Version2.1 2021-01-13T16:48:28Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 26-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)CSc2nnc3n2c4ccccc4s3 C21236817 RHF 6-31G(d) (6D,7F) CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CSc2nnc3n2c4ccccc4s3 C01[X(C20H16F3N5O2S2)] 138 C1 520 O=C(Nc1ccccc1C(F)(F)F)CN(C(=O)CSc1nnc2n1c1ccccc1s2)C O=C(Nc1ccccc1C(F)(F)F)CN(C(=O)CSc1nnc2n1c1ccccc1s2)C CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CSc2nnc3sc4ccccc4n23 InChIKey=BNEAMDFYFKZVOV-UHFFFAOYSA-N InChI=1S/C20H16F3N5O2S2/c1-27(10-16(29)24-13-7-3-2-6-12(13)20(21,22)23)17(30)11-31-18-25-26-19-28(18)14-8-4-5-9-15(14)32-19/h2-9H,10-11H2,1H3,(H,24,29) InChI=1/C20H16F3N5O2S2/c1-27(10-16(29)24-13-7-3-2-6-12(13)20(21,22)23)17(30)11-31-18-25-26-19-28(18)14-8-4-5-9-15(14)32-19/h2-9H,10-11H2,1H3,(H,24,29)/f/h24H CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CSc2nnc3n2c4ccccc4s3 C01[X(C20H16F3N5O2S2)] 138 C01 520 O=C(Nc1ccccc1C(F)(F)F)CN(C(=O)CSc1nnc2n1c1ccccc1s2)C O=C(N[C]1[CH][CH][CH][CH][C]1C(F)(F)F)CN(C(=O)CS[C]1[N][N][C]2[N@@]1[C]1[CH][CH][CH][CH][C]1S2)C CN(CC(=O)N[C]1[CH][CH][CH][CH][C]1C(F)(F)F)C(=O)CS[C]2[N][N][C]3S[C]4[CH][CH][CH][CH][C]4N23 InChIKey=BNEAMDFYFKZVOV-UHFFFAOYSA-N InChI=1S/C20H16F3N5O2S2/c1-27(10-16(29)24-13-7-3-2-6-12(13)20(21,22)23)17(30)11-31-18-25-26-19-28(18)14-8-4-5-9-15(14)32-19/h2-9H,10-11H2,1H3,(H,24,29) InChI=1/C20H16F3N5O2S2/c1-27(10-16(29)24-13-7-3-2-6-12(13)20(21,22)23)17(30)11-31-18-25-26-19-28(18)14-8-4-5-9-15(14)32-19/h2-9H,10-11H2,1H3,(H,24,29)/f/h24H 3333.2553180526 -2282.0096186 1-A 28513.6455 123 397 520 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -91.99328 -91.97268 -26.35098 -26.35010 -26.34403 -20.54735 -20.54330 -15.65759 -15.61379 -15.60523 -15.58480 -15.58219 -11.51604 -11.36909 -11.36771 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11.28529
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456.7073 472.4800 488.2585 501.0271 517.2850 531.0102 540.9281 546.9407 569.2545 582.9318 596.2554 626.9495 636.7685 640.9618 655.7783 665.7005 684.1856 690.1085 715.2905 744.4662 747.1143 777.5412 785.7152 801.5160 806.7849 827.8701 849.6423 855.5373 866.1181 875.1686 904.8829 926.9626 977.3421 998.0965 1034.0425 1049.9083 1060.3636 1068.6111 1093.9341 1101.4904 1106.0533 1117.6042 1130.0892 1130.3343 1139.1965 1139.6783 1169.1858 1171.1480 1194.5337 1219.9383 1221.2185 1236.9327 1241.7575 1249.7163 1253.4665 1302.8089 1312.9077 1316.1127 1329.7752 1330.4004 1333.7377 1367.2298 1370.0841 1384.9273 1406.4851 1433.2395 1446.9216 1475.1225 1476.3981 1480.4374 1544.0896 1552.1733 1580.8016 1600.1817 1609.0916 1627.6250 1628.0158 1631.0636 1642.2890 1650.8602 1658.5233 1673.6638 1674.7385 1726.4531 1737.4188 1785.2992 1792.9410 1800.9389 1821.5952 1932.0319 1982.8196 3235.5849 3248.3090 3278.0749 3303.9721 3316.1692 3333.1473 3334.7469 3373.1289 3373.1753 3385.3317 3391.4015 3397.2870 3415.1036 3416.9532 3451.0032 3889.4454 9.0889 7.6457 8.1346 8.1383 9.4362 8.9691 8.0242 8.6791 5.2804 