Version2.2 2021-02-11T06:08:17Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 29-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CSc2ncc3n2cccc3 C24902849 RHF 6-31G(d) (6D,7F) CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CSc2ncc3n2cccc3 C01[X(C19H17F3N4O2S1)] 132 C1 473 O=C(Nc1ccccc1C(F)(F)F)CN(C(=O)CSc1ncc2n1cccc2)C O=C(Nc1ccccc1C(F)(F)F)CN(C(=O)CSc1ncc2n1cccc2)C Fc1cccc(N[C@H]2[NH+]=C3C=CC=CC3=NC2=N[S](=O)(=O)c4ccc(Br)cc4)c1 InChIKey=RZBUJWBNOPYDDP-UHFFFAOYSA-N InChI=1S/C19H17F3N4O2S/c1-25(11-16(27)24-15-8-3-2-7-14(15)19(20,21)22)17(28)12-29-18-23-10-13-6-4-5-9-26(13)18/h2-10H,11-12H2,1H3,(H,24,27) InChI=1/C19H17F3N4O2S/c1-25(11-16(27)24-15-8-3-2-7-14(15)19(20,21)22)17(28)12-29-18-23-10-13-6-4-5-9-26(13)18/h2-10H,11-12H2,1H3,(H,24,27)/f/h24H CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CSc2ncc3n2cccc3 C01[X(C19H17F3N4O2S1)] 132 C01 473 O=C(Nc1ccccc1C(F)(F)F)CN(C(=O)CSc1ncc2n1cccc2)C O=C(N[C]1[CH][CH][CH][CH][C]1C(F)(F)F)CN(C(=O)CS[C]1[N][CH][C]2[CH]=[CH][CH]=CN12)C CN(CC(=O)N[C]1[CH][CH][CH][CH][C]1C(F)(F)F)C(=O)CS[C]2[N][CH][C]3C=CC=CN23 InChIKey=RZBUJWBNOPYDDP-UHFFFAOYSA-N InChI=1S/C19H17F3N4O2S/c1-25(11-16(27)24-15-8-3-2-7-14(15)19(20,21)22)17(28)12-29-18-23-10-13-6-4-5-9-26(13)18/h2-10H,11-12H2,1H3,(H,24,27) InChI=1/C19H17F3N4O2S/c1-25(11-16(27)24-15-8-3-2-7-14(15)19(20,21)22)17(28)12-29-18-23-10-13-6-4-5-9-26(13)18/h2-10H,11-12H2,1H3,(H,24,27)/f/h24H 2765.4562280695 -1792.7729036 1-A 22335.9741 109 364 473 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -91.95674 -26.34894 -26.34794 -26.34193 -20.54389 -20.53704 -15.64173 -15.61069 -15.59980 -15.55061 -11.51393 -11.36563 -11.36102 -11.31689 -11.30676 -11.29074 -11.28367 -11.27128 -11.26808 -11.26798 -11.26444 -11.25716 -11.25093 -11.25024 -11.24626 -11.24397 -11.24272 -11.24011 -11.23802 -8.96646 -6.64937 -6.64790 -6.64574 -1.74521 -1.64384 -1.63823 -1.41683 -1.40483 -1.37248 -1.27316 -1.26187 -1.21870 -1.17114 -1.11190 -1.08734 -1.07183 -1.05482 -1.04259 -1.00908 -0.98617 -0.96826 -0.95514 -0.90482 -0.88092 -0.87870 -0.87197 -0.83412 -0.83018 -0.82726 -0.80765 -0.79435 -0.79382 -0.75366 -0.72630 -0.71598 -0.71436 -0.71186 -0.70927 -0.69967 -0.68417 -0.67414 -0.66732 -0.66418 -0.66231 -0.66036 -0.65182 -0.64733 -0.64180 -0.63687 -0.63399 -0.62421 -0.61994 -0.61281 -0.60111 -0.59116 -0.58720 -0.58182 -0.56959 -0.55411 -0.54825 -0.54343 -0.53369 -0.53132 -0.51811 -0.51676 -0.51376 -0.48422 -0.46451 -0.44614 -0.44376 -0.44131 -0.43034 -0.42600 -0.38888 -0.38009 -0.35886 -0.34406 -0.32876 -0.25964 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.11223 0.11249 0.12902 0.15803 0.18123 0.19255 0.19703 0.22789 0.23835 0.24225 0.24893 0.25239 0.26060 0.26576 0.28004 0.28431 0.29619 0.30169 0.30756 0.31264 0.31586 0.31682 0.32908 0.33257 0.33451 0.34093 0.34475 0.35387 0.36591 0.36608 0.37348 0.38422 0.39883 