Z| 57.048797 25.873502 115.935768 55.518755 17 6 7 8 13 3 1 |36.858105| |12.582864|36.858105| |8.066014|13.467225|73.516695| |5.240597|7.967401|25.429044|36.858105| |4.097120|5.236016|14.643490|13.600115|36.858105| |3.208041|3.977134|9.468309|7.929238|13.912582|36.858105| |2.975427|3.773629|8.229792|6.836798|7.922333|13.602117|36.858105| |3.338186|4.495809|9.283265|7.944145|6.887437|7.937717|13.748079|36.858105| |4.395371|6.675017|14.045187|13.710078|7.898379|6.856081|7.896183|13.750898|36.858105| |2.424025|2.937894|6.073164|4.484525|5.088951|7.656868|13.033996|7.712448|5.082128|36.858105| |2.213129|2.664431|5.249409|3.712400|3.882796|5.055149|7.612064|6.537191|4.430850|13.723874|53.358707| |1.949340|2.284420|4.482939|3.060989|3.280230|4.195977|5.486113|4.618721|3.460893|9.225997|20.502094|36.858105| |1.917855|2.219616|4.445453|3.022458|3.397850|4.483464|5.386543|4.186366|3.253133|9.032392|11.973644|14.573530|73.516695| |2.184706|2.563432|5.312469|3.744405|4.458195|6.557353|7.837539|5.198582|3.936212|14.808511|11.628750|8.839983|24.413334|53.358707| |1.721040|1.984174|3.797974|2.508596|2.620087|3.161227|3.887874|3.550768|2.823383|5.379941|10.507780|12.729149|14.019615|7.241203|36.858105| |1.601919|1.825177|3.478531|2.262122|2.366070|2.803627|3.317592|3.049034|2.503336|4.341431|7.504304|7.666759|11.097005|6.085654|12.728779|53.358707| |1.672383|1.915958|3.645180|2.379701|2.469857|2.919488|3.496669|3.254794|2.658112|4.512912|7.845821|7.265982|10.336751|6.090729|9.312085|25.494573|0.500000| |1.445242|1.627975|3.054212|1.947305|2.005994|2.305923|2.665270|2.532115|2.146415|3.273980|5.459184|4.954262|7.547033|4.513990|7.578063|17.041534|0.253495|36.858105| |1.332912|1.483789|2.795731|1.765172|1.841536|2.106852|2.361162|2.206860|1.904381|2.861159|4.488155|4.069361|6.823998|4.112665|5.519358|10.755108|0.168940|12.509412|36.858105| |1.372614|1.526595|2.907268|1.841741|1.950881|2.253832|2.494128|2.278527|1.963606|3.049483|4.610130|4.230836|7.585158|4.542031|5.184565|10.730822|0.180867|7.982996|12.477784|36.858105| |1.537020|1.731492|3.338449|2.156282|2.311440|2.751369|3.115396|2.765780|2.315378|4.036707|6.200195|6.231731|11.442457|6.197182|7.484659|17.128470|0.262468|7.767676|7.934873|12.397259|36.858105| |1.544398|1.737452|3.374789|2.184866|2.373354|2.856226|3.199680|2.780405|2.324427|4.219729|6.287982|6.586817|13.561037|6.835035|7.486041|12.252880|0.188588|6.196738|6.670916|8.752555|17.654678|0.500000| |1.630999|1.840835|3.583547|2.325460|2.521809|3.023481|3.379650|2.949034|2.472913|4.319115|6.216223|5.732826|11.164008|6.717016|5.615155|10.621792|0.232913|5.306417|5.104641|7.431186|12.458749|0.243446|36.858105| |1.719600|1.957118|3.787310|2.469247|2.631564|3.130378|3.584258|3.206005|2.670562|4.483977|6.631767|5.656363|9.922014|6.445080|5.409945|10.022076|0.273255|5.116677|4.480189|5.753484|8.096438