Version2.0 2020-08-10T07:34:15Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 29-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[NH+](C)[C@H](CNC(=O)C(=O)Nc1cccc2c1ccnc2)c3cccc(c3)F C48842994 RHF 6-31G(d) (6D,7F) C[NH+](C)[C@H](CNC(=O)C(=O)Nc1cccc2c1ccnc2)c3cccc(c3)F C01[X(C21H22F1N4O2)] 144 C1 464 C[NH+]([C@@H](c1cccc(c1)F)CNC(=O)C(=O)Nc1cccc2c1ccnc2)C C[NH+]([C@@H](c1cccc(c1)F)CNC(=O)C(=O)Nc1cccc2c1ccnc2)C C[NH+](C)[C@H](CNC(=O)C(=O)Nc1cccc2cnccc12)c3cccc(F)c3 InChIKey=HXKJLTKZWGZZFC-LJQANCHMSA-O InChI=1S/C21H21FN4O2/c1-26(2)19(14-5-3-7-16(22)11-14)13-24-20(27)21(28)25-18-8-4-6-15-12-23-10-9-17(15)18/h3-12,19H,13H2,1-2H3,(H,24,27)(H,25,28)/p+1/t19-/m1/s1 InChI=1/C21H21FN4O2/c1-26(2)19(14-5-3-7-16(22)11-14)13-24-20(27)21(28)25-18-8-4-6-15-12-23-10-9-17(15)18/h3-12,19H,13H2,1-2H3,(H,24,27)(H,25,28)/p+1/t19-/m1/s1/fC21H22FN4O2/h24-26H/q+1 C[NH+](C)[C@H](CNC(=O)C(=O)Nc1cccc2c1ccnc2)c3cccc(c3)F C01[X(C21H22F1N4O2)] 144 C01 464 C[NH+]([C@@H](c1cccc(c1)F)CNC(=O)C(=O)Nc1cccc2c1ccnc2)C C[NH]([C@@H]([C]1[CH][CH][CH][C]([CH]1)F)CNC(=O)[C]([NH][C]1=[CH][CH]=[CH][C]2[C]1[CH][CH][N][CH]2)=O)C C[NH](C)[C@H](CNC(=O)C(=O)NC1=CC=C[C]2[CH][N][CH][CH][C]12)[C]3[CH][CH][CH][C](F)[CH]3 InChIKey=JXWVZNVWTWKYCX-LJQANCHMSA-N InChI=1S/C21H22FN4O2/c1-26(2)19(14-5-3-7-16(22)11-14)13-24-20(27)21(28)25-18-8-4-6-15-12-23-10-9-17(15)18/h3-12,19,26H,13H2,1-2H3,(H,24,27)(H,25,28)/t19-/m1/s1 InChI=1/C21H22FN4O2/c1-26(2)19(14-5-3-7-16(22)11-14)13-24-20(27)21(28)25-18-8-4-6-15-12-23-10-9-17(15)18/h3-12,19,26H,13H2,1-2H3,(H,24,27)(H,25,28)/t19-/m1/s1/f/h24-25H 2480.4602935376 -1274.8311919 1-A 15511.5885 100 364 464 |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| -26.42813 -20.66933 -20.64616 -15.86494 -15.72284 -15.70126 -15.62641 -11.48189 -11.46760 -11.45838 -11.45417 -11.44683 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9.60364
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|XX|YY|ZZ|XY|XZ|YZ| 47.8173 -17.7732 -30.0442 46.4438 11.3496 -5.9836
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3368.7568 3374.6585 3374.8048 3378.4888 3385.0438 3395.0707 3395.6189 3399.3288 3399.9190 3415.9159 3424.1899 3706.4843 3854.2582 3859.0969 6.7605 6.1625 5.3816 6.6143 5.7902 2.6850 6.9551 5.0214 7.1095 4.8014 5.6774 5.1321 5.2162 4.0930 3.0778 2.9345 1.5631 3.8627 1.5364 3.9218 4.3470 4.9106 3.2036 2.9085 3.5184 3.7237 3.3207 3.9982 3.0919 3.8646 3.9296 3.3722 4.4108 6.3600 8.4929 6.1693 5.3084 6.6236 1.8763 2.5669 2.4370 4.0085 3.9420 1.2920 3.2163 2.5938 4.3653 5.6420 1.9960 6.1214 2.8917 1.4872 3.6573 4.5587 1.4075 2.4790 4.5951 2.1472 2.3623 3.2069 2.9241 1.5018 1.5457 3.2633 1.4588 4.9547 4.7328 2.0971 1.4613 1.3935 1.3381 2.8507 1.2360 2.3783 2.1808 1.8250 2.3752 2.5714 2.8396 1.6422 1.3402 1.7174 1.2590 1.6823 2.1328 1.7297 1.5837 1.7597 1.9495 1.8655 2.0784 1.8938 1.4793 2.7583 3.8647 