Version2.1 2020-12-16T22:59:27Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 01-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cc2cc(c(=O)[nH]c2cc1C)[C@@H](c3nnnn3C(C)(C)C)[NH+]4CCc5ccccc5C4 C06320975 RHF 6-31G(d) (6D,7F) Cc1cc2cc(c(=O)[nH]c2cc1C)[C@@H](c3nnnn3C(C)(C)C)[NH+]4CCc5ccccc5C4 C01[X(C26H31N6O1)] 186 C1 557 Cc1cc2[nH]c(=O)c(cc2cc1C)[C@@H](c1nnnn1C(C)(C)C)[NH+]1CCc2c(C1)cccc2 Cc1cc2[nH]c(=O)c(cc2cc1C)[C@@H](c1nnnn1C(C)(C)C)[NH+]1CCc2c(C1)cccc2 Cc1cc2NC(=O)C(=Cc2cc1C)[C@H]([NH+]3CCc4ccccc4C3)c5nnnn5C(C)(C)C InChIKey=ZRLILBIXHQQGGK-QHCPKHFHSA-O InChI=1S/C26H30N6O/c1-16-12-20-14-21(25(33)27-22(20)13-17(16)2)23(24-28-29-30-32(24)26(3,4)5)31-11-10-18-8-6-7-9-19(18)15-31/h6-9,12-14,23H,10-11,15H2,1-5H3,(H,27,33)/p+1/t23-/m0/s1 InChI=1/C26H30N6O/c1-16-12-20-14-21(25(33)27-22(20)13-17(16)2)23(24-28-29-30-32(24)26(3,4)5)31-11-10-18-8-6-7-9-19(18)15-31/h6-9,12-14,23H,10-11,15H2,1-5H3,(H,27,33)/p+1/t23-/m0/s1/fC26H31N6O/h27,31H/q+1 Cc1cc2cc(c(=O)[nH]c2cc1C)[C@@H](c3nnnn3C(C)(C)C)[NH+]4CCc5ccccc5C4 C01[X(C26H31N6O1)] 186 C01 557 Cc1cc2[nH]c(=O)c(cc2cc1C)[C@@H](c1nnnn1C(C)(C)C)[NH+]1CCc2c(C1)cccc2 O=C1N[C]2[CH][C]([C]([CH][C]2[CH]=C1[C@@H]([C]1[N][N][N][N]1C(C)(C)C)[NH]1CC[C]2[C]([CH][CH][CH][CH]2)C1)C)C C[C]1[CH][C]2NC(=O)C(=C[C]2[CH][C]1C)[C@@H]([C]3[N][N][N]N3C(C)(C)C)[NH]4CC[C]5[CH][CH][CH][CH][C]5C4 InChIKey=JUCDKHOPPURLPR-QHCPKHFHSA-N InChI=1S/C26H31N6O/c1-16-12-20-14-21(25(33)27-22(20)13-17(16)2)23(24-28-29-30-32(24)26(3,4)5)31-11-10-18-8-6-7-9-19(18)15-31/h6-9,12-14,23,31H,10-11,15H2,1-5H3,(H,27,33)/t23-/m0/s1 InChI=1/C26H31N6O/c1-16-12-20-14-21(25(33)27-22(20)13-17(16)2)23(24-28-29-30-32(24)26(3,4)5)31-11-10-18-8-6-7-9-19(18)15-31/h6-9,12-14,23,31H,10-11,15H2,1-5H3,(H,27,33)/t23-/m0/s1/f/h27H 3427.4072028078 -1403.9817777 1-A 16649.2934 118 439 557 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3303.5527 3304.0331 3313.9960 3332.6137 3336.4882 3354.1358 3358.9645 3361.3197 3366.6007 3370.4031 3375.1770 3386.2691 3386.4154 3401.5826 3491.6382 3831.4177 4.1874 4.5289 4.6711 3.2819 3.8183 3.9909 6.0355 4.8732 4.3736 4.6127 1.1387 3.2288 4.7059 3.3975 4.3143 3.1363 1.2947 3.5772 1.7206 2.1115 2.4209 1.9758 2.5901 1.9084 3.2118 2.4356 2.6184 1.4584 2.1734 3.0646 2.9417 3.7128 2.8479 5.0240 4.1033 3.0928 2.9830 3.1637 3.9676 2.9223 3.7035 3.0726 4.1390 3.8044 4.0923 5.3163 4.7844 3.1331 4.2157 6.5683 3.9676 3.9390 1.3390 3.6996 3.4918 5.0979 4.5502 5.3392 5.2084 5.7223 1.5898 2.7937 6.7376 3.1583 3.3378 5.7099 2.8430 3.3061 2.7497 1.5050 1.6213 2.0186 1.3777 1.6772 1.6603 1.5103 1.1977 1.8689 1.5049 1.5651 1.8250 2.2640 2.3458 3.5101 1.3519 3.4240 2.0372 1.4468 1.4538 2.9211 1.6120 2.1206 2.7895 3.1106 3.3275 1.8975 2.6704 2.9286 4.1194 5.2782 2.1419 1.3916 1.3026 2.0643 2.3519 1.8947 1.5218 2.2624 2.6839 1.7388 1.7833 2.9755 1.5995 1.4727 2.2035 3.8067 1.3651 2.4168 1.3379 1.5337 1.6554 1.3343 1.3598 1.2768 1.5597 1.2761 1.3834 6.9040 1.2140 3.3811 1.5093 1.0447 1.0563 2.2341 1.0565 1.0934 1.0784 1.3098 1.0433 1.0990 1.2721 1.3513 1.1443 1.0964 1.1090 1.0802 2.2286 2.3445 10.2676 6.1732 6.3626 5.8314 5.4377 6.1926 5.9685 1.0381 1.0377 1.0594 1.0460 1.0366 1.0391 1.0713 1.0900 1.1026 1.1020 1.0860 1.0922 1.1025 1.1013 1.1042 1.1027 1.1042 1.1029 1.0877 1.1044 1.0935 1.0937 1.0922 1.0909 1.0928 1.1011 1.0920 1.0935 1.0984 1.0806 1.0786 0.0005 0.0016 0.0029 0.0026 0.0054 0.0076 0.0165 0.0269 0.0312 0.0431 0.0122 0.0409 0.0636 0.0513 0.0812 0.0684 0.0302 0.1042 0.0634 0.0838 0.1002 0.0919 0.1271 0.0968 0.1753 0.1382 0.1652 0.1020 