4.7015 4.5930 3.4975 5.1577 2.8439 3.9426 2.4109 3.2563 6.5326 7.8203 6.5154 6.5666 6.2693 4.8204 7.2029 9.0826 5.6857 10.8766 7.2750 7.0891 5.7021 2.9078 11.0679 3.1954 7.9398 11.6554 4.4312 4.1880 9.6464 1.6583 10.9106 3.3825 3.9294 2.2599 2.8839 6.7510 5.3033 5.5215 6.8804 6.8775 7.8344 12.5919 6.4266 10.7152 7.2331 4.1095 5.2944 6.3937 1.2861 5.5865 1.3511 4.3271 6.4280 4.9736 1.3554 1.4441 2.0010 5.0469 2.8521 1.3676 1.3770 8.6562 10.6319 1.3225 2.9564 1.3409 2.7437 3.5093 9.2509 2.7638 3.2222 2.7697 2.9147 1.9004 1.5892 1.6333 1.4009 2.5860 1.1659 3.6369 1.8264 2.0357 1.7621 2.9718 2.6426 2.7667 2.6446 2.0426 2.2319 3.1423 3.0752 1.8217 4.4145 1.5392 2.0948 1.1328 1.1268 2.5333 2.4545 1.2264 3.3322 1.0834 2.3900 1.3371 3.6257 2.1208 10.0354 6.4087 4.5496 6.0528 4.9268 11.4388 9.1491 1.0385 1.0635 1.0603 1.1060 1.0997 1.1054 1.1042 1.0892 1.0881 1.0927 1.0951 1.0970 1.0956 1.0946 1.0943 1.0781 0.0004 0.0004 0.0012 0.0030 0.0090 0.0146 0.0162 0.0233 0.0204 0.0210 0.0302 0.0261 0.0442 0.0258 0.0465 0.0338 0.0537 0.1457 0.2244 0.1983 0.2582 0.2679 0.2368 0.4208 0.5939 0.4210 0.8251 0.5957 0.6230 0.5194 0.3249 1.3602 0.4203 1.1152 1.7239 0.6986 0.6958 1.6630 0.2923 2.0831 0.6772 0.8231 0.5234 0.6890 1.6341 1.3437 1.4417 1.8976 1.9298 2.3617 4.1118 2.1135 3.8168 2.6309 1.5555 2.0304 2.5818 0.5470 2.4092 0.5972 1.9527 3.1011 2.5179 0.7628 0.8476 1.2606 3.2777 1.8894 0.9201 0.9709 6.1878 7.6633 0.9732 2.2245 1.0094 2.0979 2.6855 7.4507 2.2335 2.7089 2.4286 2.5611 1.7132 1.4438 1.5029 1.2968 2.5861 1.1841 3.7117 1.9029 2.1229 1.8468 3.2730 2.9226 3.1265 3.0824 2.4721 2.7531 4.0286 3.9494 2.3523 6.2013 2.1849 3.0842 1.7090 1.7190 3.9541 3.8329 1.9223 5.2952 1.7396 3.8734 2.2068 5.9915 3.7245 17.8482 12.0349 8.6170 11.5665 9.6321 25.1570 21.1930 6.4059 6.6115 6.7127 7.1135 7.1255 7.2357 7.2348 7.3014 7.2949 7.3785 7.4208 7.4596 7.5287 7.5301 7.6785 9.6089 0.0340 0.3549 1.1278 2.4804 1.3687 5.3516 3.4880 1.1692 1.6088 2.7588 0.2643 1.7542 0.1788 9.6977 0.9975 6.3372 3.3214 0.2789 0.0055 4.6723 0.2267 5.3387 2.2608 1.8914 3.9811 6.8024 0.3928 8.3141 8.1668 5.5241 32.0676 9.0062 4.2571 7.9871 4.1272 4.1495 20.1696 1.8999 68.5043 11.0267 7.6919 0.2918 8.3924 7.2322 2.2161 3.4928 7.6487 10.3609 4.0880 20.6569 0.9885 11.2240 6.2884 4.1197 0.0817 35.3722 4.9675 75.6741 4.2323 53.5697 29.1091 5.1151 0.7875 0.2373 0.0967 16.9030 12.0655 12.0011 2.6009 5.1168 0.4910 21.6046 0.0110 6.7096 0.5351 20.0314 31.3882 8.5869 27.3913 7.0041 2.1853 59.8462 61.2488 172.6537 3.4201 35.9456 171.9887 15.3276 152.4539 40.7181 86.9966 52.9604 41.7145 179.6541 62.9236 16.2861 93.6164 329.4183 270.3796 34.2950 47.0381 78.5127 20.9997 186.2240 72.6137 20.2098 44.6226 130.1182 27.6558 107.4311 41.4713 14.1424 119.4516 15.7322 368.9038 299.0430 46.4633 181.8891 5.5558 37.2295 292.9184 193.7025 25.5449 26.2229 19.8172 26.3961 6.0703 14.6113 14.4953 4.9591 0.2689 8.9434 19.1028 23.7614 2.3379 7.0354 0.2202 71.0554 1.1450 3.5496 5.5739 1.6938 0.9853 0.3478 1.5331 0.0617 4.4033 1.0190 0.5492 