Version2.1 2021-01-24T10:28:53Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 19-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1ccc(cc1NC(=O)COC(=O)c2cc(ccc2O)NS(=O)(=O)c3cccs3)Cl C03255133 RHF 6-31G(d) (6D,7F) COc1ccc(cc1NC(=O)COC(=O)c2cc(ccc2O)NS(=O)(=O)c3cccs3)Cl C01[X(C20H17Cl1N2O7S2)] 141 C1 526 COc1ccc(cc1NC(=O)COC(=O)c1cc(ccc1O)NS(=O)(=O)c1cccs1)Cl COc1ccc(cc1NC(=O)COC(=O)c1cc(ccc1O)NS(=O)(=O)c1cccs1)Cl COc1ccc(Cl)cc1NC(=O)COC(=O)c2cc(N[S](=O)(=O)c3sccc3)ccc2O InChIKey=AWXMUXHOZCRKAN-UHFFFAOYSA-N InChI=1S/C20H17ClN2O7S2/c1-29-17-7-4-12(21)9-15(17)22-18(25)11-30-20(26)14-10-13(5-6-16(14)24)23-32(27,28)19-3-2-8-31-19/h2-10,23-24H,11H2,1H3,(H,22,25) InChI=1/C20H17ClN2O7S2/c1-29-17-7-4-12(21)9-15(17)22-18(25)11-30-20(26)14-10-13(5-6-16(14)24)23-32(27,28)19-3-2-8-31-19/h2-10,23-24H,11H2,1H3,(H,22,25)/f/h22H COc1ccc(cc1NC(=O)COC(=O)c2cc(ccc2O)NS(=O)(=O)c3cccs3)Cl C01[X(C20H17Cl1N2O7S2)] 141 C01 526 COc1ccc(cc1NC(=O)COC(=O)c1cc(ccc1O)NS(=O)(=O)c1cccs1)Cl CO[C]1[CH][CH][C]([CH][C]1NC(=O)COC(=O)[C]1[CH][C]([CH][CH][C]1O)NS(=O)(=O)C1=[CH][CH]=[CH]S1)Cl CO[C]1[CH][CH][C](Cl)[CH][C]1NC(=O)COC(=O)[C]2[CH][C]([CH][CH][C]2O)N[S](=O)(=O)c3sccc3 InChIKey=AWXMUXHOZCRKAN-UHFFFAOYSA-N InChI=1S/C20H17ClN2O7S2/c1-29-17-7-4-12(21)9-15(17)22-18(25)11-30-20(26)14-10-13(5-6-16(14)24)23-32(27,28)19-3-2-8-31-19/h2-10,23-24H,11H2,1H3,(H,22,25) InChI=1/C20H17ClN2O7S2/c1-29-17-7-4-12(21)9-15(17)22-18(25)11-30-20(26)14-10-13(5-6-16(14)24)23-32(27,28)19-3-2-8-31-19/h2-10,23-24H,11H2,1H3,(H,22,25)/f/h22H 3653.8198234639 -2654.6344311 1-A 22740.5951 128 398 526 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -104.82791 -92.21467 -91.99015 -20.63857 -20.62253 -20.59907 -20.57802 -20.55865 -20.55478 -20.55256 -15.62391 -15.60818 -11.41250 -11.38265 -11.33345 -11.32711 -11.32416 -11.30898 -11.30725 -11.30528 -11.28785 -11.28431 -11.28297 -11.26667 -11.26645 -11.26184 -11.25843 -11.25824 -11.25647 -11.25278 -11.25161 -11.23977 -10.56121 -9.18516 -8.99990 -8.03062 -8.02728 -8.02723 -6.87172 -6.87129 -6.87034 -6.68238 -6.68142 -6.67967 -1.51080 -1.48159 -1.45045 -1.43352 -1.42619 -1.39273 -1.35657 -1.28311 -1.26085 -1.19802 -1.19559 -1.16537 -1.12509 -1.08111 -1.05484 -1.03636 -1.02778 -1.02224 -1.01464 -1.00503 -0.96127 -0.91380 -0.89710 -0.88805 -0.84935 -0.83696 -0.82411 -0.80752 -0.79096 -0.77761 -0.77414 -0.75780 -0.73952 -0.73116 -0.72932 -0.72541 -0.71787 -0.70077 -0.69830 -0.69169 -0.69058 -0.68229 -0.67015 -0.64453 -0.63985 -0.63721 -0.63500 -0.63423 -0.62836 -0.62082 -0.61541 -0.60675 -0.59329 -0.58173 -0.57994 -0.57857 -0.56727 -0.56330 -0.55979 -0.55348 -0.54558 -0.53655 -0.53245 -0.52425 -0.52066 -0.51947 -0.50327 -0.49831 -0.49314 -0.49275 -0.48127 -0.47781 -0.47267 -0.46451 -0.45650 -0.45010 -0.44747 -0.44472 -0.36709 -0.36020 -0.35076 -0.34836 -0.32475 -0.31504 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.08207 0.09602 0.11349 0.13295 0.13559 0.17290 0.19017 0.19294 0.20767 0.21341 0.22233 0.22703 0.22885 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384.5075 403.1154 409.0415 424.1072 426.1359 450.0689 477.6614 483.3272 494.9952 505.3948 523.9333 571.4849 588.5179 590.6251 595.9781 601.6258 628.7160 645.5485 655.4363 657.3055 679.6129 692.8894 696.6869 704.5411 726.5745 756.2397 783.1162 799.4605 801.1736 811.3156 827.3605 860.2731 873.5496 881.0619 922.8088 923.5801 929.7446 950.6702 979.4012 987.6704 1007.9235 1038.9454 1049.0629 1059.8018 1064.5932 1074.3561 1076.9033 1118.3498 1120.6274 1124.2741 1154.4045 1156.3194 1164.1584 1203.3017 1219.2719 1226.5517 1235.2612 1243.3645 1265.6368 1276.2187 1293.2627 1293.6574 1315.8074 1327.8379 1354.6696 1360.0784 1378.6293 1381.1034 1403.6197 1425.1929 1436.5948 1451.2787 1472.3892 1474.4852 1510.8565 1525.8783 1548.8561 1568.6494 1585.1006 1592.2009 1618.4998 1626.5766 1647.8248 1649.4766 1658.3341 1664.6745 1668.7658 1733.3645 1745.9772 1778.4567 1797.9741 1810.9143 1824.8267 1936.0978 1993.0853 3219.1664 3252.9146 3287.9940 3301.5857 3336.1500 3399.8207 3400.3175 3406.6919 3408.8502 3416.2104 3418.8052 3433.4208 3445.4257 3472.9471 3822.3244 3869.1894 3959.0604 8.3031 7.0936 9.6513 7.2895 9.7389 6.2397 6.4498 6.4064 3.7667 8.2092 8.0990 7.2295 3.5466 5.7097 6.1929 7.6671 7.2646 6.6268 6.1716 5.6650 5.1439 2.9126 1.8594 2.8117 9.0525 8.5401 10.5883 5.9974 6.0118 9.3724 7.9235 5.3053 7.2253 7.9616 3.5977 7.1656 1.6607 3.8959 3.0435 6.7438 5.2630 3.9187 3.3484 2.3208 3.4861 3.9692 2.2244 8.9555 6.3230 2.7457 3.2171 1.3003 7.0067 10.1379 7.2322 5.3814 5.7063 4.7158 6.7635 1.1787 5.4450 4.7679 6.2332 1.4215 4.9093 4.6741 1.9677 4.0138 6.1779 1.3091 1.3732 4.4706 1.3462 1.3890 4.4679 1.4772 1.3515 1.8757 2.1244 4.8900 4.9587 5.8195 2.9926 1.2404 3.4142 2.2239 1.6039 10.4880 2.5083 3.2730 1.2634 2.8445 1.7554 1.7730 1.8307 1.8909 1.7697 1.0929 1.4014 3.1355 3.2278 5.8766 2.8888 2.0710 2.1132 2.0489 2.4478 2.1723 5.9038 2.2309 1.3196 1.1143 1.0474 1.1506 2.9996 1.7592 2.4049 5.1897 4.5227 5.5989 4.4763 5.8556 10.9063 9.6198 1.0330 1.0585 1.1083 1.1081 1.1036 1.0904 1.0911 1.0936 1.0909 1.0955 1.0967 1.0961 1.1004 1.0934 1.0773 1.0779 1.0662 0.0001 0.0002 0.0016 0.0020 0.0040 0.0058 0.0080 0.0133 0.0091 0.0243 0.0340 0.0451 0.0298 0.0516 0.0761 0.0983 0.1245 0.1248 0.1555 0.1601 0.1698 0.1068 0.0838 0.1273 