Version2.1 2021-01-14T00:18:01Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 01-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1cc(ccc1O)[C@@H]2[C@H]3CC=C[C@@H]3c4cc(ccc4N2)S(=O)(=O)NC5CCCCC5 C14458853 RHF 6-31G(d) (6D,7F) COc1cc(ccc1O)[C@@H]2[C@H]3CC=C[C@@H]3c4cc(ccc4N2)S(=O)(=O)NC5CCCCC5 C01[X(C25H30N2O4S1)] 180 C1 544 COc1cc(ccc1O)[C@H]1Nc2ccc(cc2[C@@H]2[C@@H]1CC=C2)S(=O)(=O)NC1CCCCC1 COc1cc(ccc1O)[C@H]1Nc2ccc(cc2[C@@H]2[C@@H]1CC=C2)S(=O)(=O)NC1CCCCC1 COc1cc(ccc1O)[C@H]2Nc3ccc(cc3[C@H]4C=CC[C@H]24)[S](=O)(=O)NC5CCCCC5 InChIKey=NSRINMXZOQSNGX-ZYLNGJIFSA-N InChI=1S/C25H30N2O4S/c1-31-24-14-16(10-13-23(24)28)25-20-9-5-8-19(20)21-15-18(11-12-22(21)26-25)32(29,30)27-17-6-3-2-4-7-17/h5,8,10-15,17,19-20,25-28H,2-4,6-7,9H2,1H3/t19-,20-,25+/m0/s1 InChI=1/C25H30N2O4S/c1-31-24-14-16(10-13-23(24)28)25-20-9-5-8-19(20)21-15-18(11-12-22(21)26-25)32(29,30)27-17-6-3-2-4-7-17/h5,8,10-15,17,19-20,25-28H,2-4,6-7,9H2,1H3/t19-,20-,25+/m0/s1 COc1cc(ccc1O)[C@@H]2[C@H]3CC=C[C@@H]3c4cc(ccc4N2)S(=O)(=O)NC5CCCCC5 C01[X(C25H30N2O4S1)] 180 C01 544 COc1cc(ccc1O)[C@H]1Nc2ccc(cc2[C@@H]2[C@@H]1CC=C2)S(=O)(=O)NC1CCCCC1 CO[C]1[CH][C]([CH][CH][C]1O)[C@H]1N[C]2[CH][CH][C]([CH][C]2[C@@H]2[C@@H]1CC=C2)[S@@]([O])(=O)NC1CCCCC1 CO[C]1[CH][C]([CH][CH][C]1O)[C@H]2N[C]3[CH][CH][C]([CH][C]3[C@H]4C=CC[C@H]24)[S]([O])(=O)NC5CCCCC5 InChIKey=NLILIHGYYPBKKV-ZYLNGJIFSA-N InChI=1S/C25H30N2O4S/c1-31-24-14-16(10-13-23(24)28)25-20-9-5-8-19(20)21-15-18(11-12-22(21)26-25)32(29,30)27-17-6-3-2-4-7-17/h5,8,10-15,17,19-20,25-26,28H,2-4,6-7,9H2,1H3,(H,27,29,30)/t19-,20-,25+/m0/s1 InChI=1/C25H30N2O4S/c1-31-24-14-16(10-13-23(24)28)25-20-9-5-8-19(20)21-15-18(11-12-22(21)26-25)32(29,30)27-17-6-3-2-4-7-17/h5,8,10-15,17,19-20,25-26,28H,2-4,6-7,9H2,1H3,(H,27,29,30)/t19-,20-,25+/m0/s1/f/h27H 3368.7694845679 -1769.9418961 1-A 23434.2907 121 423 544 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21.3606 22.2901 36.5224 53.9615 67.3541 84.5900 97.1805 104.8418 125.2616 129.5004 157.0847 172.8746 180.7140 205.2547 228.5553 243.2164 244.9377 258.8191 272.6001 298.6500 303.3515 313.1646 330.9078 343.3765 354.8173 379.3690 393.0544 414.1401 421.1713 429.4419 435.0143 451.7993 461.6670 467.7553 479.4482 486.4774 509.8960 515.0490 529.9204 541.2494 549.9659 581.6204 596.2718 599.4214 623.2956 645.3421 660.6953 677.6131 700.8022 709.7235 726.2991 771.1548 795.2727 795.7699 818.4566 840.6523 846.1318 860.6132 864.8066 878.2905 912.0921 914.8018 923.4365 945.0595 950.4693 967.2108 970.9840 990.4632 995.3373 1008.1265 1009.4053 1012.9880 1025.4747 1039.3908 1078.7170 1083.8631 1085.9886 1097.1930 1105.7230 1115.9743 1144.4448 1147.4266 1156.5292 1168.5019 1171.0828 1190.7520 1201.7245 1203.5956 1211.8308 1222.7423 1231.7299 1236.7666 1245.8190 1253.2450 1256.1284 1283.5649 1289.3184 1293.2580 1293.9685 1305.6636 1322.6093 1329.6388 1331.8044 1346.1294 1352.0190 1379.2460 1401.0749 1402.0106 1402.8233 1407.9933 1414.1672 1431.2741 1440.0501 1441.3008 1458.1225 1460.0761 1465.2224 1473.5610 1490.1141 1498.1331 1502.8953 1506.0424 1519.0269 1525.9169 1528.1335 1528.3120 1544.2503 1551.9396 1567.5857 1609.4326 1618.3821 1630.7145 1636.6659 1638.7612 1640.5900 1641.3076 1643.4468 1649.1175 1653.2822 1660.3373 1660.4153 1665.6147 1703.1775 1772.7067 1803.1035 1804.7577 1818.1351 1832.8149 3121.2572 3171.7735 3172.1169 3181.7475 3182.9376 3185.0847 3187.8712 3190.9758 3213.3490 3219.8910 