0.1563 0.2455 0.2613 0.3571 0.2769 0.5244 0.4521 0.3808 0.3892 0.4272 0.5549 0.4339 0.5704 0.4836 0.6835 0.6852 0.7604 1.0678 1.0238 0.7211 1.0151 1.6981 1.1318 1.1339 0.4123 1.2480 1.2611 1.8811 1.7390 2.0567 2.0174 2.2260 0.6708 1.2118 2.9551 1.4595 1.5993 2.8107 1.4495 1.7478 1.5287 0.8418 0.9340 1.1905 0.8203 1.0210 1.0164 0.9977 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3.3763 2.7154 13.0678 9.0386 0.1673 3.1061 1.2801 8.9182 2.8830 1.6798 6.9428 1.4605 0.9408 8.7706 21.3208 13.6053 30.3325 3.2338 26.1166 1.0533 3.0334 67.0793 1.4249 0.5369 4.3555 8.8560 5.0272 0.9457 0.0705 51.0213 11.8765 13.9338 13.9352 20.2979 6.4045 4.4766 11.9935 19.7848 25.5585 12.8552 30.8228 9.5595 0.1331 0.2655 10.1482 0.1303 2.5820 16.4311 6.6145 20.4874 9.6705 13.9457 31.9793 0.1598 10.2421 10.2343 1.7594 6.6189 10.5255 0.0815 9.1075 1.7401 5.7949 24.3489 1.9150 10.9222 66.1605 21.3478 7.4668 9.2574 9.1962 33.4739 2.9996 14.9514 4.6789 2.9395 91.9976 4.6331 44.8661 16.8156 26.6899 2.5922 11.4937 32.0128 8.2573 46.3689 22.8896 1.2858 7.1505 0.9557 24.5280 6.6656 9.0229 64.5808 2.2415 171.6010 24.4814 8.1966 105.1045 29.6990 0.1924 0.7807 8.6826 0.3876 11.0901 1.9856 3.6403 17.0672 2.1221 141.2167 27.8336 84.2153 38.1628 17.2137 3.4983 19.7984 12.8055 9.3862 114.0320 0.8471 6.9430 1.1226 195.2468 1079.5803 16.1556 36.3180 8.7022 23.1472 27.5684 4.9381 10.3481 3.5773 9.7028 20.7654 41.4818 14.4326 22.5667 59.9313 9.3423 13.9730 1.8226 37.5427 11.8591 10.3924 2.1166 14.8929 10.6825 2.6107 6.1904 5.4429 9.0349 10.2435 13.9773 264.2241 94.9339 0.4532 4.6560 5.8247 0.8957 4.3151 1.5541 1.2935 0.1849 1.9842 2.1929 0.2854 1.8262 1.2475 1.7194 2.5531 0.9778 0.7454 0.9158 0.6885 2.5887 0.4214 2.2335 2.0447 0.2296 0.4837 0.5814 0.2344 0.2652 0.6387 0.8646 0.1552 3.1515 0.5626 4.6286 2.1025 3.1664 3.0271 1.5604 3.0940 0.6591 3.8981 1.0145 1.3610 1.4611 4.2396 3.1973 0.9464 9.4213 6.3251 1.6645 1.3826 2.3657 3.3060 4.3134 2.5180 11.2051 7.0071 36.4034 1.4831 5.0113 1.5369 5.1105 1.2369 6.4760 2.7869 3.5670 1.4473 2.3561 1.6011 2.2014 2.8006 2.1066 3.1252 5.8551 4.8623 0.4196 0.1713 2.2117 4.3746 10.5001 1.8993 13.3910 9.1767 5.4540 0.0466 9.1811 1.8068 4.5864 0.3229 14.5294 0.4184 9.2539 3.2136 5.5639 5.7189 8.8720 15.3487 18.4152 5.6254 12.2509 3.3192 4.3850 5.3323 4.7365 1.2811 10.6721 10.3332 114.9131 5.9004 9.2186 10.5237 1.1785 13.4296 15.7120 149.7800 373.0184 27.1574 80.8250 12.9900 16.2663 8.8237 2.3482 12.4980 1.3870 11.3362 18.2042 30.9037 32.5438 0.7156 7.1749 104.7378 24.1166 6.7187 0.8202 13.9817 19.9833 20.5974 13.7692 14.9013 4.1900 64.6492 39.7699 19.8195 8.0890 8.5774 2.8859 9.6243 2.2111 10.5340 331.2648 11.8481 14.9137 21.8091 356.9730 61.2635 51.2756 352.3890 137.1929 14.8921 43.4368 188.3769 49.1378 58.4802 44.9427 156.6567 111.0666 28.0735 49.3843 56.5112 44.2251 78.7038 18.0660 144.1554 36.6401 52.4028 18.1944 89.2006 38.9558 91.6982 86.7002 68.1929 67.2504 84.6651 260.4195 22.8265 55.7714 0.7331 0.7500 0.7499 0.7498 0.7448 0.7497 0.7376 0.6294 0.6794 0.6622 0.7008 0.7178 0.7483 0.5457 0.4195 0.4126 0.7229 0.2301 0.3258 0.3207 0.5246 0.7453 0.6865 0.7360 0.4120 0.7435 0.1008 0.4691 0.6800 0.1560 0.7257 0.3259 0.5663 0.4152 0.3009 0.7223 0.6046 0.3980 0.0816 0.6713 0.7337 0.6060 0.6926 0.6236 0.5323 0.5031 0.7255 0.1050 0.3608 0.6724 0.6005 0.1458 0.6319 0.2448 0.2039 0.2916 0.2423 0.0871 0.2625 0.1302 0.1483 0.2366 0.5790 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1.00783 1.00783 1.00783 1.00783 12040.3717 19486.3076 27348.6748 