1.5183 1.3589 1.6142 1.3293 1.2755 1.1559 1.9766 1.2623 2.1815 1.2691 1.0771 2.2534 1.0873 1.0441 1.0539 2.8724 1.0590 2.5588 2.1500 2.5158 6.7963 5.9129 5.0100 5.5939 5.7827 9.5090 11.6554 1.0342 1.0529 1.0421 1.0887 1.1038 1.0921 1.1106 1.0928 1.1099 1.0895 1.0916 1.0881 1.1089 1.0967 1.1083 1.0936 1.0978 1.0974 1.0946 1.0783 1.0777 1.0799 0.0003 0.0009 0.0013 0.0067 0.0074 0.0045 0.0139 0.0172 0.0318 0.0290 0.0709 0.0799 0.1112 0.0958 0.0905 0.0921 0.0562 0.1666 0.0682 0.1894 0.2478 0.3016 0.2210 0.2366 0.3453 0.4621 0.4233 0.5267 0.4317 0.5578 0.6301 0.5464 0.7561 1.1108 1.6055 1.1809 1.0786 1.3629 0.4426 0.6282 0.6073 1.0721 1.0795 0.3716 0.9479 0.9108 1.6154 2.1437 0.8491 2.6661 1.3385 0.7033 1.7595 2.2237 0.7067 1.2819 2.4808 1.2151 1.3563 1.8965 1.8191 0.9545 1.0092 2.2141 0.9932 3.4564 3.3643 1.5358 1.0735 1.0367 1.0030 2.1695 0.9566 1.8990 1.8016 1.5392 2.0517 2.2821 2.5520 1.5581 1.3069 1.7036 1.2571 1.7401 2.2347 1.8272 1.7355 1.9981 2.2299 2.1500 2.4725 2.3036 1.8363 3.5472 5.0627 1.9926 1.8485 2.2319 1.8976 1.8352 1.7110 2.9514 1.8895 3.3449 1.9722 1.6781 3.5334 1.7177 1.6545 1.6853 4.6973 1.7356 4.2131 3.6824 4.6240 12.8241 11.2731 9.6612 10.8392 11.6017 21.1359 26.7897 6.5056 6.6372 6.5852 7.0587 7.2480 7.2470 7.3979 7.2837 7.4209 7.3107 7.3250 7.3178 7.4863 7.4476 7.5290 7.4452 7.4769 7.5445 7.5614 8.7278 9.4323 9.4759 0.6888 1.7031 3.4798 0.1831 2.2842 0.7286 3.0286 0.9212 7.3676 0.6354 2.1720 5.0716 0.2360 0.6437 1.0521 13.6673 1.1271 0.3313 3.1161 5.3348 4.2905 2.6348 15.8705 5.6681 7.5680 5.9711 25.4647 10.3619 0.6553 13.2486 13.9255 7.3793 8.5297 7.8606 5.0970 0.5668 81.5937 15.5678 78.2220 8.4905 5.0139 19.0818 6.1785 96.3326 8.0222 9.2143 16.2004 3.3100 24.9791 7.8940 19.1235 53.0138 10.1801 3.9785 41.2915 2.4006 4.1648 86.9052 31.3178 72.0028 7.2784 9.0734 2.7249 43.4843 0.6620 1.4875 3.4108 5.2140 0.7750 1.4538 0.4472 21.9393 6.3375 4.6898 2.6243 5.1230 0.7229 3.3270 4.4525 9.9714 7.7028 10.5954 1.9602 17.3784 125.0569 17.5015 4.3614 29.3128 54.1236 14.7273 28.9072 89.0346 13.9412 25.9013 16.7700 3.3500 5.3041 18.5309 29.3047 44.4750 10.8293 10.6860 50.8949 42.6632 4.3488 15.1289 3.9461 6.6242 16.0453 31.1358 96.6776 59.4332 59.1304 954.2444 124.4352 5.5656 61.1835 32.1695 56.6317 31.5204 505.7856 119.4380 3.1731 11.0336 11.6600 0.6037 9.7528 18.9682 0.2489 4.1860 4.2108 2.6928 4.0810 6.3863 2.4943 21.0403 0.4819 3.0839 30.4418 0.0279 2.3880 43.2381 49.0234 132.5928 4.9047 5.5694 2.0188 4.5543 3.4257 0.3374 1.4613 0.6630 3.6686 3.2677 0.9262 0.9828 0.3799 0.5004 1.0803 0.3047 0.7622 2.1777 1.1314 2.5116 1.0216 2.6627 1.9373 2.1949 0.2305 3.4581 0.5621 1.7141 1.3252 1.0087 1.1893 3.8483 4.5902 4.1460 3.6518 4.3082 1.8727 3.4649 0.5583 2.8889 1.5070 5.6439 1.0990 12.1167 1.4622 1.4703 3.3698 21.6651 5.2872 0.7567 2.3221 2.2296 0.7634 2.6883 0.6893 6.7806 9.0851 2.6487 