2.7775 2.0371 1.1360 2.0352 1.2120 1.1484 0.9832 0.8695 0.8402 0.6455 1.1773 0.9982 4.7126 1.3125 1.1573 0.6550 1.7442 1.8778 1.8341 0.7459 5.0512 0.5171 1.7257 7.3005 0.9599 4.2410 7.7262 4.0020 2.2099 1.2003 0.4916 0.8176 1.0788 0.9044 0.1193 2.9396 1.2873 2.0754 2.2301 0.4583 10.3092 0.3825 2.3201 0.1797 7.2498 6.6816 0.6491 1.9570 1.5658 5.6938 33.6273 9.5470 1.9737 2.8096 0.9208 11.2405 1.4359 0.5696 0.4380 4.6734 6.6569 0.0108 25.4247 0.5806 3.9690 15.9726 6.2015 4.1223 4.9103 11.6158 16.0096 4.7641 3.2502 2.2309 3.0230 3.8145 11.5469 7.7290 7.3581 2.9456 3.9234 7.8300 2.2125 17.3656 15.2942 6.6978 7.2938 2.8688 15.3101 9.0233 61.0193 2.0482 0.2607 14.3033 8.9423 9.0058 0.6581 10.4458 16.5231 15.0776 5.6713 26.0587 51.2753 5.8210 10.8106 18.4708 27.8338 44.6563 36.5792 5.5548 11.8745 49.9246 124.7932 58.2969 64.6685 43.6002 36.5139 58.2406 64.7044 51.2199 103.1748 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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 47 48 6 7 6 6 8 7 6 6 6 6 6 6 6 9 9 9 6 8 6 16 6 7 7 6 7 6 6 6 6 6 6 16 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 14.00307 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 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
5733.6974 50766.9255 53203.1113 0.99998 0.00202 -0.00615 -0.00200 0.99999 0.00440 0.00616 -0.00438 0.99997 1 0.01511 0.00171 0.00163 0.31476 0.03555 0.03392 11.66 13.11 22.93 36.02 57.81 75.63 84.29 97.19 116.53 125.14 151.97 161.87 173.45 178.54 203.63 222.07 240.73 279.89 317.49 326.99 371.68 387.47 415.42 453.05 479.31 510.07 516.28 536.38 555.67 565.74 626.60 657.10 679.79 702.50 720.87 744.26 764.01 778.27 786.93 819.03 838.71 857.88 902.04 916.17 922.20 943.52 957.79 984.39 992.91 1029.14 1071.12 1074.93 1118.71 1130.47 1153.20 1160.78 1191.12 1222.45 1230.93 1246.15 1259.17 1301.92 1333.69 1406.18 1436.04 1487.76 1510.58 1525.63 1537.49 1573.93 1584.80 1591.36 1607.98 1625.95 1626.30 1639.05 1639.74 1682.20 1685.02 1718.67 1755.22 1757.06 1779.67 1786.61 1798.06 1803.46 1874.45 1888.98 1893.59 1913.25 1914.15 1918.95 1967.14 1971.25 1992.60 2023.62 2062.11 2081.80 2122.37 2124.21 2130.02 2221.60 2233.23 2274.42 2302.30 2315.12 2341.79 2342.35 2346.74 2362.89 2375.22 2386.25 2408.03 2409.58 2483.98 2499.76 2568.65 2579.64 2591.15 2620.87 2779.76 2852.84 4655.28 4673.59 4716.42 4753.68 4771.23 4795.66 4797.96 4853.18 4853.25 4870.74 4879.47 4887.94 4913.57 4916.23 4965.22 5596.04 0.374380 0.401077 0.402021 0.310652 -2281.635239 -2281.608542 -2281.607598 -2281.698967 3.064531D-04
MUNgauss RevisionA2.0 retrievium 13-Jan-2021 DUDE CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)CSc2nnc3n2c4ccccc4s3 C21236817 RHF 6-31G(d) (6D,10F) C1 479.069753 |X|Y|Z| 48.797432 31.995625 158.457235
62.776902 25 6 7 16 18 5 2