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1.41781 1.43055 1.43697 1.44275 1.45287 1.45691 1.46827 1.47033 1.47427 1.49650 1.51024 1.51993 1.53052 1.55974 1.57985 1.58418 1.59657 1.61835 1.61973 1.62405 1.63631 1.64793 1.65077 1.66190 1.67056 1.67264 1.68312 1.69846 1.70187 1.71080 1.71933 1.72531 1.73100 1.73446 1.74848 1.75799 1.76124 1.76578 1.76677 1.77527 1.78690 1.80196 1.80304 1.82937 1.83972 1.85033 1.90550 1.91470 1.93924 1.94110 1.95187 1.96347 2.00231 2.00636 2.01643 2.02646 2.04276 2.05461 2.07064 2.08309 2.08905 2.09331 2.11753 2.12310 2.12636 2.13771 2.14285 2.15229 2.17396 2.18408 2.18961 2.19799 2.20547 2.21441 2.22505 2.23228 2.24875 2.25133 2.25195 2.27331 2.27668 2.28766 2.29101 2.30425 2.30968 2.32113 2.32584 2.33533 2.35384 2.35859 2.36651 2.37261 2.38860 2.39167 2.40000 2.40810 2.41506 2.42381 2.43480 2.44167 2.44950 2.45768 2.46932 2.47626 2.49330 2.49748 2.50217 2.51694 2.52792 2.55819 2.56056 2.57702 2.58824 2.59938 2.60593 2.61430 2.62267 2.63397 2.63471 2.64692 2.65219 2.66478 2.68138 2.68714 2.70961 2.71752 2.72055 2.74838 2.76293 2.78903 2.79358 2.81643 2.83442 2.86663 2.87315 2.91886 2.92735 2.93647 2.94362 2.96787 2.97717 2.98060 2.99379 3.00701 3.02402 3.02627 3.03152 3.03664 3.04542 3.05523 3.07947 3.08450 3.10539 3.11361 3.14297 3.14544 3.19896 3.20161 3.24174 3.26441 3.28157 3.29974 3.32238 3.36175 3.36545 3.41475 3.41952 3.42551 3.43831 3.46409 3.48026 3.53316 3.57699 3.64907 3.68352 3.82724 3.83725 4.34776 4.44841 4.46824 4.49050 4.51011 4.51602 4.52328 4.53368 4.54949 4.57513 4.58719 4.62196 4.65272 4.68026 4.69000 4.72679 4.75628 4.77558 4.79336 4.80371 4.83315 4.87722 4.89328 4.97429 5.01342 5.13116 5.20150 5.37971 6.34192
10.11902
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|XX|YY|ZZ|XY|XZ|YZ| 18.3507 1.0704 -19.4212 -0.2396 -2.9063 2.3706
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ| -130.6826 -17.6526 19.6357 67.6821 152.4147 -14.5796 27.5825 -9.3382 -6.9106 -51.1160
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5.1195 4.2039 3.4290 1.6708 4.5883 5.1126 2.4918 4.6367 5.6227 5.9057 6.4119 5.9120 6.2714 5.3697 4.4908 9.5501 7.1447 6.9534 5.5455 2.9777 2.8759 7.0635 7.6490 4.4032 6.4486 3.5844 1.7289 3.4551 6.8711 3.3236 2.2906 2.8664 7.1568 5.3139 5.5682 4.9269 6.7829 7.8488 4.8447 5.5955 5.2584 5.9974 6.4319 1.3076 5.5739 1.3342 4.5103 1.4260 4.5680 4.9441 1.5445 5.2191 1.4446 1.9951 5.0119 2.8605 2.3945 1.3003 1.3775 1.3138 6.5719 1.3398 2.9203 3.2445 2.7585 2.9106 1.8814 1.6234 1.4153 1.7954 1.5305 1.3098 2.5319 1.1456 3.8740 2.1117 1.7924 1.9307 2.6579 2.7415 2.3841 2.0166 2.2300 3.4806 3.2821 1.8724 2.7716 2.4634 1.5504 2.1824 3.5599 1.1680 1.1226 3.3802 2.5127 1.2256 1.0755 2.3860 1.1112 5.5318 2.1118 5.6325 4.5674 4.9490 5.5677 11.4870 9.1406 1.0387 1.0636 1.0604 1.1059 1.0995 1.1063 1.1027 1.0891 1.0880 1.0951 1.0938 1.0961 1.0946 1.0988 1.0981 