|0.168687|15.828516|73.516695| |1.586353|1.769748|3.475426|2.232544|2.469648|2.942863|3.131936|2.689324|2.309186|3.852772|5.152196|4.538771|9.636587|6.289178|4.258058|7.080018|0.147006|4.010537|4.158626|5.973255|7.840647|0.197555|14.299200|15.017221|53.358707| |1.617494|1.791508|3.532023|2.246870|2.498789|2.920595|3.005358|2.597227|2.282648|3.490019|4.493536|3.681792|7.580093|5.523489|3.361681|5.318115|0.115314|3.184664|3.229792|4.259877|5.011017|0.128906|7.811042|11.998560|17.915224|36.858105| |1.454702|1.590482|3.088873|1.926445|2.102290|2.380630|2.439414|2.177942|1.955576|2.751607|3.639945|2.946145|5.801542|4.194066|2.828345|4.544059|0.097654|2.912315|3.049002|4.007899|4.181244|0.105931|5.689662|9.160193|10.682890|12.600618|36.858105| |1.408151|1.543135|2.960635|1.843539|1.974594|2.221272|2.326654|2.121568|1.900721|2.630981|3.600784|2.916818|5.514485|3.895798|2.902171|4.856766|0.106395|3.205042|3.349869|4.449108|4.375641|0.105098|5.843719|9.944926|9.228766|8.135534|14.422741|97.533100| |1.453311|1.575382|3.057088|1.884630|2.053765|2.280749|2.292679|2.066142|1.890076|2.503103|3.263373|2.563213|4.990011|3.746975|2.430008|3.779756|0.081813|2.461737|2.531850|3.151574|3.288110|0.084990|4.253844|7.324311|7.244046|8.193906|14.505185|20.038603|97.533100| |1.354461|1.471235|2.852682|1.768513|1.933992|2.182252|2.219820|1.981043|1.786933|2.508368|3.324690|2.726397|5.433239|3.871651|2.664069|4.230919|0.087515|2.781785|3.039557|4.014357|3.984650|0.104828|4.894389|7.443935|9.288728|8.163376|14.379687|20.112847|20.033045|97.533100| |17.584175|8.865637|12.928879|4.892944|4.026266|3.149907|2.870409|3.141324|4.020020|2.355502|2.910120|1.897899|3.346129|2.921893|1.676053|2.113318|0.044684|1.402377|1.300803|1.338210|1.497079|0.042078|1.578781|2.930896|2.100869|1.567576|1.409806|3.057935|3.162641|2.973881|0.500000| |17.583727|8.865282|12.929043|4.890434|4.022348|3.147220|2.868772|3.140154|4.019277|2.354264|2.906852|1.896242|3.344863|2.922286|1.674027|2.143302|0.045816|1.418977|1.314249|1.362844|1.523079|0.042395|1.631494|3.062285|2.174949|1.647620|1.485460|3.224036|3.366474|3.102423|0.300841|0.500000| |17.563591|8.892616|10.238878|4.241508|3.389559|2.776749|2.649620|3.001290|3.838737|2.208382|2.800039|1.820439|3.157828|2.711151|1.628651|2.069993|0.044102|1.384812|1.275816|1.306259|1.452064|0.040387|1.532377|2.877271|2.020620|1.509593|1.368747|3.000745|3.076204|2.872097|0.300572|0.300570|0.500000| |8.841092|17.561319|16.520601|7.089619|4.781432|3.810605|3.750699|4.600054|6.768912|2.949187|3.703061|2.319028|3.959272|3.467751|2.024473|2.502745|0.053301|1.647180|1.495393|1.524011|1.727946|0.048328|1.812120|3.412073|2.354450|1.728661|1.535992|3.367658|3.396257|3.213517|0.212154|0.173348|0.212446|0.500000| |8.841193|17.560507|16.519781|7.081634|4.774630|3.805713|3.746964|4.596345|6.765343|2.946710|3.696303|2.315985