0.99990 0.01385 0.00167 -0.01382 0.99969 -0.02079 -0.00195 0.02076 0.99978 1 0.00719 0.00444 0.00317 0.14989 0.09262 0.06599 20.29 35.08 46.40 52.37 70.72 81.72 98.13 139.33 158.24 181.27 194.01 211.03 217.91 230.41 257.15 276.81 286.27 319.95 359.71 373.51 381.31 404.22 415.27 422.14 437.89 446.52 470.89 495.68 502.66 530.48 558.64 581.34 584.49 605.57 622.21 657.70 677.04 688.82 701.01 722.24 735.59 743.67 761.74 795.49 807.98 840.06 867.10 899.23 919.79 953.08 1001.12 1005.67 1040.08 1088.66 1126.48 1138.63 1158.78 1163.36 1166.56 1169.08 1217.59 1234.48 1241.38 1274.21 1297.49 1315.11 1338.40 1362.88 1397.62 1401.91 1422.68 1439.47 1446.38 1462.46 1466.59 1523.50 1533.50 1566.39 1575.61 1587.20 1591.61 1618.56 1629.03 1632.56 1637.47 1648.55 1654.43 1661.52 1667.06 1679.22 1700.90 1724.50 1748.61 1752.57 1779.81 1784.82 1805.84 1834.03 1855.87 1868.36 1878.99 1886.44 1892.12 1914.15 1955.17 1965.97 1969.18 1981.29 1988.46 2003.64 2029.11 2031.28 2039.58 2053.07 2072.43 2082.81 2126.89 2159.19 2189.52 2205.67 2237.50 2244.90 2249.72 2253.02 2257.31 2271.62 2283.46 2290.80 2295.57 2326.00 2329.66 2332.87 2336.07 2341.28 2341.94 2344.75 2346.46 2352.93 2355.42 2357.87 2366.88 2369.49 2374.35 2382.02 2385.98 2393.98 2402.09 2407.03 2473.38 2539.77 2574.44 2606.22 2608.29 2640.07 2734.44 4620.09 4627.98 4628.60 4628.65 4647.37 4662.99 4669.78 4696.98 4700.21 4709.58 4716.22 4721.65 4736.58 4744.37 4750.87 4753.08 4753.77 4768.10 4794.89 4800.46 4825.85 4832.80 4836.19 4843.79 4849.26 4856.13 4872.09 4872.30 4894.12 5023.69 5512.56 0.583425 0.611026 0.611970 0.524101 -1403.398352 -1403.370752 -1403.369808 -1403.457676 2.947107D-04 MUNgauss RevisionA2.0 retrievium 16-Dec-2020 DUDE Cc1cc2cc(c(=O)[nH]c2cc1C)[C@@H](c3nnnn3C(C)(C)C)[NH+]4CCc5ccccc5C4 C06320975 RHF 6-31G(d) (6D,10F) C1 443.255935 |X|Y|Z| 98.517361 74.975474 36.363223 64.520559 26 6 7 20 6 |36.858105| |12.607969|36.858105| |7.608424|13.906901|36.858105| |4.998599|7.851646|13.557838|36.858105| |3.807130|5.073535|7.617750|13.265169|36.858105| |3.063781|3.916514|5.107056|7.813398|14.165187|36.858105| |2.905281|3.752027|4.488994|6.709114|7.834346|12.949776|36.858105| |2.462536|3.050692|3.495321|4.706594|5.372294|8.050353|15.697739|73.516695| |3.348439|4.559216|5.205487|8.005940|7.003955|7.963003|14.061917|15.146921|53.358707| |3.045105|4.000556|4.269657|5.800369|5.123629|5.800269|9.573146|14.117010|25.950329|0.500000| |4.420447|6.807038|7.923014|13.718479|7.872037|6.781662|7.821577|9.611458|18.787127|0.256411|36.858105| |4.999763|7.860508|6.891337|7.900633|5.138902|4.532527|5.156920|7.280985|10.717317|0.202144|13.664140|36.858105| |7.472440|13.418212|7.945906|6.825732|4.507982|3.773715|3.935044|5.746263|7.056651|0.132767|7.915542|13.835810|36.858105| |6.444305|7.498893|5.034645|4.430694|3.322231|2.922578|3.084434|4.741486|5.277257|0.105804|5.033311|7.636995|12.626661|36.858105| |2.537348|3.051698|3.804163|4.952379|7.587987|12.490515|7.390640|11.685215|6.858653|0.116123|4.400825|3.329851|2.912637|2.374910|36.858105| |2.549031|3.002355|3.793238|4.680090|7.221604|8.891727|5.531382|8.721706|5.728302|0.098298|3.941321|3.067831|2.778994|2.278371|17.671286|0.500000| |2.341193|2.764072|3.335214|4.145757|5.622445|7.614608|5.841691|9.863171|5.909834|0.104349|3.822058|3.018993|2.665920|2.219478|12.584135|0.246639|36.858105| |2.182249|2.574304|2.995923|3.705649|4.586381|6.152966|5.801571|10.815280|5.942078|0.109574|3.662681|2.959964|2.565679|2.170669|7.795550|0.159721|14.741768|53.358707| |2.027700|2.338