2.1190 18.2630 3.9469 1.6435 3.0773 4.4061 2.4013 23.0404 5.7549 4.2695 6.6325 0.3060 0.1841 5.8152 1.2487 3.7234 10.5281 2.6670 2.6727 1.4614 4.6784 3.2580 2.5279 2.7735 15.5452 2.6798 2.7475 8.4218 2.4633 7.4877 6.9048 6.3281 12.7968 8.4383 1.6877 14.1280 283.1026 51.2582 17.9878 5.5908 2.1174 3.2757 2.5549 15.3789 10.2516 0.5268 2.5552 1.2482 26.5289 25.1695 20.8072 6.9728 6.3447 4.0842 1.6336 3.8465 35.5088 164.3303 12.4300 30.5206 23.9200 19.0108 0.8084 55.2109 2.7209 14.9667 228.6298 15.4004 60.4741 87.6536 11.9736 51.3437 101.0631 76.5256 44.1036 70.2306 38.9670 150.4970 33.6459 70.9278 173.8987 158.9522 87.7823 22.0927 66.0693 16.3328 0.7404 0.7499 0.7460 0.7078 0.7464 0.7458 0.7166 0.7472 0.6822 0.7319 0.6886 0.3775 0.6625 0.5929 0.3831 0.7459 0.7391 0.7348 0.7072 0.6864 0.6492 0.7206 0.1143 0.5756 0.3483 0.6573 0.2491 0.6927 0.0251 0.2670 0.7202 0.0740 0.1662 0.3833 0.4039 0.7485 0.5481 0.7104 0.5798 0.4187 0.3079 0.2786 0.2444 0.5879 0.6887 0.2878 0.7126 0.0602 0.6170 0.4810 0.7212 0.5478 0.2621 0.7283 0.3247 0.2660 0.2210 0.6640 0.3762 0.2752 0.0911 0.7088 0.3482 0.7491 0.4991 0.1362 0.6880 0.2061 0.6613 0.2574 0.7086 0.4437 0.1735 0.7289 0.1648 0.7481 0.4670 0.7329 0.6017 0.0922 0.6567 0.5605 0.3595 0.6762 0.5710 0.7500 0.5598 0.4103 0.3599 0.7091 0.1498 0.2372 0.2131 0.4589 0.1354 0.1784 0.4376 0.3934 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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 49 50 6 7 1 6 6 1 6 7 6 8 6 8 7 6 6 6 6 6 6 6 6 7 6 6 6 6 6 6 6 9 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 14.00307 1.00783 12.00000 12.00000 1.00783 12.00000 14.00307 12.00000 15.99491 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 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
5774.7825 25043.7014 26348.0638 0.99982 0.01878 0.00116 -0.01878 0.99982 0.00070 -0.00115 -0.00072 1.00000 1 0.01500 0.00346 0.00329 0.31252 0.07206 0.06850 12.61 22.33 29.47 59.65 66.96 76.83 83.91 109.65 125.30 145.64 209.40 233.85 273.64 286.80 321.41 332.05 355.41 389.22 394.92 411.96 447.52 464.51 492.33 534.62 587.23 660.33 669.23 680.30 700.42 712.12 750.56 754.48 776.05 783.37 814.98 820.09 844.91 850.28 910.38 927.31 935.71 969.40 980.88 1005.28 1017.57 1110.76 1140.25 1155.41 1222.53 1237.03 1275.27 1289.04 1300.14 1309.13 1328.17 1347.91 1377.26 1410.05 1420.31 1441.46 1478.44 1494.31 1514.58 1543.96 1546.62 1565.56 1580.37 1604.11 1606.54 1616.71 1622.84 1635.21 1649.00 1674.91 1703.71 1721.40 1742.11 1765.82 1776.98 1825.78 1850.99 1866.84 1873.01 1906.32 1918.69 1926.53 1962.21 1997.34 2004.72 2012.29 2044.42 2067.31 2088.39 2125.65 2145.38 2147.31 2186.13 2204.08 2239.54 2248.39 2280.46 2290.45 2293.25 2321.03 2336.67 2339.64 2347.19 2355.89 2359.49 2370.31 2397.00 2399.63 2405.19 2453.13 2541.21 2574.80 2588.16 2602.96 2609.21 2654.99 2794.55 2841.77 4701.29 4706.18 4711.93 4772.76 4803.25 4828.57 4837.86 4839.14 4846.89 4855.38 4855.59 4860.89 4870.32 4884.75 4885.54 4890.88 4891.73 4914.74 4926.65 5332.80 5545.42 5552.38 0.440744 0.464098 0.465042 0.383050 -1274.390448 -1274.367094 -1274.366150 -1274.448142 2.750025D-04