|3.957119|3.468343|2.020894|2.553012|0.055256|1.674283|1.515935|1.560721|1.768298|0.048810|1.893190|3.624718|2.460238|1.837921|1.635430|3.593689|3.652761|3.377623|0.173352|0.212140|0.212460|0.300580|0.500000| |4.134328|4.866533|13.546673|8.937260|17.749665|8.926450|5.625488|4.962365|5.646973|4.123718|4.422368|2.854303|5.356968|5.243101|2.334734|2.912742|0.061655|1.835963|1.709686|1.818215|2.125177|0.060819|2.319205|4.252053|3.153289|2.375992|2.021218|4.234774|4.493939|4.215089|0.116403|0.116236|0.093524|0.120503|0.120312|0.500000| |2.816453|3.326871|7.646258|5.644899|8.997320|17.736342|8.868811|5.645054|4.944696|7.049850|6.344686|4.154226|8.484009|9.943760|3.135123|3.830897|0.080355|2.303861|2.145038|2.329620|2.856152|0.083784|3.162239|5.654734|4.322766|3.163704|2.538724|5.222334|5.458069|5.278749|0.077901|0.077819|0.068396|0.088550|0.088426|0.215261|0.500000| |2.978768|3.898499|7.479646|5.658880|4.961656|5.642361|8.928117|17.744950|8.962148|7.113258|10.102412|4.972595|7.443175|6.542880|3.921749|4.500444|0.098903|2.757151|2.343363|2.377337|2.882770|0.079473|3.013883|5.909730|3.640071|2.538785|2.149772|4.792517|4.548397|4.399782|0.077648|0.077626|0.076586|0.113506|0.113439|0.107721|0.124013|0.500000| |4.660145|7.380697|12.500155|8.862214|5.615582|4.948063|5.645342|8.962648|17.777811|4.146046|5.279662|3.090951|5.075341|4.498344|2.617435|3.184190|0.069102|2.046584|1.808819|1.844237|2.140660|0.059234|2.263270|4.366218|2.861791|2.077429|1.810102|4.001277|3.948217|3.730176|0.114637|0.114661|0.117563|0.224810|0.225003|0.123973|0.107466|0.217690|0.500000| |1.624872|1.854170|3.548566|2.317252|2.437652|2.913776|3.460475|3.141452|2.561216|4.628338|8.106400|8.916028|12.587474|6.556735|17.619289|12.353736|0.181019|6.913533|5.729012|5.122665|6.859586|0.217665|4.860791|7.855178|5.366542|3.101548|2.654367|6.061749|5.136032|5.785295|0.044317|0.043836|0.042758|0.052753|0.051947|0.061141|0.081608|0.094278|0.066120|0.500000| |1.741688|2.018073|3.803796|2.502835|2.545335|3.003776|3.749109|3.616725|2.881898|4.895503|10.028786|9.077850|10.328800|6.107474|17.667635|12.378027|0.221729|7.097585|4.858255|4.326263|5.531253|0.147593|4.519118|8.261381|4.807609|2.926249|2.522763|5.895763|4.974854|5.321768|0.046925|0.046774|0.046094|0.057702|0.057421|0.062665|0.080654|0.115688|0.075658|0.299464|0.500000| |1.444205|1.629399|3.037382|1.933771|1.973386|2.254802|2.624411|2.532971|2.148876|3.193474|5.435558|4.809966|7.088823|4.306878|7.654826|12.151782|0.193323|17.664111|8.642228|5.701802|5.806144|0.143996|4.252400|7.412081|4.588316|2.756974|2.519352|6.120006|4.896093|5.451381|0.039004|0.039144|0.038564|0.046190|0.046422|0.050041|0.062030|0.077589|0.057338|0.206077|0.226998|0.500000| |1.431212|1.609838|2.999002|1.901528|1.940448|2.204498|2.540746|2.454831|2.101867|3.041772|5.013917|4.295062|6.578596|4.117133|5.870672|12.311547