|36.858105| |13.085422|53.358707| |7.696938|18.005413|36.858105| |5.889744|10.510882|12.467627|36.858105| |6.004020|9.440052|7.975590|15.938859|73.516695| |4.230439|7.078496|7.893480|13.982801|14.937001|53.358707| |3.375681|5.259981|5.041050|7.688927|11.717488|18.392286|36.858105| |3.154050|4.817351|4.230116|6.300645|11.592078|10.638021|13.725511|36.858105| |2.596308|3.840922|3.246814|4.345928|8.063531|7.009665|7.932068|13.765806|36.858105| |2.328774|3.410435|2.910307|3.701538|6.549030|6.173526|6.826392|7.913851|13.774896|36.858105| |2.412648|3.555899|3.137342|3.931038|6.571422|7.013038|7.894705|6.880049|7.986304|13.780411|36.858105| |2.842066|4.288742|3.999463|5.206186|8.107780|10.676229|13.616536|7.929185|6.896237|7.923055|13.744572|36.858105| |2.789021|4.189033|3.978276|4.650396|6.932347|9.049720|7.551891|5.028838|4.465709|5.048835|7.637552|12.666494|36.858105| 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|2.658378|3.628964|2.248800|2.127818|3.982638|2.553075|1.720678|1.766417|1.600887|1.446694|1.421039|1.531944|1.466372|2.995830|3.387784|3.363081|3.091984|5.139113|4.039205|35.204495|8.894987|12.258592|20.360043|36.858105| |2.828424|4.015021|2.479174|2.343920|4.368223|2.803507|1.876843|1.931396|1.734764|1.556381|1.527261|1.654899|1.576211|3.200418|3.668971|3.588058|3.579930|6.094413|4.743493|49.157393|13.938540|11.969227|11.850929|13.980735|53.358707| |2.417252|3.490908|2.231832|2.139047|3.952080|2.614490|1.772036|1.832682|1.664001|1.498005|1.464297|1.573734|1.496100|3.057844|3.494867|3.369521|3.081492|5.486738|3.766243|38.960827|7.295054|7.273648|7.500144|8.154507|18.501463|36.858105| |2.336619|3.472046|2.267454|2.189653|4.005498|2.710001|1.841773|1.909979|1.734155|1.558377|1.520737|1.633225|1.546924|3.160249|3.640426|3.446125|3.103646|5.779221|3.598463|38.569338|5.712025|5.747899|5.532109|5.196135|10.344635|13.793977|36.858105| |2.002578|2.954780|1.976713|1.927510|3.508787|2.430858|1.675129|1.740254|1.603583|1.452892|1.414476|1.503794|1.426430|2.941665|3.354536|3.159657|2.563977|4.807642|2.860052|27.854652|4.060854|4.454907|4.447041|4.064642|6.971891|8.025572|13.740787|36.858105| |1.817912|2.628967|1.761363|1.719070|3.139848|2.174032|1.507735|1.564941|1.455288|1.327346|1.291980|1.365373|1.299929|2.698387|3.038979|2.891786|2.229959|4.096499|2.499850|23.027887|3.563185|4.111554|4.314628|4.002313|6.261997|6.920265|7.890741|13.737079|36.858105| |1.855072|2.636784|1.744349|1.694089|3.113598|2.123595|1.468635|1.521382|1.412926|1.289356|1.256783|1.329984|1.269318|2.633811|2.952627|2.846162|2.220980|3.986533|2.552935|23.082677|3.859661|4.570032|5.068834|4.958086|7.211712|7.913393|6.788612|7.911350|13.742386|36.858105| |2.110908|2.984480|1.934013|1.863407|3.444415|2.301481|1.576599|1.630455|1.499404|1.360971|1.329125|1.416547|1.351522|2.786270|3.140891|3.049144|2.544796|4.490094|3.038450|28.203626|5.206256|6.016584|6.925094|7.709501|11.300717|13.667454|7.882632|6.913916|8.000553|13.799339|36.858105| |2.137224|2.926829|1.875387|1.797444|3.343841|2.203752|1.508073|1.552984|1.429882|1.302797|1.275802|1.359952|1.303542|2.691487|3.007675|2.971955|2.436047|4.160868|2.969311|25.357016|5.058958|6.718884|9.249704|10.892340|9.996853|7.184620|4.794762|4.212242|4.670879|6.738946