335|2.669504|3.154211|3.731959|4.500673|4.246540|7.726882|4.779887|0.090278|3.097537|2.608721|2.319448|2.001696|5.367022|0.124996|9.078905|19.511365|53.358707| |2.053641|2.336556|2.698126|3.111075|3.742693|4.281609|3.764862|6.549422|4.330122|0.080477|2.932529|2.481322|2.260902|1.949245|5.255151|0.131844|8.931161|12.226644|20.732933|53.358707| |2.242081|2.575161|3.074740|3.601754|4.647128|5.362092|4.261597|7.136943|4.744432|0.085460|3.250226|2.671669|2.439397|2.062975|7.344868|0.190910|14.196019|12.115673|12.373013|19.488678|53.358707| |2.222930|2.484124|2.974379|3.307651|4.199513|4.382611|3.443035|5.678360|4.016013|0.072599|2.882757|2.425434|2.288537|1.951344|5.627556|0.173149|7.254424|7.151353|7.402753|10.618160|17.277129|36.858105| |2.030563|2.218493|2.570008|2.767328|3.282521|3.355871|2.819366|4.724634|3.416450|0.063170|2.475087|2.153049|2.059227|1.794282|3.958530|0.115543|5.025841|5.782173|6.643944|9.765701|10.539967|12.426143|36.858105| |1.998902|2.207950|2.611405|2.882801|3.630490|3.863276|3.096556|5.269507|3.584308|0.065643|2.544843|2.163087|2.044736|1.764102|5.201128|0.171078|5.873739|6.056780|6.007113|7.629653|10.519048|12.435573|7.609318|36.858105| |2.627239|2.934969|3.646566|3.941465|5.099084|4.757734|3.563007|5.592255|4.286146|0.075851|3.231717|2.699326|2.602541|2.178840|5.478829|0.179053|5.943175|5.969364|5.802368|7.299359|10.448642|12.445828|7.643885|7.530001|36.858105| |2.209594|2.611699|3.107591|3.901991|5.183931|7.615319|6.492201|12.670281|6.080155|0.109621|3.730880|2.946820|2.563212|2.148519|12.590747|0.253170|7.752564|8.951659|6.314676|5.835773|7.156442|4.237956|3.232798|4.349516|3.938154|53.358707| |2.185674|2.606960|3.044185|3.878010|4.889441|7.384782|7.690131|18.171822|6.813451|0.125978|3.920657|3.095181|2.626439|2.208894|9.421612|0.183117|7.186028|9.844421|6.618916|5.727141|6.570319|3.766742|2.997503|3.710796|3.503238|25.395258|0.500000| |1.910978|2.193359|2.550630|3.036910|3.827680|4.921173|4.375282|8.610585|4.545707|0.085065|2.902741|2.402397|2.144265|1.844047|7.485523|0.188774|6.559883|7.941852|6.211931|5.884467|6.957515|4.260279|3.317600|4.809948|3.667944|17.282605|0.254557|36.858105| |1.721895|1.960264|2.219967|2.604734|3.104470|3.861589|3.774762|7.863957|4.077648|0.079199|2.577121|2.191335|1.951672|1.709251|4.961605|0.125448|4.542739|6.174436|5.091357|4.665354|5.093158|3.208492|2.673200|3.544454|2.839915|10.533628|0.205108|12.533122|36.858105| |1.737228|1.977458|2.224965|2.600361|3.039385|3.699904|3.703370|7.675219|4.089162|0.080090|2.593126|2.220857|1.977583|1.736821|4.383323|0.113859|3.724867|4.964042|4.120219|3.826988|4.215936|2.750431|2.309201|3.000849|2.558199|9.099721|0.178761|7.563258|12.598420|36.858105| |1.566063|1.759226|1.941992|2.221268|2.511173|2.942559|3.007153|6.154078|3.477837|0.069580|2.239351|1.970042|1.771029|1.583006|3.322424|0.087809|2.948998|4.010033|3.464513|3.230756|3.467416|2.308167|1.997228|2.509361|2.160519|6.127939|0.124923|5.009054|7.556317|13.686350|36.858105| |1.545089|1.726604|1.886925|2.134167|2.362268|2.698014|2.781217|5.569746|3.313722|0.066810|2.161972|1.928928|1.743924|1.570706|2.916875|0.078154|2.556620|3.449008|3.006358|2.827778|3.039010|2.056422|1.793357|2.211758|1.971126|5.109343|0.104222|3.877291|5.021076|7.906681|13.809103|36.858105| |1.682722|1.889895|2.071068|2.347576|2.586809|2.925591|3.011896|5.910482|3.615999|0.072447|2.373530|2.110323|1.906229|1.706398|3.069767|0.082921|2.595241|3.438776|2.963119|2.804353|3.060424|2.083590|1.799451|2.219981|2.043162|5.306949|0.106956|