MUNgauss RevisionA2.0 retrievium 10-Aug-2020 DUDE C[NH+](C)[C@H](CNC(=O)C(=O)Nc1cccc2c1ccnc2)c3cccc(c3)F C48842994 RHF 6-31G(d) (6D,10F) C1 381.172679 |X|Y|Z| 45.281853 36.723309 110.055747
56.775318 22 6 7 19 3
|36.858105| |12.713406|53.358707| |9.380576|25.724171|0.500000| |7.781929|17.312824|0.259286|36.858105| |7.615731|16.930656|0.255735|7.490120|36.858105| |7.271709|12.460642|0.182396|6.827774|17.646850|0.500000| |4.921107|10.173777|0.187682|6.482361|12.343000|0.247921|36.858105| |3.870324|6.830301|0.127966|4.488301|7.815743|0.200756|13.265252|53.358707| |3.527511|5.825134|0.105490|4.064179|6.097001|0.186771|7.901427|19.348921|36.858105| |3.743207|6.072250|0.105598|4.490474|5.963494|0.203113|6.917706|11.541509|15.832672|73.516695| |2.811153|4.396875|0.082588|3.062323|4.257712|0.126593|5.062416|10.794154|12.390601|14.031935|36.858105| |2.621997|4.090792|0.079036|2.790353|3.920235|0.110761|4.664899|9.785731|8.058385|9.807696|15.891937|73.516695| |2.543236|3.852123|0.071866|2.759644|3.536024|0.108513|3.974847|7.282063|7.977945|12.497636|14.289212|14.839096|53.358707| 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|2.166632|3.066788|0.057133|2.210553|2.629704|0.082456|2.676788|4.271315|3.952997|7.349926|4.665742|6.934994|8.928000|7.553295|5.085965|4.512198|5.121965|7.909766|13.414019|36.858105| |1.960859|2.723513|0.051037|1.969298|2.274914|0.070720|2.276860|3.517218|3.110147|5.814663|3.508014|5.469456|6.088454|5.103636|3.959183|3.827335|4.605560|7.000764|7.951992|14.038298|36.858105| |1.730308|2.404891|0.045610|1.738841|1.988641|0.060619|2.006082|3.084017|2.652747|4.842118|3.029140|4.904620|5.089723|4.500979|3.792634|3.969455|5.177398|7.938737|6.782743|7.964892|14.093895|53.358707| |1.666966|2.344618|0.044792|1.691745|1.951162|0.058723|2.002193|3.120693|2.671111|4.751294|3.162412|5.227528|5.338425|5.123555|4.536216|5.133749|7.679838|13.394481|7.875500|7.027931|8.424599|20.095982|36.858105| |6.396091|10.403963|0.202704|4.947583|12.569918|0.246888|7.486184|8.674682|4.959935|8.022239|3.925409|6.858717|4.403588|2.685723|2.457223|2.106171|1.971754|2.085174|2.422878|2.481326|2.170588|2.616286|1.896920|36.858105| |5.338448|7.329823|0.138103|3.913333|7.583265|0.204543|5.305792|7.187666|4.615596|7.544437|3.918288|6.853550|4.506851|2.796634|2.524721|2.180802|2.067986|2.212067|2.574239|2.671896|2.347070|2.813646|2.025554|13.747884|36.858105| |4.133519|5.514166|0.110162|3.114313|5.021817|0.133130|4.010998|5.579419|3.638259|5.897844|3.336345|6.100169|3.910252|2.532437|2.342654|2.067598|1.965822|2.075325|2.355626|2.410977|2.158