|10.722546|388.023441| |17.610028|12.520669|7.294999|5.437742|9.268468|5.636964|3.306563|2.997794|2.497844|2.290617|2.418406|2.866797|2.903333|5.526459|6.577589|7.498149|5.738962|7.858844|4.943804|24.053511|3.001351|4.323424|3.585960|2.351209|3.361765|2.147701|2.084781|1.815220|1.660899|1.692262|1.903945|13.751995|0.500000| |17.648655|12.359590|5.656483|4.507741|8.258573|4.703865|2.856671|2.721360|2.295563|2.071315|2.128144|2.454943|2.416901|4.688109|5.531241|5.956257|7.044803|8.696999|7.506069|31.243329|4.009220|6.050192|4.718646|2.977521|4.247813|2.597559|2.456817|2.085453|1.903617|1.966805|2.269039|16.635276|0.303977|0.500000| |17.588785|12.274473|6.556358|6.068573|12.516076|5.831732|3.539215|3.405714|2.797469|2.470412|2.518790|2.937391|2.802096|5.327773|6.198439|6.995871|6.464233|8.531588|5.895986|27.417623|3.412831|4.932421|4.003795|2.607490|3.749833|2.363518|2.280214|1.963147|1.789267|1.828660|2.076457|15.001388|0.300580|0.299661|0.500000| |5.693640|12.536014|17.637051|8.860844|10.733267|10.009732|4.785949|3.982718|3.105835|2.821390|3.067466|3.903980|3.971467|7.079453|10.233399|9.305308|7.471164|14.134566|4.721833|26.798538|2.911205|3.770707|3.144047|2.199729|3.340619|2.244304|2.318800|2.029890|1.794189|1.758747|1.936315|13.158187|0.151995|0.129607|0.135735|0.500000| |7.376994|12.558546|17.567753|8.941537|11.350901|9.401382|4.680242|3.821376|3.031916|2.804115|3.094102|3.955828|4.167941|7.395469|9.901452|10.950271|5.843354|9.242296|4.221744|22.713821|2.651506|3.592547|3.027491|2.070435|3.048046|2.019733|2.033571|1.792844|1.617279|1.610266|1.777440|12.408448|0.234878|0.150648|0.172236|0.302228|0.500000| |3.956919|6.713279|7.726864|9.449061|10.872678|26.082438|9.266228|5.852629|4.313930|4.040282|4.785142|7.251076|7.397626|11.116635|19.901682|15.678743|4.290611|8.217546|3.215401|19.723412|2.264383|2.955297|2.556478|1.808136|2.701800|1.860216|1.935065|1.743647|1.559799|1.519665|1.640887|11.150650|0.110656|0.091382|0.106702|0.228944|0.199372|0.500000| |3.443473|5.321748|4.491503|6.859166|14.206476|9.753876|8.951071|17.812940|8.921969|5.643050|4.963106|5.650195|4.098821|7.506453|8.605844|8.566201|3.867833|7.324565|3.207898|20.740953|2.416966|3.120749|2.720870|1.944979|2.919430|2.024738|2.111381|1.903405|1.700110|1.653600|1.784131|12.040203|0.088035|0.082544|0.105014|0.115652|0.108184|0.148614|0.500000| |2.433238|3.558941|2.904500|3.770286|7.260197|5.687367|5.654649|8.966927|17.721770|8.923264|5.665378|4.964445|3.566917|7.191556|7.151874|7.194779|2.586321|4.830949|2.291472|15.433452|1.893522|2.468302|2.226762|1.607706|2.368549|1.677704|1.749305|1.624662|1.477905|1.433770|1.516900|10.268074|0.064354|0.060619|0.073345|0.077171|0.074950|0.099164|0.216228|0.500000| |2.071424|2.996891|2.501488|3.071226|5.495444|4.916247|4.929090|5.632765|8.898495|17.734586|8.927061|5.641812|4.116823|9.144694|7.777306|7.877166|2.122406|3.940042|1.880497|12.599125|1.568586|2.064639|1.882786|1.356810|1.977108|1.405719|1.461348|1.373117|1.261670|1.225271|1.286357|8.765010|0.056