3.749738|4.433519|6.840332|7.947037|13.712407|36.858105| |1.900123|2.168098|2.424123|2.808197|3.173257|3.662696|3.711522|7.219423|4.319423|0.084591|2.807837|2.428126|2.171299|1.903986|3.840760|0.103565|3.073381|3.980965|3.339199|3.164087|3.533406|2.387750|2.014683|2.534237|2.365748|6.898510|0.135216|4.521476|5.018083|7.915002|6.900484|7.959129|13.815649|36.858105| |1.939603|2.233792|2.544841|3.016814|3.567392|4.362055|4.308395|8.653331|4.702534|0.090398|2.983714|2.511121|2.223941|1.925560|4.958328|0.130247|3.845996|4.933097|4.010373|3.768429|4.271823|2.814970|2.321236|3.019781|2.720264|10.383271|0.193856|6.730845|7.570909|13.744687|7.954887|6.872760|7.921725|13.684879|36.858105| |2.240528|2.635403|3.119136|3.842907|4.909025|6.401172|5.676353|10.589310|5.771889|0.105046|3.657358|2.933165|2.577247|2.166574|7.656391|0.199210|5.009588|5.974787|4.646905|4.423223|5.280223|3.434549|2.708399|3.614607|3.395279|17.314705|0.258796|7.809600|6.453793|7.516523|5.012722|4.447288|5.052309|7.647476|12.593784|36.858105| |17.554774|8.820496|5.906709|4.280141|3.356201|2.779665|2.682710|4.109655|4.201424|0.079503|3.955753|4.571733|6.639986|6.511812|2.328370|0.065011|2.132439|2.723559|2.525498|2.542495|2.764368|2.011252|1.839734|1.840270|2.336858|2.823062|0.057094|1.802544|1.643866|1.676953|1.524677|1.518764|1.662817|1.865945|1.876756|2.137538|0.500000| |17.555143|8.821030|5.910501|4.281968|3.363428|2.786533|2.679377|4.090557|4.197488|0.079255|3.955847|4.571365|6.639456|6.511606|2.344163|0.064920|2.216570|2.847571|2.684891|2.719040|2.922127|2.124957|1.977395|1.896773|2.483782|2.787487|0.056649|1.791266|1.621263|1.622620|1.469906|1.445274|1.559467|1.744972|1.788961|2.046229|0.302563|0.500000| |17.593064|8.865869|7.330506|4.758889|3.836223|3.038896|2.785613|4.211068|4.216318|0.077422|3.968756|4.166891|5.531539|4.730641|2.568598|0.073154|2.365379|2.952769|2.756067|2.832845|3.126375|2.328328|2.124081|2.097194|2.812315|3.016268|0.060044|1.931062|1.724953|1.734762|1.560022|1.535453|1.670395|1.889602|1.936227|2.249375|0.302276|0.302267|0.500000| |7.068033|8.991686|17.701185|8.904777|7.003805|4.692774|3.910309|5.579506|5.742262|0.098178|5.648995|4.960337|5.638361|4.091900|3.730088|0.107974|3.277291|3.909127|3.531058|3.657936|4.234650|3.134542|2.699315|2.759012|4.013224|4.105005|0.080124|2.524638|2.174129|2.169370|1.893910|1.836998|2.010651|2.348367|2.471775|3.035730|0.153266|0.153459|0.226735|0.500000| |3.745059|4.676387|7.032009|8.851483|17.720013|9.059072|5.572789|7.611105|6.833269|0.110407|5.639491|4.180064|3.937619|3.009403|7.004305|0.218659|5.348080|5.678426|4.810929|5.057554|6.498123|4.689831|3.568612|4.054771|6.288116|6.485833|0.118974|3.727170|2.973272|2.891902|2.402613|2.259878|2.463887|2.996845|3.359414|4.574260|0.091300|0.091609|0.109854|0.213033|0.500000| |4.073692|5.602108|4.961375|5.634751|4.179960|3.952212|4.753805|7.123685|9.774719|0.218023|8.907906|17.715589|8.947997|7.091915|3.019316|0.076498|2.787335|3.827315|3.394534|3.178057|3.353581|2.217161|1.992010|1.995654|2.406453|3.761096|0.082162|2.281331|2.124361|2.160089|1.938865|1.905750|2.073870|2.352403|2.414663|2.744400|0.107527|0.107517|0.095746|0.107647|0.096437|0.500000| |6.544006|6.690659|4.610596|3.969784|3.067930|2.698782|2.798055|4.336383|4.646346|0.092665|4.310499|5.929051|8.857353|17.558233|2.235830|0.059875|2.130132|2.838528|2.659666|2.609574|2.739727|1.918632|1.788833|1.722139|2.146827|2.733621|0.057139|1.745609|1.613457|1.623407|1.482487|1.463574|1.576114|1.748642|1.780949|1.999862|0.174235|0.213