898|2.640464|1.914098|7.918446|13.706379|36.858105| |3.742184|5.136004|0.108728|2.926233|4.424275|0.110633|3.740078|5.061902|3.190526|5.129068|2.952767|5.542788|3.447899|2.263553|2.147887|1.913122|1.803344|1.870020|2.088378|2.100856|1.895011|2.354293|1.723655|6.826915|7.912434|13.792370|36.858105| |4.077473|5.952497|0.133777|3.303118|5.034437|0.116781|4.333431|5.534198|3.310647|5.290939|2.964933|5.561388|3.409928|2.208205|2.109584|1.864832|1.740954|1.794427|2.009103|2.008708|1.801884|2.238694|1.644847|7.976944|6.937080|8.029338|13.790574|36.858105| |5.177215|8.398328|0.195219|4.289320|7.538242|0.155080|6.099442|7.064976|3.980380|6.355788|3.342342|6.104304|3.774446|2.372093|2.236658|1.944504|1.808334|1.877305|2.134983|2.146499|1.902225|2.336399|1.710832|13.668594|7.932948|6.873952|7.890240|13.837690|36.858105| |3.394626|4.957202|0.114423|2.901644|3.932310|0.092835|3.619379|4.616010|2.804413|4.514773|2.566580|4.862251|2.993434|1.972860|1.917261|1.716254|1.599333|1.629909|1.798812|1.783466|1.614630|2.029723|1.499116|5.312915|4.685446|5.324362|8.171006|14.434992|8.220473|97.533100| |17.653485|12.309287|0.226629|7.190352|5.560826|0.145916|4.098374|4.450428|3.001994|5.658909|2.452713|4.100343|3.058848|1.938104|1.772605|1.575835|1.519141|1.621742|1.837747|1.948976|1.784658|2.163525|1.532209|4.877631|4.171808|3.464074|3.263914|3.584365|4.362218|7.039058|0.500000| |17.702264|12.250143|0.222241|5.629722|7.105271|0.183511|4.574309|5.126308|3.388100|6.175010|2.774265|4.687545|3.389464|2.136140|1.944041|1.717691|1.652003|1.767550|2.016867|2.136360|1.938934|2.339800|1.660147|7.433870|6.486105|5.061838|4.534726|4.855575|6.008627|8.755947|0.299427|0.500000| |17.644572|12.329934|0.181781|7.148755|6.893975|0.217203|4.625040|5.180535|3.655352|7.196854|2.901313|4.704351|3.648845|2.264534|2.018261|1.774699|1.721368|1.870695|2.161963|2.345900|2.125890|2.522372|1.766048|5.552999|5.086228|3.895642|3.390821|3.535068|4.320595|6.649552|0.299177|0.299031|0.500000| |5.651340|12.217942|0.228834|17.690828|6.626527|0.159334|7.030437|6.380759|4.112353|7.829020|3.105280|5.080868|3.762815|2.293644|2.114532|1.828465|1.717297|1.810281|2.082695|2.145046|1.902393|2.304542|1.663638|4.562580|3.564850|2.905333|2.794903|3.215356|4.177569|6.500404|0.149210|0.126148|0.143146|0.500000| |7.502014|12.317713|0.217266|17.657779|5.522671|0.144050|4.782395|4.881399|3.313165|6.457601|2.615308|4.287904|3.269832|2.038569|1.866849|1.643207|1.570542|1.670711|1.905017|2.003439|1.813524|2.195441|1.563935|4.144754|3.416500|2.819014|2.683790|3.005827|3.751301|6.076293|0.231418|0.149001|0.188571|0.301016|0.500000| |6.809071|12.297635|0.181429|17.644543|7.066405|0.209558|6.220233|6.275993|4.473411|9.465956|3.294464|5.173769|4.124520|2.476899|2.211443|1.908262|1.821250|1.964482|2.296361|2.444583|2.164909|2.568096|1.821222|4.605611|3.853345|3.031311|