3233.7791 3234.9238 3238.3732 3242.9469 3257.1797 3257.9574 3278.7182 3283.2209 3331.9574 3358.9788 3372.7272 3373.4061 3389.8137 3395.0260 3395.5208 3401.7929 3416.4308 3793.3846 3868.7479 4088.3945 5.4110 5.3433 4.4921 5.1591 3.0451 4.7814 3.9087 4.8245 4.6802 4.8849 4.1669 4.0401 4.0425 4.1445 4.7087 5.4666 1.6734 4.9002 2.1726 3.5971 5.0161 4.1650 2.4631 4.0000 5.2638 3.1767 2.4742 4.0254 3.9610 2.8844 1.1700 1.8443 2.5737 3.2490 3.7222 2.7014 2.1786 2.6512 3.0006 3.0839 2.5275 3.5624 5.3513 3.3872 4.1227 4.2207 3.4829 3.5385 3.4916 5.4888 3.4816 4.8082 5.2701 4.6453 3.5422 3.7485 2.0682 5.0309 3.2043 2.1119 1.6852 5.2546 2.0993 3.3877 1.5333 1.5135 2.7236 1.9476 1.9700 1.6457 2.8811 1.4736 2.1992 2.2821 2.1064 1.7956 1.3265 1.3482 2.3539 1.3446 2.9011 1.8038 1.3865 3.7096 2.9315 3.9240 1.2809 3.4150 2.1821 2.1696 2.6342 2.2625 1.6966 1.9965 1.7434 2.9625 2.3764 2.2888 1.4456 2.8005 1.2671 2.0620 1.3943 2.2930 1.5928 1.4887 1.6846 1.3650 2.0914 1.4087 2.2163 1.2696 1.3575 1.4955 2.4378 2.9522 1.3364 1.2631 1.3750 1.5349 1.4706 1.5104 1.3958 1.6406 1.4346 1.4692 1.6410 1.7052 1.5154 1.6846 3.1205 2.2012 1.3199 1.0889 1.1100 1.3037 1.1070 1.1241 1.0943 1.0480 2.8744 1.1093 1.0729 1.8206 3.3125 4.4668 5.1773 5.9838 5.9280 6.2506 1.0820 1.0744 1.0742 1.0835 1.0711 1.0757 1.0665 1.0624 1.0336 1.0851 1.0934 1.0975 1.0948 1.0922 1.0949 1.0927 1.1079 1.0931 1.1028 1.0912 1.0899 1.0872 1.0909 1.0961 1.0954 1.1006 1.0939 1.0761 1.0775 1.0658 0.0004 0.0005 0.0012 0.0015 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11.4832 11.5454 12.3711 6.2105 6.3682 6.3686 6.4627 6.3932 6.4296 6.3859 6.3739 6.2883 6.6284 6.7366 6.7667 6.7646 6.7677 6.8439 6.8336 7.0170 6.9424 7.2132 7.2539 7.3049 7.2895 7.3854 7.4434 7.4409 7.5041 7.5224 9.1237 9.5018 10.4957 0.1373 0.4553 0.0891 0.0721 0.1349 2.9002 2.2166 0.5454 0.9491 2.4958 1.0994 0.7633 1.7519 0.4906 0.1451 1.1263 0.0507 0.8825 0.9129 1.4539 1.4405 3.9224 0.2937 0.8233 8.4222 2.8509 3.5456 7.2322 3.5485 10.5294 113.9676 62.9084 11.8231 13.4387 4.1914 3.1223 8.7520 20.4844 8.4915 6.0175 1.9143 38.4831 6.1863 54.5553 13.1745 2.6345 23.7754 17.6760 56.9273 148.9617 55.0152 11.4988 55.8247 5.8540 12.2832 8.8026 9.0098 8.0814 12.0147 3.8778 1.3683 21.0958 4.4141 15.5412 37.8185 39.9580 110.4425 6.7861 23.2124 16.0126 21.3177 7.2372 23.7625 65.7733 81.3457 41.6252 1.5666 4.3922 83.2081 1.6698 7.6040 7.3735 0.4684 0.8560 8.9920 61.0047 1.3474 189.6500 10.0535 15.7483 4.0638 34.7740 2.1101 92.8963 106.6218 240.7153 56.6185 18.7228 23.4580 60.7508 3.1882 55.2837 1.6565 102.0434 9.6116 109.6050 3.5339 26.3708 293.9813 52.9333 84.1055 19.3771 4.6490 32.7570 121.5266 160.5405 20.3804 12.0480 42.7351 0.8618 6.2134 25.6603 2.2324 97.6959 0.5979 8.0011 3.8469 9.8731 12.5873 77.5249 4.9773 57.1744 82.6016 1.0943 5.3641 20.1989 2.8372 4.3011 9.7047 5.8986 443.6010 3.9135 11.5841 50.0618 228.3982 12.1299 179.8877 38.7097 24.1988 20.2564 23.6494 15.2874 18.0941 62.8000 20.4822 13.0726 17.7043 60.8333 40.6447 35.0674 80.9056 76.2721 29.7007 50.6740 81.4819 35.2036 47.6171 19.1523 44.0700 18.9929 10.9638 10.6141 11.4834 3.0633 5.3788 23.1993 0.6910 49.2036 39.2622 161.1420 0.8215 0.6713 1.7354 0.9911 0.3470 2.3257 3.1081 1.1953 0.7795 0.7773 1.9889 1.0129 1.5484 1.3369 1.2651 2.0847 0.6252 1.5585 0.2814 0.8068 2.4627 3.8768 0.5408 1.0048 1.9370 0.5193 1.2763 1.3246 3.2251 5.3408 2.3989 4.3830 