1.0943 1.0781 0.0004 0.0004 0.0010 0.0027 0.0108 0.0165 0.0175 0.0191 0.0196 0.0189 0.0276 0.0149 0.0557 0.0652 0.0394 0.0888 0.1326 0.1541 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11.8573 19.8029 1.4783 4.4917 0.1857 17.3386 66.4385 6.9216 2.5755 3.7559 7.3414 8.7982 1.9684 3.5065 7.2805 12.3104 4.1066 20.2593 14.6432 1.9576 33.6071 10.1809 4.3274 46.9849 4.3423 56.3434 26.2261 14.3533 4.2843 1.6208 23.0817 14.1832 0.0665 18.0295 12.3250 11.7675 3.1885 0.0168 5.1756 0.9627 63.7378 0.4580 24.0995 27.3828 28.4073 60.0498 72.8121 164.2844 21.8013 10.6198 4.2437 0.9506 173.6378 9.0195 158.8115 97.0506 72.2488 10.6393 183.8021 64.4346 4.4807 99.1591 324.7127 21.6530 289.2311 49.1578 99.7709 12.8515 25.6157 187.9719 44.6143 47.8283 14.5404 72.2442 104.2098 23.7124 36.8983 13.7657 73.5369 6.7073 366.3827 3.2516 185.1109 37.1582 25.3919 301.8704 191.1099 26.5766 26.4311 22.8618 27.9290 6.7443 5.7047 24.9097 4.9630 2.4829 19.6000 14.6327 16.3755 7.2361 1.8746 12.0648 0.2300 70.7967 1.5176 5.3195 4.4856 3.9525 1.1113 0.9628 1.1156 0.0632 4.3737 0.5348 1.8147 1.5692 3.6316 2.0425 0.8971 2.9846 0.5727 0.7815 0.8536 0.7902 1.1061 0.6531 0.8260 1.2099 1.0818 2.5439 1.7833 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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 7 6 6 8 7 6 6 6 6 6 6 6 9 9 9 6 8 6 16 6 7 6 6 7 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 14.00307 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 18.99840 18.99840 12.00000 15.99491 12.00000 31.97207 12.00000 14.00307 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
4050.1330 39502.9274 41159.0720 0.99999 0.00369 -0.00277 -0.00361 0.99966 0.02593 0.00287 -0.02592 0.99966 1 0.02139 0.00219 0.00210 0.44560 0.04569 0.04385 12.33 13.64 24.78 35.03 61.16 85.28 88.89 98.90 115.99 125.57 168.22 177.14 206.52 211.72 235.62 259.35 287.82 302.76 327.35 374.49 387.59 465.80 475.55 479.38 533.74 551.93 565.36 627.20 664.37 699.90 704.46 744.42 764.94 772.38 785.00 838.16 889.62 890.70 900.38 917.10 921.90 943.57 959.72 986.96 1006.73 1029.24 1081.19 1153.67 1162.27 1178.82 1191.31 1191.75 1231.83 1246.11 1263.23 1304.00 1304.31 1333.83 1338.58 1422.33 1435.90 1486.42 1510.91 1525.94 1532.40 1545.46 1573.61 1595.96 1596.97 1625.94 1639.06 1639.85 1685.01 1757.07 1779.45 1785.69 1803.13 1803.90 1820.33 1847.83 1874.04 1887.16 1893.90 1913.95 1918.08 1967.54 1970.68 1992.42 2029.32 2060.03 2081.51 2116.86 2122.53 2129.98 2169.07 2221.21 2234.35 2270.62 2301.85 2303.56 2314.70 2341.61 2342.42 2346.25 2375.00 2386.16 2408.06 2468.77 2483.22 2509.03 2579.13 2620.71 2683.58 2784.00 2852.36 4653.27 4671.82 4713.34 4750.31 4770.71 4791.20 4795.37 4852.66 4860.40 4878.98 4886.04 4898.05 4915.96 4944.01 4962.32 4965.24 5597.18 0.372058 0.396721 0.397665 0.310950 -1792.400846 -1792.376183 -1792.375239 -1792.461954 2.908435D-04