138|0.133743|0.108203|0.078726|0.153778|0.500000| |6.546438|6.690251|4.608328|3.967488|3.061927|2.692029|2.801168|4.358140|4.650251|0.093032|4.308948|5.926998|8.854995|17.557683|2.221777|0.059939|2.054876|2.715260|2.504180|2.452092|2.608187|1.833570|1.684908|1.679397|2.049703|2.766693|0.057585|1.755797|1.635493|1.677557|1.538497|1.539802|1.682761|1.870102|1.867191|2.084481|0.213240|0.174332|0.133779|0.108134|0.078520|0.153727|0.302674|0.500000| |4.729529|5.536404|4.188251|3.975815|3.077686|2.806706|3.066281|4.804520|5.315074|0.111461|4.787054|7.364524|8.854623|17.606747|2.294044|0.060401|2.157745|2.921662|2.692450|2.588673|2.709973|1.860603|1.716141|1.689212|2.040311|2.871622|0.061029|1.814210|1.701061|1.731853|1.587352|1.577766|1.708906|1.893725|1.909755|2.121798|0.133297|0.133286|0.103948|0.096073|0.076539|0.227982|0.301786|0.301720|0.500000| |1.840821|2.008652|2.292684|2.484412|2.911806|3.059632|2.648519|4.552633|3.194933|0.059887|2.274779|1.993673|1.893451|1.666782|3.653653|0.104143|4.713501|5.730636|6.913945|10.173221|9.478185|8.732215|17.638040|6.948697|5.517488|4.257424|0.081409|3.334909|2.731290|2.315816|2.016858|1.794809|1.777269|1.969031|2.277651|2.599394|0.046758|0.049935|0.053031|0.065996|0.085814|0.051878|0.046076|0.043542|0.044665|0.500000| |1.981626|2.126899|2.450626|2.574354|3.009438|2.995122|2.522740|4.216035|3.103977|0.057569|2.283813|2.011563|1.953359|1.714532|3.459159|0.103937|4.076585|4.726031|5.211080|6.949278|7.648509|8.941323|17.581718|6.996116|7.090712|3.926619|0.073823|2.967769|2.431864|2.140801|1.871604|1.696977|1.708436|1.903071|2.162950|2.501181|0.050016|0.053596|0.058219|0.072692|0.092701|0.051603|0.047636|0.045068|0.045326|0.301301|0.500000| |2.123896|2.321657|2.670410|2.857042|3.307572|3.329995|2.843433|4.713689|3.512458|0.065030|2.568929|2.250764|2.159087|1.882671|3.734989|0.105669|4.775024|5.727036|6.768223|9.775031|9.539617|8.749609|17.610823|5.506431|6.949854|4.116261|0.079721|3.006512|2.471735|2.160896|1.880429|1.701079|1.713664|1.915352|2.185981|2.547040|0.052993|0.058076|0.061456|0.077368|0.098326|0.057807|0.052576|0.048714|0.049971|0.302084|0.301043|0.500000| |2.065678|2.302450|2.754761|3.086261|4.004146|4.337167|3.379389|5.747033|3.833288|0.069651|2.703000|2.267355|2.129720|1.823306|6.205580|0.225728|6.158355|6.133536|5.656218|6.664171|9.375177|8.709369|5.493090|17.553812|6.839720|7.137937|0.117495|5.826951|4.049919|3.460202|2.818850|2.474331|2.507962|2.922032|3.551671|4.397491|0.053098|0.053817|0.060160|0.080790|0.125303|0.057895|0.048969|0.048421|0.048477|0.140641|0.142570|0.122380|0.500000| |1.938910|2.102639|2.465557|2.644443|3.238129|3.311403|2.699638|4.569656|3.209936|0.059141|2.322982|2.008087|1.929253|1.679297|4.162553|0.137112|4.467732|4.862224|4.888300|6.047440|7.609133|8.848523|7.001753|17.584069|6.858506|4.868169|0.086240|3.886394|3.030382|2.650885|2.269954|2.034331|2.049322|2.312576|2.682798|3.141449|0.049708|0.051191|0.057075|0.073494|0.102157|0.051428|0.045764|0.044693|0.044470|0.174040|0.212398|0.141964|0.302986|0.500000| |1.820997|2.007237|2.330879|2.581477|3.170504|3.466110|2.902126|5.087607|3.355656|0.062418|2.342405|2.011140|1.889118|1.647577|4.637369|0.141718|5.490694|6.086798|6.276575|7.900168|9.621325|8.789069|6.924548|17.579538|5.483695|5.683895|0.101134|4.974082|3.744627|3.055239|2.576349|2.234951|2.198130|2.469340|2.961808|3.412893|0.046873|0.048316|0.052574|0.067327|0.094764|0.052210|0.044700|0.043547|0.044195|0.207844|0.170844|0.141346|0.300440|0.301535|0.500000| |2.886036|3.