1.5448 2.5040 3.5506 1.8113 1.3541 1.5354 1.6405 1.5211 0.5639 3.3947 1.1717 2.4586 2.3085 6.2641 1.8793 2.9119 3.0135 0.4962 2.1389 2.0953 4.7523 4.0061 5.3556 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14.00307 31.97207 15.99491 15.99491 14.00307 12.00000 12.00000 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 6115.1366 39070.2604 39208.2410 0.99997 -0.00195 0.00734 0.00159 0.99878 0.04933 -0.00742 -0.04932 0.99876 1 0.01416 0.00222 0.00221 0.29513 0.04619 0.04603 16.81 17.70 30.73 32.07 52.55 77.64 96.91 121.71 139.82 150.84 180.22 186.32 226.01 248.73 260.01 295.32 328.84 349.93 352.41 372.38 392.21 429.69 436.46 450.57 476.10 494.04 510.50 545.83 565.52 595.86 605.97 617.87 625.89 650.04 664.24 673.00 689.82 699.93 733.63 741.04 762.44 778.74 791.28 836.82 857.90 862.43 896.78 928.50 950.59 974.93 1008.30 1021.13 1044.98 1109.52 1144.22 1144.94 1177.58 1209.51 1217.39 1238.23 1244.26 1263.66 1312.30 1316.20 1328.62 1359.73 1367.51 1391.60 1397.03 1425.06 1432.07 1450.47 1452.31 1457.46 1475.43 1495.45 1552.03 1559.44 1562.50 1578.62 1590.89 1605.64 1646.60 1650.89 1663.99 1681.21 1684.93 1713.23 1729.01 1731.71 1743.55 1759.25 1772.18 1779.43 1792.46 1803.14 1807.29 1846.76 1855.04 1860.71 1861.73 1878.56 1902.94 1913.05 1916.17 1936.78 1945.25 1984.43 2015.83 2017.18 2018.35 2025.79 2034.67 2059.28 2071.91 2073.71 2097.91 2100.72 2108.13 2120.13 2143.94 2155.48 2162.33 2166.86 2185.54 2195.45 2198.64 2198.90 2221.83 2232.89 2255.41 2315.61 2328.49 2346.23 2354.80 2357.81 2360.44 2361.48 2364.55 2372.71 2378.70 2388.86 2388.97 2396.45 2450.49 2550.53 2594.26 2596.64 2615.89 2637.01 4490.79 4563.47 4563.97 4577.83 4579.54 4582.63 4586.64 4591.10 4623.29 4632.71 4652.69 4654.33 4659.30 4665.88 4686.36 4687.47 4717.34 4723.82 4793.94 4832.82 4852.60 4853.58 4877.19 4884.69 4885.40 4894.42 4915.48 5457.83 5566.27 5882.29 0.558192 0.585199 0.586144 0.497061 -1769.383704 -1769.356697 -1769.355753 -1769.444835 2.987825D-04 MUNgauss RevisionA2.0 retrievium 14-Jan-2021 DUDE COc1cc(ccc1O)[C@@H]2[C@H]3CC=C[C@@H]3c4cc(ccc4N2)S(=O)(=O)NC5CCCCC5 C14458853 RHF 6-31G(d) (6D,10F) C1 454.192629 |X|Y|Z| 42.716493 43.602553 140.386312 63.945614 27 6 7 16 24 2 1 |36.858105| |13.600778|73.516695| |7.983034|24.941241|36.858105| |6.662284|13.903868|13.803272|36.858105| |4.479120|9.176679|7.898385|13.655629|36.858105| |3.788189|8.222606|6.889489|7.966860|13.763227|36.858105| |3.987643|9.440478|7.952351|6.891330|7.905364|13.724799|36.858105| |5.264233|14.637817|13.650199|7.924184|6.826298|7.942167|13.829617|36.858105| |4.713700|12.815023|7.993706|5.237450|4.603677|5.251918|8.078264|14.138892|73.516695| |3.654583|6.834761|5.017846|7.560991|12.530984|7.506445|4.994137|4.419415|5.985776|36.858105| |3.930552|6.936488|4.845086|7.456371|8.983033|5.616663|4.208243|4.012986|5.579825|17.513196|0.500000| |3.126638|5.798956|4.054558|5.410329|7.483522|5.903036|4.243439|3.734428|5.286972|12.506606|0.248032|36.858105| |2.889114|5.530790|3.899135|4.879811|6.965711|6.528220|4.594100|3.818478|5.433343|8.963163|0.175356|17.535313|0.500000| |3.252917|5.874604|3.937732|5.036709|5.817615|4.702810|3.766201|3.529614|5.127889|7.173706|0.185151|12.424834|0.249391|36.858105| |2.600715|4.654439|3.001624|3.609076|4.103169|3.603621|2.994793|2.788306|4.219995|5.056321|0.133385|8.112547|0.194840|12.550966|36.858105| |2.372961|4.254364|2.750376|3.317