677|0.051842|0.060955|0.067648|0.067371|0.091686|0.124051|0.214249|0.500000| |2.179069|3.177098|2.768193|3.310012|5.520338|5.692272|5.633687|4.959506|5.670603|8.939120|17.766414|8.947953|7.119526|18.501533|11.685237|11.899817|2.182626|4.041558|1.890975|12.418910|1.536291|2.032232|1.843222|1.319822|1.920796|1.357180|1.407305|1.316791|1.208966|1.176717|1.239563|8.481636|0.061308|0.053940|0.062661|0.075827|0.077168|0.112924|0.107761|0.124437|0.215414|0.500000| |6.882837|9.345334|4.669871|4.285129|8.505928|4.508601|2.837458|2.876583|2.424864|2.115993|2.099772|2.371802|2.233206|4.354019|5.125269|5.245139|8.846404|11.019374|17.629240|56.480050|6.725576|9.449403|6.398070|4.082638|6.252557|3.608099|3.369161|2.713386|2.412735|2.495153|2.977588|21.250671|0.138078|0.217211|0.190104|0.115481|0.110711|0.085111|0.091952|0.065842|0.053166|0.052582|0.500000| |6.584846|9.460903|4.616182|3.792134|6.844921|4.149434|2.562193|2.501604|2.130648|1.909715|1.935683|2.200398|2.142430|4.203468|5.034729|5.057297|8.831685|10.960850|17.638175|56.532921|6.792015|9.656431|6.477282|4.109247|6.274809|3.606767|3.358701|2.704725|2.407808|2.493521|2.979069|21.322364|0.142105|0.236605|0.151756|0.120607|0.112688|0.081930|0.077108|0.057120|0.048167|0.049141|0.303316|0.500000| |2.550239|3.893817|2.541367|2.449274|4.454632|3.019283|2.033538|2.106806|1.890901|1.688477|1.650180|1.785556|1.685598|3.418205|3.992429|3.739768|3.589977|6.902711|4.092908|47.666976|5.946844|5.792489|5.230029|4.601714|9.205802|8.886437|17.762080|8.895488|5.625589|4.911481|5.613029|28.272383|0.062705|0.073750|0.068759|0.072927|0.062352|0.059880|0.065146|0.052753|0.043694|0.042194|0.103532|0.103040|0.500000| |1.921761|2.866228|1.949259|1.912036|3.455858|2.440148|1.689769|1.756813|1.624735|1.474853|1.434725|1.521237|1.441141|2.978193|3.403489|3.168189|2.478087|4.742097|2.679643|25.573826|3.505424|3.908269|3.825442|3.352358|5.615751|5.691049|8.954670|17.732386|8.921582|5.638994|4.974408|24.207963|0.048651|0.054953|0.052317|0.056116|0.049047|0.048792|0.053179|0.045738|0.038770|0.037130|0.070242|0.069961|0.215530|0.500000| |1.655074|2.389569|1.620466|1.588762|2.892397|2.028758|1.416776|1.470573|1.378313|1.263897|1.229356|1.292055|1.231668|2.570674|2.878129|2.731547|2.001558|3.691328|2.202378|19.663090|2.968573|3.513813|3.678357|3.290910|4.972902|4.977620|5.630524|8.917811|17.731203|8.935615|5.677314|27.343637|0.042335|0.047848|0.045326|0.045952|0.041552|0.040537|0.044099|0.038944|0.033521|0.032074|0.059211|0.059083|0.123974|0.215381|0.500000| |1.706906|2.401821|1.598182|1.555127|2.858074|1.958447|1.361118|1.408592|1.316613|1.207650|1.177324|1.240584|1.186943|2.474732|2.752367|2.665536|1.991662|3.553592|2.269730|19.743388|3.286346|4.054471|4.587358|4.320514|5.850409|5.628699|4.908966|5.629527|8.887472|17.729438|8.911394|44.714223|0.043578|0.050251|0.046859|0.044631|0.041306|0.038971|0.042295|0.037150|0.032004|0.030734|0.062130|0.062117|0.106834|0.123978|0.214776|0.500000|
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