258462|4.072176|4.371494|5.452028|4.884273|3.724068|5.713359|4.607317|0.081004|3.551619|2.966744|2.871556|2.380194|5.115095|0.153396|5.722852|6.042172|5.959587|7.356910|9.685427|8.777982|6.823237|5.484866|17.580316|4.990179|0.093942|3.315573|2.637416|2.394997|2.039091|1.872649|1.945999|2.244814|2.553101|3.163198|0.069949|0.076603|0.085419|0.123439|0.180109|0.072781|0.065734|0.061381|0.061586|0.139791|0.169350|0.203267|0.140986|0.139461|0.122873|0.500000| |2.514000|2.718796|3.299420|3.403569|4.155025|3.813090|2.988699|4.762638|3.690458|0.066375|2.820096|2.425904|2.389984|2.036459|4.260919|0.138764|4.485624|4.817601|4.795974|5.921192|7.602801|8.882261|7.190355|6.747899|17.591988|4.492099|0.082156|3.163476|2.526288|2.305217|1.981976|1.824791|1.889211|2.159459|2.437939|2.957038|0.062428|0.066342|0.075941|0.103149|0.141571|0.060387|0.056166|0.053729|0.052771|0.144609|0.221535|0.178310|0.165320|0.200572|0.139223|0.301528|0.500000| |2.787923|3.162205|4.063689|4.477059|6.243806|5.620758|3.945123|6.072234|4.666912|0.081194|3.537281|2.887281|2.771218|2.284351|6.528989|0.240758|6.072686|5.914013|5.386254|6.334191|9.124414|8.713054|5.516423|6.971388|17.595384|6.110951|0.107307|4.011648|3.048182|2.800422|2.331747|2.137184|2.248202|2.654618|3.063208|3.975741|0.069193|0.071631|0.083245|0.126136|0.237819|0.070698|0.061664|0.060084|0.059180|0.122569|0.145180|0.140043|0.207747|0.174129|0.141324|0.299933|0.304388|0.500000| |1.894568|2.148562|2.510617|2.924425|3.701382|4.490199|3.824565|7.144437|4.119135|0.076601|2.723709|2.274103|2.067068|1.781568|6.667928|0.196693|5.622927|6.413359|5.331663|5.352394|6.516786|4.368582|3.354660|5.372092|3.809685|12.409366|0.180300|17.604090|8.781869|6.673673|4.683513|3.754827|3.689854|4.448717|6.326526|7.406163|0.049740|0.049118|0.053753|0.070344|0.104335|0.059474|0.046955|0.047492|0.048308|0.092729|0.085429|0.082685|0.196316|0.121974|0.150899|0.092557|0.093030|0.118228|0.500000| |1.872861|2.141877|2.481858|2.936525|3.674613|4.666906|4.155992|8.091253|4.377434|0.082168|2.809801|2.339364|2.094219|1.807221|7.116901|0.175155|7.837115|9.780170|7.828689|7.379835|8.531387|4.885127|3.808881|5.439079|3.910916|12.290615|0.213425|17.710310|8.870303|5.533257|4.106216|3.261521|3.123252|3.624705|4.928505|5.657214|0.048739|0.049218|0.052596|0.068348|0.099887|0.061817|0.047940|0.047490|0.049410|0.109190|0.091877|0.094830|0.171324|0.117083|0.165974|0.098310|0.092655|0.113826|0.300369|0.500000| |1.588468|1.783889|2.005007|2.303918|2.709762|3.245230|3.131817|6.315385|3.499532|0.068301|2.263389|1.956719|1.767369|1.563907|4.101704|0.108323|3.932391|5.319887|4.651993|4.369687|4.682911|3.049631|2.600292|3.476188|2.660742|7.656729|0.146584|8.986121|17.573132|8.869282|6.985214|4.682507|3.973903|4.239706|5.739211|4.948036|0.042206|0.041731|0.044401|0.055056|0.073509|0.052753|0.041269|0.041722|0.043174|0.075024|0.066361|0.066106|0.108450|0.083808|0.105231|0.068103|0.066929|0.078174|0.217089|0.211326|0.500000| |1.697819|1.940774|2.176665|2.568305|3.004900|3.776687|3.889477|8.502470|4.204062|0.083176|2.601641|2.222919|1.959000|1.722863|4.654140|0.112644|4.524044|6.677605|5.483660|4.793247|5.015548|3.058513|2.603549|3.242618|2.696714|9.291196|0.210961|8.911682|17.529974|8.876816|6.512170|4.543781|3.993602|4.392479|6.100426|5.415392|0.044974|0.044689|0.046881|0.058540|0.078414|0.060580|0.045214|0.045502|0.048013|0.074494|0.065087|0.067956|0.099232|0.077116|0.095804|0.071029|0.066387|0.078991|0.173714|0.220981|0.304045|0.500000| |1.458570|1.627645|1.785884|2.026