830|3.891108|3.459720|2.826390|2.585087|3.922814|5.119136|0.133668|8.082086|0.195410|8.078060|14.415014|36.858105| |2.601552|4.694033|3.118044|3.934725|4.911454|4.174935|3.229687|2.901916|4.293833|7.610242|0.190007|12.413917|0.249744|7.879487|8.182468|12.588706|36.858105| |2.672193|4.694729|3.061675|3.909633|4.622222|3.772950|2.991217|2.771653|4.124110|7.205463|0.212825|8.864985|0.175695|6.802445|6.742309|8.989980|17.419505|0.500000| |2.334196|4.283502|2.846556|3.477038|4.434255|4.063904|3.139709|2.742308|4.101298|6.404456|0.152249|7.713739|0.205216|5.088098|5.198227|7.186343|12.648755|0.251134|36.858105| |1.999152|3.660923|2.376767|2.788593|3.395311|3.254443|2.643858|2.328443|3.578232|4.390239|0.109527|5.148657|0.145996|3.955667|4.353829|6.013849|7.435660|0.169554|13.888864|36.858105| |1.839119|3.390238|2.186356|2.507409|3.017998|2.990691|2.483526|2.177646|3.391130|3.690937|0.092598|3.977508|0.115421|3.147629|3.326820|4.185067|4.976119|0.122673|7.918254|13.655153|36.858105| |1.912025|3.558327|2.313066|2.644918|3.221601|3.250658|2.684970|2.325689|3.608236|3.862783|0.095695|3.849929|0.112097|2.983245|2.987307|3.575763|4.439962|0.112444|6.830556|7.920079|13.781199|36.858105| |2.201564|4.128868|2.745267|3.217485|4.081574|4.075203|3.220846|2.745302|4.156470|5.048255|0.120651|4.642201|0.133463|3.389817|3.220488|3.778065|5.070874|0.128863|7.862062|6.878413|7.959032|13.779399|36.858105| |2.495367|4.653238|3.157546|3.893211|5.207438|4.837624|3.599476|3.070716|4.519950|7.523607|0.168241|6.906198|0.188688|4.468543|4.117200|4.950769|7.740290|0.186863|13.473518|7.921277|6.851639|7.902107|13.669668|36.858105| |3.019797|5.676813|4.004602|5.284846|7.741745|6.389456|4.421647|3.774729|5.328630|13.003584|0.253601|7.912732|0.197915|4.944681|4.100421|4.533156|6.932251|0.181458|7.872855|5.202070|4.584741|5.197137|7.933999|13.856698|53.358707| |1.575946|2.891758|1.827423|2.043444|2.373947|2.378090|2.054087|1.830805|2.915549|2.769328|0.071349|2.995242|0.086890|2.544366|2.757256|3.352988|3.601013|0.091736|4.745886|6.977097|10.848362|6.981784|4.745196|4.199678|4.386710|388.023441| |1.491852|2.750348|1.730458|1.908782|2.200415|2.238796|1.964335|1.750444|2.813594|2.496877|0.064451|2.603890|0.075788|2.223072|2.339898|2.741648|2.983507|0.077323|3.827122|4.936211|7.403350|6.613755|4.471079|3.700387|3.999555|94.387562|73.516695| |1.529530|2.813087|1.773248|1.967864|2.275811|2.298673|2.002867|1.785544|2.857860|2.616964|0.067092|2.935464|0.086788|2.565532|2.864325|3.462606|3.483810|0.086639|4.314736|6.152124|7.273989|5.070285|3.883677|3.672554|3.974020|94.460465|13.644746|73.516695| |1.515866|2.739152|1.709333|1.917893|2.180018|2.126954|1.851433|1.684460|2.691933|2.567036|0.068306|2.761064|0.077095|2.410642|2.648824|3.238533|3.412105|0.091218|4.226836|5.868526|7.109362|5.140085|3.922471|3.663541|3.975377|82.427036|13.344143|13.931168|53.358707| |1.470558|2.641885|1.636437|1.830419|2.053913|1.990828|1.747240|1.604862|2.575669|2.400329|0.064981|2.489050|0.068414|2.180810|2.334923|2.784073|3.007795|0.083346|3.648962|4.578808|5.517144|4.670234|3.689651|3.361277|3.752430|49.966209|11.274107|8.921015|17.688623|36.858105| |1.321752|2.379059|1.461310|1.609653|1.785492|1.752284|1.564946|1.443758|2.344486|2.031298|0.054976|2.092711|0.058096|1.866942|1.986054|2.302297|2.438039|0.067217|2.865828|3.449948|4.102353|3.698444|3.000466|2.712411|3.128793|38.704751