MUNgauss RevisionA2.1 retrievium 11-Feb-2021 DUDE CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CSc2ncc3n2cccc3 C24902849 RHF 6-31G(d) (6D,10F) C1 422.102432 |X|Y|Z| 140.913434 41.221946 27.930805
54.540793 22 6 7 16 17 4 1
|36.858105| |13.091429|53.358707| |7.698563|18.008851|36.858105| |5.885217|10.507469|12.469621|36.858105| |6.007131|9.420505|7.975340|15.937365|73.516695| |4.222921|7.081748|7.891493|13.979873|14.939184|53.358707| |3.369967|5.261365|5.040848|7.689538|11.723419|18.396036|36.858105| |3.153306|4.821012|4.230650|6.301320|11.595412|10.638791|13.724369|36.858105| |2.594979|3.842786|3.247087|4.346301|8.066127|7.010123|7.931767|13.766660|36.858105| |2.325562|3.410773|2.910222|3.701664|6.551435|6.173743|6.826041|7.913836|13.774106|36.858105| |2.407308|3.555200|3.136906|3.931037|6.574225|7.013162|7.894273|6.880044|7.986291|13.781012|36.858105| |2.834514|4.287535|3.998644|5.206182|8.111915|10.676728|13.616767|7.929363|6.896373|7.923120|13.743901|36.858105| |2.778748|4.185807|3.976738|4.650143|6.935507|9.049684|7.552167|5.028904|4.465784|5.048923|7.637542|12.666634|36.858105| 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|2.620999|3.580894|2.224737|2.107740|3.936330|2.536291|1.711460|1.758428|1.595230|1.441669|1.415251|1.524399|1.458420|2.981370|3.373186|3.337549|3.048652|5.075230|3.961460|34.746409|8.646603|11.618268|14.019627|36.858105| |2.833539|4.022291|2.483421|2.349342|4.369517|2.814381|1.884566|1.940374|1.742649|1.562796|1.533054|1.661058|1.581148|3.210048|3.684480|3.593187|3.589072|6.101216|4.758675|49.659496|14.035872|11.826842|8.718575|13.676048|53.358707| |2.478652|3.601512|2.299101|2.205022|4.064246|2.695976|1.824723|1.888853|1.710765|1.536782|1.501625|1.616069|1.533707|3.129079|3.590762|3.445022|3.208070|5.731334|3.928249|42.034722|7.627672|7.313214|5.423572|7.836858|18.739341|36.858105| |2.126380|3.042553|1.980299|1.914186|3.523960|2.374132|1.627419|1.686831|1.549805|1.403602|1.368810|1.458996|1.388227|2.858779|3.238174|3.114219|2.620264|4.681842|3.098773|29.737046|5.208827|5.756851|4.648943|6.850315|11.047929|14.273438|36.858105| |2.020463|2.819891|1.830796|1.766554|3.266088|2.188318|1.504529|1.555455|1.436868|1.308334|1.277526|1.357544|1.297144|2.682529|3.006867|2.930315|2.369587|4.137910|2.821803|25.142693|4.665106|5.695830|5.105348|7.943177|9.432334|7.883758|13.159705|36.858105| |2.189604|2.997305|1.914332|1.833580|3.408904|2.245832|1.535043|1.581432|1.453810|1.322805|1.295158|1.381918|1.323525|2.729521|3.056989|3.014606|2.501419|4.258277|3.068941|26.374246|5.367339|7.090115|7.332620|13.284737|10.703126|6.793985|7.870125|14.204636|36.858105| |17.607680|12.522488|7.301521|5.439942|9.300318|5.624710|3.300171|2.997248|2.496651|2.287114|2.412047|2.857522|2.889373|5.500896|6.549182|7.445503|5.733098|7.860848|4.939395|24.036397|3.000741|4.325566|2.631830|2.320426|3.364953|2.194187|