2.769024|3.022980|3.817561|5.927050|0.166851|0.141056|0.204935|0.299017|0.299091|0.500000| |4.454182|9.035257|0.192472|5.738289|8.731938|0.173863|17.608806|12.602710|5.832757|8.985821|4.298747|7.511686|4.650715|2.771988|2.613274|2.194872|1.995696|2.062574|2.393278|2.365592|2.041799|2.489357|1.839569|6.843187|4.748826|3.828920|3.793196|4.659495|6.702308|9.077595|0.107507|0.117889|0.111399|0.185125|0.124328|0.141826|0.500000| |4.642659|9.439021|0.168263|7.482478|8.767683|0.213558|17.664389|12.693341|7.415819|13.330334|4.739303|7.448271|5.342288|3.048201|2.768465|2.296864|2.111490|2.228804|2.644749|2.673371|2.278719|2.725041|1.990004|5.481484|4.254843|3.330964|3.108352|3.515810|4.644813|6.855060|0.111089|0.114118|0.125456|0.245575|0.146924|0.211675|0.301711|0.500000| |3.412588|5.801675|0.113903|3.763863|6.163806|0.154325|8.913289|25.997146|9.489587|10.893252|7.738922|15.209309|6.874515|3.902046|3.687168|2.925848|2.570692|2.637039|3.146291|2.979849|2.471149|2.999933|2.262627|5.919058|5.063404|4.186801|3.921848|4.300642|5.258611|8.163487|0.081580|0.094964|0.091774|0.109908|0.086645|0.104612|0.226438|0.183861|0.500000| |2.659772|4.011775|0.073622|2.939455|3.628782|0.114839|4.014101|6.963074|7.926769|15.062151|9.633082|10.891759|26.009351|9.141346|5.884833|4.289047|4.010223|4.726555|7.127810|7.045343|4.745167|5.173655|3.819284|3.199768|3.251154|2.770241|2.429255|2.414049|2.704702|4.762091|0.065254|0.071201|0.079296|0.081011|0.070910|0.092035|0.093839|0.114218|0.126862|0.500000| |1.990776|3.009050|0.058563|2.151063|2.645216|0.075752|3.032803|5.289216|4.484823|6.785121|6.780233|13.339185|9.769417|9.026428|17.775098|8.848355|5.660932|4.948806|5.616191|4.117742|3.295181|4.268455|3.613949|2.558459|2.577312|2.390977|2.224641|2.216305|2.360011|4.556934|0.050164|0.054966|0.056449|0.061464|0.053301|0.062831|0.078849|0.081906|0.115168|0.149844|0.500000| |1.611871|2.364139|0.046345|1.695728|2.000820|0.057397|2.188977|3.550971|2.897267|4.701586|3.750822|7.068517|5.667249|5.652620|8.861244|17.737613|8.996156|5.630660|4.912260|3.597176|3.161856|4.504609|4.147089|1.973190|2.026686|1.942892|1.824869|1.787714|1.850997|3.744400|0.041244|0.044781|0.045820|0.047956|0.043028|0.049296|0.057866|0.059523|0.076057|0.098987|0.215152|0.500000| |1.516802|2.172420|0.042211|1.563262|1.811474|0.052975|1.913384|3.018360|2.501567|4.251667|3.074229|5.432853|4.902441|4.923484|5.624738|8.987503|17.719482|8.835599|5.580539|4.174393|4.022311|6.491538|7.041215|1.783522|1.869509|1.796384|1.661311|1.602100|1.651417|3.338537|0.038934|0.042139|0.043719|0.043494|0.040084|0.045905|0.049956|0.052431|0.062767|0.091126|0.124167|0.215415|0.500000| |2.451160|3.471483|0.063691|2.502686|3.013367|0.097176|3.029811|4.832874|4.642062|9.063554|5.185414|7.324462|9.858741|6.787227|4.585843|3.882860|4.125833|5.605563|8.730160|17.746815|9.061887|7.751356|