|10.242988|7.625541|10.386940|12.433248|36.858105| |1.272672|2.279113|1.389253|1.523557|1.669391|1.630488|1.468391|1.367250|2.230898|1.882392|0.051567|1.900633|0.052267|1.706867|1.788843|2.040203|2.178560|0.061145|2.508413|2.877183|3.318700|3.169790|2.693052|2.439168|2.890963|27.894220|7.519586|5.719730|6.744936|7.525463|12.436088|36.858105| |1.279283|2.269058|1.375194|1.514121|1.642930|1.582288|1.425116|1.339535|2.183919|1.863993|0.051846|1.881554|0.050987|1.709011|1.797231|2.047453|2.174101|0.062235|2.441644|2.747959|3.019554|2.852085|2.510977|2.346991|2.823442|24.040716|6.047550|5.093623|6.009799|6.427246|7.519863|12.444740|36.858105| |1.412699|2.493588|1.518110|1.693460|1.844831|1.751382|1.558711|1.465203|2.367108|2.136906|0.059981|2.154190|0.057547|1.940029|2.043648|2.364659|2.549785|0.074378|2.874455|3.226847|3.470277|3.234005|2.875571|2.730931|3.256593|26.157968|6.243855|5.432986|6.809110|7.524188|6.445828|7.543159|12.442666|36.858105| |1.481292|2.627161|1.614212|1.814937|2.006247|1.905826|1.676293|1.561113|2.504910|2.364045|0.065584|2.448268|0.065655|2.186492|2.355041|2.804681|2.998715|0.086252|3.455813|4.111136|4.402856|3.804240|3.261695|3.134512|3.610912|34.437920|7.561703|6.983675|10.632181|12.446813|7.534588|6.447943|7.518491|12.437243|36.858105| |17.648722|16.980131|5.861736|4.871076|3.595923|3.183758|3.417200|4.425140|7.651069|3.027899|0.089486|2.665029|0.069342|2.787061|2.299541|2.106846|2.272663|0.064739|2.061743|1.795966|1.665859|1.727980|1.962952|2.188048|3.516347|10.288904|2.447270|2.503538|1.900598|1.359048|1.230989|1.189971|1.197241|1.314005|1.370335|0.500000| |17.567343|16.454713|7.020785|6.668695|4.541910|3.734561|3.791801|4.763588|7.413982|3.819352|0.117917|3.148195|0.079644|3.175374|2.557690|2.381205|2.665061|0.077408|2.411735|2.055257|1.897848|1.988486|2.309030|2.613977|4.365931|11.498163|2.727326|2.761765|2.127671|1.528775|1.369716|1.325655|1.336551|1.483029|1.546114|0.299921|0.500000| |17.567154|16.456196|7.035444|6.673648|4.547339|3.738737|3.796410|4.771498|7.422293|3.831233|0.116273|3.382507|0.085364|3.689608|2.897676|2.583721|2.790217|0.079892|2.434691|2.076248|1.882586|1.930689|2.210905|2.546798|4.165469|11.466393|2.687468|2.799499|2.119843|1.501554|1.343912|1.288209|1.299493|1.440327|1.520046|0.299879|0.298746|0.500000| |7.404325|12.475095|8.939383|17.744102|8.919127|5.665749|4.963637|5.639058|7.509584|7.063922|0.231796|5.181592|0.122648|5.076774|3.657249|3.353222|3.958899|0.114587|3.395274|2.728984|2.431770|2.533580|3.044602|3.704182|6.713030|14.174724|3.292265|3.402460|2.593797|1.830863|1.604617|1.526684|1.533164|1.726795|1.842915|0.145094|0.222803|0.222050|0.500000| |3.129056|6.521773|4.960888|5.650960|8.917032|17.720337|8.944754|5.661134|7.550414|6.934410|0.140452|5.993957|0.203809|4.500026|3.638579|3.617694|4.409893|0.106617|4.573447|3.675129|3.417107|3.769120|4.787654|5.592682|9.313286|18.944322|4.459198|4.575989|3.157599|2.145926|1.882474|1.733015|1.663796|1.837523|2.019511|0.075014|0.086473|0.086545|0.124286|0.500000| |3.339638|7.650737|5.665673|4.962995|5.623406|8.860868|17.734325|9.013839|13.167904|4.065571|0.096409|3.638004|0.112274|3.257336|2.703656|2.578210|2.888151|0.073815|2.878883|2.494073|2.387304|2.589562|3.039685|3.272312|5.188499|14.268929|3.449800|3.498844|2.437376|1.687223|1.525763|1.429785|1.377807|1.493274|1.604158|0.082446|0.088299|0.088387|0.107730|0.214494