1.913692|1.831032|1.975561|0.500000| |17.647886|12.365235|5.659279|4.504523|8.250313|4.699169|2.853255|2.720816|2.294457|2.068856|2.124314|2.449993|2.410172|4.675031|5.521841|5.928340|7.035735|8.692161|7.492820|31.241247|4.010902|6.057624|3.461882|2.927609|4.251722|2.656314|2.268046|2.177110|2.400263|0.303931|0.500000| |17.586937|12.272222|6.548909|6.053807|12.518263|5.811330|3.527424|3.401513|2.793419|2.464024|2.509462|2.924545|2.786913|5.300717|6.172741|6.940606|6.468150|8.543512|5.902257|27.430184|3.416789|4.933769|2.940536|2.574983|3.761924|2.424554|2.092340|1.995621|2.162977|0.300650|0.299658|0.500000| |5.696461|12.539027|17.637804|8.858971|10.708246|10.040106|4.794515|3.983625|3.106935|2.824033|3.072634|3.913536|3.985880|7.100317|10.276626|9.342824|7.464239|14.139640|4.721286|26.726374|2.904382|3.764218|2.309788|2.177585|3.344705|2.314198|1.992428|1.823638|1.886519|0.152139|0.129724|0.135646|0.500000| |7.381034|12.558375|17.565906|8.949458|11.395529|9.365360|4.670400|3.818975|3.030144|2.800995|3.088264|3.945056|4.151085|7.370624|9.847409|10.903386|5.838899|9.250239|4.220816|22.677829|2.648329|3.590111|2.223532|2.048811|3.051907|2.071722|1.809831|1.694306|1.778711|0.235258|0.150778|0.172121|0.302232|0.500000| |3.948046|6.719847|7.722146|9.447313|10.872867|26.083614|9.266630|5.855718|4.315215|4.040269|4.783349|7.244949|7.383733|11.103126|19.873260|15.630203|4.311896|8.308016|3.225966|19.775483|2.267163|2.955598|1.881120|1.798383|2.714852|1.919287|1.695051|1.561455|1.598263|0.110233|0.091294|0.106297|0.230551|0.197689|0.500000| |3.448153|5.329653|4.493079|6.860692|14.203683|9.755392|8.951426|17.812856|8.921707|5.642874|4.963096|5.650436|4.098976|7.506592|8.605509|8.565595|3.880169|7.364474|3.216365|20.749666|2.417286|3.115325|2.000984|1.935947|2.934249|2.091616|1.849429|1.696067|1.726799|0.088164|0.082629|0.105130|0.115561|0.108214|0.148744|0.500000| |2.433549|3.561251|2.904878|3.770587|7.261510|5.687664|5.654473|8.967189|17.721501|8.922964|5.665373|4.964494|3.566952|7.191781|7.151625|7.194524|2.591943|4.851131|2.295613|15.444999|1.894085|2.464071|1.637056|1.603150|2.379801|1.724226|1.569011|1.455109|1.467917|0.064369|0.060619|0.073314|0.077164|0.074939|0.099201|0.216216|0.500000| |2.068792|2.997107|2.501420|3.071301|5.497139|4.916365|4.928877|5.632748|8.898119|17.734201|8.927161|5.641767|4.116840|9.145347|7.777256|7.877243|2.126287|3.957278|1.882886|12.611813|1.569012|2.061506|1.383568|1.352815|1.985071|1.439964|1.325564|1.239855|1.250380|0.056597|0.051783|0.060813|0.067701|0.067307|0.091686|0.124047|0.214242|0.500000| |2.173698|3.175995|2.767715|3.309963|5.522473|5.692316|5.633493|4.959496|5.670562|8.939323|17.766315|8.947580|7.119436|18.504365|11.685756|11.900393|2.186493|4.061718|1.892891|12.432912|1.536564|2.029486|1.354158|1.314678|1.927581|1.389565|1.274609|1.194246|1.209679|0.061124|0.053830|0.062416