132|2.275913|2.646109|2.704549|5.521896|3.160574|0.063604|2.045471|1.815908|1.640215|1.477093|3.003178|0.079376|2.774161|3.835751|3.390902|3.156388|3.323376|2.214241|1.946761|2.414639|2.043128|5.347846|0.110126|4.576911|7.026530|8.915707|17.708971|8.944554|5.650066|4.965604|5.655869|4.081337|0.039393|0.038280|0.040378|0.048489|0.060795|0.049849|0.038664|0.039806|0.041221|0.055268|0.050661|0.050864|0.074044|0.060854|0.070116|0.053623|0.052336|0.060363|0.118331|0.109653|0.205830|0.179548|0.500000| |1.428988|1.582621|1.711656|1.912174|2.086935|2.346425|2.426196|4.814232|2.948958|0.059954|1.943480|1.759785|1.602602|1.459594|2.510431|0.067566|2.250787|3.059803|2.716654|2.562356|2.720688|1.855343|1.642278|1.990294|1.778665|4.237779|0.086997|3.243379|4.096635|5.634924|8.943728|17.731870|8.899574|5.656204|4.953020|3.555567|0.039164|0.037297|0.039415|0.046347|0.055693|0.048574|0.037904|0.039862|0.040840|0.045836|0.043368|0.043399|0.061018|0.051340|0.056133|0.047118|0.046115|0.053082|0.087813|0.078325|0.110837|0.106456|0.215930|0.500000| |1.637845|1.824045|1.974881|2.205014|2.379390|2.625708|2.712131|5.219492|3.351878|0.067648|2.236731|2.023625|1.844444|1.668457|2.688754|0.073227|2.298456|3.047736|2.660939|2.531922|2.748525|1.891340|1.650783|2.001130|1.875368|4.441874|0.089876|3.112679|3.546848|4.936333|5.649880|8.892860|17.734253|8.942822|5.639647|4.122660|0.045348|0.042141|0.045081|0.053255|0.063157|0.055471|0.042727|0.046073|0.046484|0.045172|0.043814|0.043888|0.062195|0.051901|0.054808|0.049892|0.048577|0.057143|0.085918|0.074013|0.090463|0.090888|0.124204|0.214242|0.500000| |2.052762|2.350452|2.630802|3.035080|3.379264|3.781579|3.804915|7.081734|4.548457|0.088306|3.017646|2.612529|2.345642|2.045445|3.771729|0.103229|2.965668|3.791175|3.189650|3.048201|3.428755|2.343526|1.975753|2.454253|2.381669|6.328546|0.123339|3.956989|4.090600|5.634980|4.964717|5.655002|8.950524|17.697528|8.891609|7.134550|0.056375|0.051823|0.056651|0.070619|0.088449|0.069743|0.051730|0.056245|0.056236|0.053054|0.052124|0.052489|0.078494|0.062777|0.065342|0.063149|0.060570|0.075047|0.109872|0.090563|0.097748|0.101977|0.107712|0.124302|0.216029|0.500000| |2.477291|2.982415|3.551717|4.529997|5.682205|7.425807|6.962954|12.250756|7.050741|0.125648|4.387264|3.425022|2.946352|2.433719|7.100197|0.178252|4.663107|5.678248|4.420544|4.175029|4.924067|3.199791|2.560418|3.226646|3.283176|12.383218|0.228613|5.667018|4.948906|5.723229|4.252304|4.004574|4.742352|7.131771|8.898974|17.693826|0.065820|0.062179|0.068337|0.093646|0.138577|0.088331|0.061480|0.064979|0.066222|0.067537|0.065825|0.068204|0.105666|0.079128|0.083696|0.087409|0.079409|0.107084|0.147497|0.126745|0.109748|0.125151|0.097865|0.091067|0.112288|0.212221|0.500000| |2.262158|2.620852|3.140576|3.748077|4.876829|5.798773|4.724233|8.252700|5.076414|0.091598|3.403759|2.763401|2.496568|2.101229|7.175613|0.223782|4.735501|5.379560|4.347114|4.303338|5.268871|3.620734|2.809349|3.954249|3.656819|12.448461|0.181894|7.012062|5.476042|6.090222|4.389105|3.991483|4.534016|6.484244|8.818811|17.573813|0.059900|0.057068|0.064106|0.087470|0.135382|0.070839|0.054205|0.056605|0.056475|0.074071|0.073231|0.072334|0.139617|0.096741|0.100868|0.091887|0.089505|0.122927|0.220103|0.146068|0.126517|0.124874|0.101912|0.090838|0.106222|0.178345|0.301973|0.500000| 1402.477040 -10101.976447 4062.172078 -194.061965 -4831.389295 3427.407449 -1403.981845 2.001073 40B3240000000016 44A9F92B2090939D 442C0E3962E7C76A 421C3D01E5380002 406A1FFFFFFFFFFE 442468D309EDE12C