|0.500000| |5.503493|15.904465|7.972970|5.065076|4.193249|4.447104|6.063488|10.102886|35.678688|3.155455|0.084036|2.790323|0.078057|2.763172|2.279631|2.109111|2.293441|0.062003|2.168055|1.896746|1.792475|1.896115|2.171536|2.366914|3.791709|11.022302|2.655605|2.699512|1.967585|1.389249|1.266233|1.210188|1.191027|1.291658|1.360895|0.144263|0.129774|0.129934|0.118506|0.101232|0.151404|0.500000| |3.405038|6.327742|4.272522|5.204206|5.825040|4.988146|4.144169|3.903877|5.664471|6.059835|0.151577|8.681221|0.222820|17.569909|8.703421|5.928546|5.676402|0.137535|4.205844|3.415391|2.823542|2.716437|3.068653|3.875955|5.884933|16.586382|3.680798|4.225539|2.971732|1.980495|1.722856|1.579831|1.572263|1.760820|1.966578|0.081217|0.089350|0.108020|0.138660|0.129365|0.099392|0.084307|0.500000| |3.601199|6.216240|4.047552|5.293843|5.527615|4.242842|3.510568|3.448917|5.041495|6.717220|0.201947|8.693068|0.174459|17.470188|8.829811|6.445453|6.570302|0.184528|4.420989|3.497085|2.846285|2.729865|3.107471|4.018332|6.249333|16.584523|3.660030|4.124799|3.076264|2.084282|1.789431|1.656571|1.677052|1.912450|2.126661|0.084781|0.098414|0.117251|0.161798|0.108851|0.083593|0.077060|0.302297|0.500000| |2.427217|4.320101|2.719490|3.155085|3.450696|3.114466|2.690352|2.545305|3.938122|3.988721|0.107224|5.648584|0.145775|8.333451|17.719207|8.944859|5.655133|0.139093|4.088332|3.647072|2.895742|2.600626|2.745199|3.354975|4.540548|17.795361|3.806724|4.706912|3.304015|2.144111|1.852739|1.672992|1.685571|1.896241|2.171867|0.060529|0.065564|0.075483|0.089032|0.086818|0.068460|0.059499|0.201624|0.191446|0.500000| |2.097996|3.748768|2.382065|2.798976|3.213351|2.938591|2.463924|2.264118|3.500893|4.049780|0.107578|5.628745|0.146134|5.610767|8.942747|17.729630|8.290334|0.190885|6.240586|6.129789|4.266933|3.484045|3.498783|4.318340|5.185286|25.572847|5.086131|6.802969|4.861117|2.985773|2.456248|2.144994|2.160115|2.494843|3.029380|0.052449|0.058583|0.062947|0.078668|0.086075|0.063534|0.052434|0.126102|0.134332|0.206799|0.500000| |1.891821|3.437761|2.202530|2.557413|3.030924|2.894941|2.405399|2.150005|3.339085|3.820669|0.097889|4.660877|0.130912|3.871243|4.586279|6.617465|6.797066|0.157932|8.976409|17.739926|8.917114|5.649182|4.956734|5.631661|5.714828|47.520021|8.067756|11.977886|8.399300|4.522810|3.438799|2.825849|2.737341|3.199247|4.189862|0.047507|0.053660|0.055031|0.070219|0.089022|0.063275|0.049457|0.092810|0.095160|0.109267|0.214093|0.500000| |1.767837|3.294867|2.117565|2.371701|2.823532|2.895544|2.464860|2.149313|3.387042|3.244722|0.081736|3.187918|0.092927|2.563763|2.562867|2.985827|3.552049|0.091934|4.933211|5.641853|8.946732|17.758446|8.922182|5.630074|5.719760|47.339362|13.778746|8.444353|6.629383|4.664257|3.900700|3.368955|2.921146|3.204717|3.653927|0.044761|0.051062|0.049233|0.063058|0.092315|0.067062|0.049493|0.065972|0.065911|0.063232|0.081749|0.124364|0.500000| |2.232551|4.224435|2.808842|3.235858|4.049972|4.145965|3.343317|2.842226|4.320965|4.677564|0.113359|4.044981|0.115975|3.052350|2.831703|3.195980|4.139087|0.108493|5.603532|4.954039|5.658129|8.936851|17.706842|8.895221|9.848400|27.874391|6.977890|5.825488|4.525698|3.243970|2.740340|2.530399|2.353723|2.650691|2.896859|0.055415|0.065495|0.061306|0.084130|0.133883|0.088301|0.062482|0.078438|0.079076|0.068107|0.082103|0.107575|0.215345|0.500000| |3.065280|5.857731|4.149705|5.287520|7.450757|6.623756