|0.243628|17.638088|8.776351|6.778116|6.297005|0.137052|4.995818|9.223875|5.159672|3.126722|2.923879|7.467201|5.611792|6.167974|0.038369|0.039146|0.038233|0.045079|0.046357|0.049379|0.060706|0.074569|0.056144|0.142754|0.163812|0.301007|0.500000| |1.314712|1.460838|2.757716|1.739784|1.822166|2.087201|2.327132|2.163168|1.869246|2.825309|4.397481|4.024756|6.867162|4.105286|5.463643|9.078187|0.140587|8.818868|17.564411|8.797941|6.847503|0.187344|4.460165|6.858688|5.186640|2.975956|2.780761|6.649139|5.257393|6.359224|0.035829|0.035897|0.034928|0.041072|0.041175|0.047111|0.059333|0.063511|0.049222|0.175025|0.131840|0.217226|0.173684|0.500000| |1.251184|1.384020|2.589304|1.619198|1.677659|1.892403|2.100340|1.989143|1.741685|2.480339|3.838544|3.338235|5.615653|3.522875|4.298390|7.753105|0.134980|8.800538|17.615961|8.705331|5.657750|0.136009|4.185154|6.791402|4.842258|2.891399|2.830021|7.123350|5.369211|6.394666|0.033895|0.034313|0.033412|0.038725|0.039352|0.043506|0.053328|0.058629|0.046332|0.122388|0.111082|0.194545|0.218714|0.302134|0.500000| |1.314127|1.450999|2.771541|1.744802|1.862907|2.143050|2.323653|2.107027|1.836116|2.803960|4.102674|3.709156|6.969461|4.264347|4.309144|7.764180|0.135364|5.679281|8.692624|17.616064|8.757428|0.219878|6.199248|8.400851|7.927145|4.197322|4.065446|9.785574|7.150724|9.787424|0.035749|0.036314|0.034702|0.040178|0.040986|0.048708|0.062300|0.060273|0.047808|0.123708|0.100801|0.125706|0.137368|0.215819|0.196834|0.500000| |1.354058|1.502201|2.848542|1.795200|1.890214|2.161422|2.381289|2.200120|1.913010|2.849253|4.272944|3.759123|6.653733|4.166736|4.416073|9.004865|0.173622|6.891684|8.804742|17.566532|8.788556|0.174026|7.260052|10.861760|7.986645|4.444063|4.414749|11.948920|7.727486|9.658466|0.036507|0.037500|0.035874|0.041457|0.042930|0.049040|0.061690|0.063779|0.050163|0.116036|0.107326|0.138553|0.191345|0.173386|0.216269|0.301940|0.500000| |1.513354|1.677687|3.294021|2.102690|2.335768|2.770874|2.908415|2.494652|2.158652|3.562353|4.742509|4.233717|9.254617|5.936912|4.058113|6.524663|0.127560|3.839422|4.203197|6.073224|7.470762|0.213890|9.431256|10.832752|26.029609|9.051960|6.694193|12.777273|10.647169|15.660680|0.041175|0.042247|0.039365|0.045743|0.047228|0.061415|0.084073|0.068707|0.054689|0.109538|0.092859|0.090899|0.098152|0.110878|0.099577|0.181855|0.155087|0.500000| |1.728699|1.929515|3.806404|2.437360|2.693068|3.146677|3.274779|2.847067|2.493014|3.751670|4.817410|3.816568|7.583377|5.718608|3.409684|5.356649|0.121676|3.170248|3.080537|3.911786|4.694137|0.117761|7.490715|13.874645|12.525134|17.677452|8.956246|16.414283|16.503205|13.203370|0.046160|0.049064|0.044756|0.051409|0.055520|0.070392|0.092911|0.077267|0.062900|0.084971|0.083897|0.076655|0.088201|0.078120|0.076926|0.102751|0.115157|0.179672|0.500000| 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