|0.075964|0.077015|0.112871|0.107761|0.124437|0.215416|0.500000| |6.889593|9.353914|4.673279|4.286712|8.481502|4.516042|2.841399|2.882502|2.428783|2.118134|2.101163|2.373430|2.233509|4.354009|5.132521|5.236259|8.860324|11.022370|17.626056|56.510332|6.715702|9.374581|4.689083|4.000328|6.275049|3.742231|3.009459|2.798768|3.091518|0.138133|0.216926|0.190667|0.115520|0.110791|0.085327|0.092242|0.065965|0.053214|0.052603|0.500000| |6.603146|9.487415|4.624890|3.797074|6.837131|4.159208|2.567205|2.507071|2.134490|1.912455|1.938160|2.203515|2.144644|4.206944|5.046031|5.054544|8.843930|10.947413|17.638757|56.583129|6.777319|9.643507|4.752200|4.015028|6.270213|3.718031|2.992624|2.791171|3.093302|0.142265|0.237240|0.152265|0.120810|0.112855|0.082204|0.077319|0.057226|0.048230|0.049193|0.303563|0.500000| |2.850785|3.661284|2.239350|2.099363|3.947377|2.498517|1.679686|1.709737|1.550351|1.409598|1.392286|1.503642|1.449969|2.965799|3.321808|3.373641|2.957603|4.701489|3.864352|28.109685|6.057142|12.182475|17.809622|8.702020|8.017408|4.211698|3.836777|4.372197|6.200010|0.070620|0.091855|0.078069|0.059494|0.058550|0.049106|0.051913|0.043042|0.036726|0.036030|0.113903|0.115625|0.500000| |2.549095|3.810740|2.454599|2.360974|4.319648|2.897611|1.955113|2.026277|1.824625|1.632008|1.594194|1.721398|1.627641|3.307569|3.836308|3.629006|3.477257|6.443460|4.127666|47.775272|6.901672|6.491089|4.457834|5.653946|12.377527|17.785800|8.952240|5.573871|4.918089|0.062515|0.074689|0.069007|0.069514|0.060671|0.057388|0.062588|0.050996|0.042324|0.040834|0.106292|0.105280|0.099312|0.500000| |1.953936|2.818494|1.866352|1.816605|3.326440|2.280984|1.574782|1.635308|1.512644|1.374219|1.337770|1.418838|1.349032|2.789667|3.153114|3.007174|2.411762|4.388837|2.759981|26.034701|4.174578|4.706784|3.686863|4.943005|7.805958|9.147140|17.753160|8.689673|5.630380|0.049230|0.057185|0.053464|0.052551|0.047440|0.045376|0.049582|0.042635|0.036175|0.034680|0.074126|0.073625|0.087650|0.215055|0.500000| |1.814831|2.525218|1.660658|1.610010|2.969464|2.012727|1.393599|1.441071|1.341950|1.228391|1.198543|1.266507|1.212054|2.520708|2.805250|2.733580|2.092219|3.672519|2.434558|21.034855|3.693825|4.643228|4.080548|5.628890|6.783373|5.650759|8.735514|17.734517|9.060820|0.046132|0.053948|0.049914|0.046022|0.042968|0.039978|0.043383|0.037824|0.032487|0.031243|0.067247|0.067060|0.102393|0.123219|0.211128|0.500000| |2.055984|2.772268|1.780581|1.707276|3.175734|2.098192|1.439881|1.480565|1.368437|1.251361|1.226350|1.304250|1.253055|2.594931|2.882927|2.864148|2.267112|3.833735|2.743548|22.413802|4.361923|6.166241|6.478306|8.802479|7.650101|4.912696|5.583342|9.007815|17.738046|0.052022|0.062700|0.056596|0.048529|0.046410|0.041507|0.044658|0.038388|0.032960|0.031927|0.077595|0.077757|0.174116|0.106973|0.123239|0.215520|0.500000|
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