|4.706171|3.987878|5.626986|9.087068|0.201552|5.806745|0.154032|4.076633|3.412802|3.670472|5.090144|0.137087|5.783606|4.307352|4.074557|4.872149|7.518522|9.431121|26.070522|21.137554|4.988816|4.753739|3.655780|2.588137|2.198525|2.059643|1.999451|2.279147|2.473292|0.073051|0.091581|0.083950|0.133407|0.193508|0.112980|0.081201|0.103599|0.107631|0.079748|0.088380|0.098496|0.114892|0.226636|0.500000| |1.435680|2.590010|1.606489|1.789695|2.015402|1.971368|1.733132|1.584920|2.548630|2.343627|0.062571|2.552484|0.071502|2.283955|2.548439|3.080460|3.115362|0.083082|3.683163|4.935975|5.502336|4.146600|3.312412|3.170507|3.537600|61.888711|10.944916|14.026728|25.893910|9.064267|7.038379|4.599991|4.182093|4.514523|6.742810|0.036892|0.040923|0.041095|0.049461|0.059406|0.046724|0.038098|0.057854|0.059506|0.066005|0.096371|0.153501|0.110338|0.079501|0.066526|0.500000| |1.543684|2.782931|1.733253|1.945768|2.200132|2.135364|1.862422|1.701989|2.719735|2.581364|0.069590|2.617151|0.071926|2.245452|2.354731|2.799430|3.136974|0.087113|3.934848|4.830486|6.219931|5.689851|4.356306|3.783826|4.158724|49.487313|12.197510|8.331977|12.598734|17.566087|8.889794|6.830372|5.691672|6.837487|8.920161|0.039498|0.044807|0.043549|0.053872|0.064231|0.049889|0.040645|0.056613|0.059630|0.059386|0.081332|0.123928|0.162115|0.106465|0.080447|0.180354|0.500000| |1.307421|2.369884|1.459875|1.599488|1.783267|1.772612|1.587412|1.454958|2.367959|2.009147|0.053784|2.066986|0.058143|1.834113|1.939805|2.235050|2.372625|0.064450|2.821614|3.405757|4.206770|3.872948|3.068709|2.710182|3.113929|41.959220|12.778455|8.142714|9.453394|8.855225|17.591536|8.789946|5.481096|4.838393|5.502991|0.033839|0.037536|0.036812|0.043939|0.053317|0.043291|0.035391|0.047373|0.048491|0.050264|0.065746|0.092894|0.118137|0.078418|0.061220|0.177524|0.215521|0.500000| |1.265963|2.273654|1.390892|1.527323|1.684760|1.652283|1.482712|1.373216|2.237473|1.909085|0.051788|1.992247|0.055330|1.804961|1.943856|2.245371|2.320588|0.063857|2.665376|3.206653|3.656705|3.219343|2.669300|2.475912|2.886591|34.869546|8.682365|7.494647|9.555589|8.881605|17.472720|8.847939|6.791264|5.680607|6.815906|0.032838|0.036294|0.035887|0.042378|0.049124|0.040191|0.033632|0.046374|0.048064|0.050891|0.067455|0.091805|0.092226|0.067637|0.056049|0.210698|0.174439|0.302514|0.500000| |1.311709|2.354401|1.438126|1.577262|1.731991|1.694969|1.525199|1.417402|2.310210|1.948981|0.053324|1.938244|0.053312|1.722986|1.782258|2.026526|2.203246|0.061939|2.565864|2.899310|3.407781|3.396493|2.890209|2.559128|3.036272|27.449164|7.695298|5.497519|6.215380|6.777149|8.852345|17.497369|8.849957|6.786221|5.661348|0.034028|0.038100|0.036706|0.043803|0.050103|0.041262|0.034767|0.044341|0.046496|0.046018|0.058399|0.077119|0.102744|0.076554|0.060726|0.113124|0.201150|0.214278|0.173682|0.500000| |1.189108|2.132126|1.293997|1.407911|1.534434|1.507844|1.369889|1.278563|2.099471|1.709095|0.046754|1.727190|0.047738|1.565154|1.638538|1.847837|1.952256|0.054524|2.219565|2.520875|2.878774|2.770478|2.382574|2.166358|2.599705|24.337898|6.684765|5.187542|5.587026|5.491898|8.837216|17.542029|8.808118|5.491598|4.836534|0.031014|0.034307|0.033386|0.039109|0.044442|0.037233|0.031660|0.040544|0.042199|0.042883|0.053914|0.069223|0.082374|0.062883|0.051724|0.110383|0.140105|0.211686|0.214708|0.303758|0.500000| |1.239456|2.192998|1.322020|1.448766|1.559589|1.501336|1.361