5.037487|2.785337|3.004803|2.637503|2.263905|2.170841|2.354779|4.285267|0.060560|0.066657|0.074794|0.066755|0.062411|0.078165|0.072764|0.084424|0.091084|0.242628|0.108727|0.088710|0.095649|0.500000| |1.994673|2.729057|0.050894|1.979022|2.249375|0.070512|2.210062|3.341832|2.922162|5.586565|3.153441|4.920116|5.259019|4.114935|3.288420|3.154861|3.657018|5.020162|5.635051|9.000226|17.729216|12.611326|5.940426|2.138367|2.321076|2.128975|1.860750|1.766013|1.866073|3.556135|0.050558|0.054651|0.060707|0.052583|0.050982|0.060754|0.054947|0.061686|0.064613|0.116755|0.078732|0.074620|0.091545|0.217839|0.500000| |1.525742|2.141015|0.041178|1.545925|1.764683|0.052588|1.811336|2.794960|2.343956|4.145885|2.741044|4.633292|4.459908|4.159374|3.946208|4.705226|7.057857|8.829685|5.615545|5.029254|5.893978|12.827448|17.681902|1.726829|1.836891|1.755447|1.597411|1.525529|1.575547|3.154774|0.039208|0.042297|0.044648|0.042354|0.039937|0.045901|0.046707|0.049978|0.056706|0.088171|0.089965|0.111277|0.213630|0.108920|0.129946|0.500000| |5.208176|6.882354|0.122973|3.872563|7.027092|0.226800|4.993877|7.015187|4.937779|8.423514|4.173277|6.979297|4.942076|3.030925|2.658267|2.287487|2.196452|2.397988|2.837656|3.027238|2.642454|3.106008|2.205771|8.903052|17.719889|8.920263|5.643423|4.985468|5.636892|8.337714|0.112343|0.166042|0.150549|0.096215|0.093829|0.111057|0.118232|0.116577|0.131709|0.100869|0.073978|0.058258|0.054835|0.096807|0.073205|0.054987|0.500000| |3.576674|4.648687|0.091697|2.738615|4.099117|0.114100|3.388724|4.830629|3.305509|5.437014|3.145545|5.735319|3.792780|2.511886|2.316637|2.071711|1.994265|2.116961|2.383472|2.457165|2.227076|2.732418|1.971644|5.643081|8.916855|17.739523|8.952218|5.688326|4.954259|9.625157|0.085030|0.118594|0.096966|0.070903|0.069785|0.075403|0.089059|0.080753|0.100540|0.074533|0.064738|0.053925|0.050822|0.074067|0.061219|0.050295|0.215807|0.500000| |3.147327|4.261835|0.090435|2.521450|3.541709|0.090602|3.109635|4.261022|2.752910|4.456888|2.621691|4.966049|3.115696|2.090411|2.007020|1.815048|1.717526|1.768455|1.945852|1.948032|1.777738|2.233744|1.640349|4.930902|5.617278|8.853564|17.749932|8.953456|5.642114|16.691419|0.078500|0.103611|0.080327|0.067382|0.065270|0.066613|0.088217|0.073768|0.092397|0.060772|0.057587|0.048439|0.044309|0.057575|0.048475|0.042548|0.123756|0.213298|0.500000| |4.892043|8.553175|0.221840|4.547970|6.853603|0.138599|6.286848|6.775050|3.764848|6.060814|3.140496|5.727932|3.564491|2.245126|2.138875|1.863187|1.724976|1.778440|2.011692|2.010423|1.785945|2.204958|1.620005|8.754653|5.608935|4.953084|5.657504|9.040657|17.699909|17.018316|0.120138|0.146974|0.111747|0.129074|0.110740|0.107987|0.217873|0.135874|0.139530|0.071281|0.063238|0.049591|0.043884|0.060974|0.048616|0.041599|0.123112|0.107558|0.125080|0.500000|
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