122|1.286392|2.105823|1.753728|0.049035|1.750754|0.047339|1.597526|1.663514|1.872382|1.994079|0.057383|2.214691|2.435424|2.654153|2.570641|2.312739|2.162962|2.646667|20.522388|5.243363|4.411877|4.849203|4.826238|5.482817|8.811708|17.535006|8.817243|5.483960|0.032330|0.036060|0.034855|0.040830|0.043603|0.036570|0.031984|0.040999|0.043812|0.043443|0.054338|0.066848|0.073540|0.061219|0.052549|0.093941|0.127364|0.122991|0.139366|0.214761|0.211316|0.500000| |1.226060|2.171636|1.312073|1.440506|1.557358|1.500842|1.356644|1.278215|2.089845|1.760917|0.048988|1.798503|0.048807|1.653665|1.756827|1.995457|2.078067|0.059281|2.298481|2.597210|2.799457|2.592303|2.292147|2.175806|2.629584|22.720326|5.597895|4.988117|5.742765|5.645068|6.770990|8.852175|17.495494|8.851795|6.766819|0.031948|0.035432|0.034714|0.040555|0.043763|0.036479|0.031700|0.042347|0.045060|0.046161|0.059093|0.073434|0.073032|0.059436|0.051469|0.117104|0.131609|0.139153|0.199931|0.173734|0.214646|0.303340|0.500000| |1.475657|2.606628|1.590648|1.779202|1.941712|1.839395|1.632514|1.533358|2.470531|2.253057|0.063393|2.225453|0.059264|1.978077|2.048776|2.362634|2.613683|0.076753|2.985580|3.278411|3.580043|3.478850|3.131374|2.922514|3.494330|25.707386|6.292117|5.228345|6.265611|6.773150|5.657581|6.788212|8.854117|17.495462|8.853677|0.038042|0.043295|0.041581|0.050386|0.053572|0.043350|0.037424|0.049845|0.054318|0.052365|0.068005|0.087440|0.096500|0.081148|0.068603|0.111353|0.201295|0.126704|0.131378|0.199689|0.139352|0.215039|0.173779|0.500000| |1.401318|2.454133|1.484339|1.655801|1.784333|1.679558|1.500668|1.422689|2.302363|2.063982|0.058672|2.081469|0.055073|1.902751|2.007738|2.304286|2.457776|0.072782|2.687343|2.946245|3.050675|2.844162|2.605407|2.538241|3.088974|22.428408|5.275485|4.834343|5.649972|5.491556|4.836075|5.491087|8.805283|17.538201|8.835047|0.036287|0.040914|0.039803|0.047289|0.048500|0.039793|0.035058|0.047894|0.052644|0.052052|0.067580|0.082214|0.077196|0.067064|0.059927|0.107814|0.140241|0.106611|0.127147|0.139290|0.123112|0.211416|0.214640|0.303630|0.500000| |1.410945|2.497916|1.527314|1.708112|1.875782|1.785633|1.581153|1.478033|2.382545|2.191550|0.060825|2.307793|0.062081|2.104191|2.304669|2.730108|2.814758|0.080408|3.145480|3.745375|3.876598|3.293031|2.857622|2.800868|3.271327|31.561892|6.815787|6.866172|9.756410|8.873860|6.793227|5.662308|6.766300|8.839657|17.487679|0.036388|0.040682|0.040386|0.048231|0.052402|0.042130|0.036022|0.052775|0.056828|0.059882|0.083618|0.110906|0.087763|0.070790|0.062068|0.200186|0.174660|0.139821|0.201186|0.131130|0.126744|0.139060|0.198932|0.173654|0.214827|0.500000| |1.606551|2.837710|1.751445|1.994733|2.214545|2.072497|1.802327|1.679147|2.671862|2.669929|0.074722|2.774702|0.073157|2.456823|2.655217|3.226732|3.511789|0.103340|4.043002|4.762352|4.813951|4.091419|3.600722|3.575039|4.083368|34.027237|7.151672|6.957793|9.776480|8.870933|5.503563|4.840359|5.477698|8.783534|17.558821|0.041041|0.046726|0.045995|0.056635|0.060817|0.047491|0.040345|0.060444|0.066630|0.067136|0.096748|0.134456|0.104508|0.087151|0.076388|0.167362|0.216842|0.123793|0.140079|0.126851|0.106624|0.122982|0.138959|0.214412|0.211298|0.303127|0.500000| 1767.947718 -10890.732903 4196.417678 -212.344175 -5138.711681 3368.769727 -1769.941954 2.001128 40B3B00000000024 44AE049F2C61BB73 442FC12FC965453C 4293CC273F500004 38121A5F91BB2C4F 44555B2A3B8EF071