0.4968 0.5069 0.7267 0.4325 0.4642 0.8164 0.7586 0.5230 0.7657 0.8518 0.4294 0.9633 0.2286 0.5624 0.4580 1.0907 1.0127 0.7997 0.6882 0.4857 0.7434 0.9244 0.5462 2.2667 1.6096 0.7472 0.9100 0.3718 2.0492 3.1532 2.4369 1.9445 2.1488 1.7834 2.6230 0.4754 2.3742 2.1437 2.8509 0.7132 2.4673 2.3805 1.0478 2.2685 3.5507 0.7836 0.8733 2.8988 0.8909 0.9275 3.0385 1.0094 0.9959 1.3878 1.5821 3.8395 3.9064 4.6469 2.5530 1.0864 3.0263 1.9994 1.4610 9.8983 2.4070 3.2253 1.2457 2.9017 1.8236 1.9170 1.9952 2.1175 1.9888 1.2686 1.6772 3.8126 4.0055 7.5063 3.7005 2.7853 2.8989 2.8960 3.5488 3.2158 8.8181 3.4431 2.0571 1.7826 1.6790 1.8643 4.8975 2.8864 4.2573 9.3211 8.4282 10.6640 8.6490 11.4886 24.0869 22.5149 6.3074 6.5993 7.0593 7.1167 7.2367 7.4261 7.4328 7.4780 7.4691 7.5330 7.5527 7.6126 7.6961 7.7700 9.2735 9.5074 9.8467 1.9104 0.2472 0.3960 0.6664 0.7289 0.5462 1.8029 1.7462 2.7664 0.9764 2.1880 3.2678 3.3407 6.2513 3.6269 0.7119 1.4928 0.4730 4.7234 3.2717 2.3339 0.3031 2.7346 1.6206 3.4787 17.1090 5.0321 0.3424 2.8147 2.2632 1.7818 0.7615 0.7136 6.1948 16.3681 25.9074 67.6975 1.4298 7.2044 22.5976 31.9046 31.5784 32.3295 17.1361 38.9755 33.7798 29.4741 81.3876 40.3117 7.8073 185.7703 40.9832 27.6778 83.7384 93.8999 15.1194 8.5685 1.6402 1.8483 81.2020 3.3114 3.8656 49.8338 45.5281 12.1007 13.2171 30.9214 135.5770 49.6266 0.2797 20.8653 47.5028 5.1612 0.2881 19.7692 16.9329 0.6202 32.2061 1.0153 56.1021 31.9888 48.5082 0.9716 21.1080 37.1284 15.5342 93.6978 367.1456 105.6895 247.7091 3.4100 38.2166 168.4352 222.4977 115.9078 123.1614 47.9027 8.9050 51.8175 46.3703 246.8925 159.1944 571.5960 1.9260 296.6299 169.0978 8.1086 121.8540 60.7389 16.4959 67.9770 15.1533 5.4548 81.3817 232.4285 108.6245 567.7127 8.7515 80.3020 151.8752 27.4389 26.2996 512.1608 221.9249 51.6151 21.6877 43.0314 12.4241 31.0890 4.4540 3.3865 2.4912 4.9506 7.3374 1.6009 0.2410 1.0623 10.4476 63.1173 76.4573 287.0389 1.9215 0.8207 0.8079 0.6041 1.3095 5.7139 0.3275 2.8788 2.8341 2.2516 2.5309 0.3414 0.5824 2.1094 0.2983 1.2136 0.4654 1.4889 0.4400 2.2746 1.0368 1.5871 0.8133 0.7647 4.6059 3.5121 3.7139 3.3354 3.2800 1.2840 1.5051 1.1853 4.6875 2.4217 0.5436 1.2730 6.9486 0.2878 0.5317 4.7085 1.3088 1.8421 0.5830 0.8082 2.0056 1.1363 0.4779 3.2076 1.6259 0.6125 3.9638 1.3510 3.5205 6.6696 4.4048 0.4335 0.6760 1.2457 4.4372 2.5821 24.5514 2.1922 0.5398 1.2330 10.7918 10.2364 2.3088 8.2634 10.7758 0.1498 2.2942 7.8180 1.2539 2.3303 11.6697 1.6345 0.1684 0.8373 0.2922 9.4668 4.9200 6.6968 3.0061 11.4210 4.0570 20.3327 3.8250 5.4538 15.1966 2.1045 4.5875 2.7460 1.0602 4.1410 15.8134 12.9335 7.5776 13.8841 11.9492 20.7177 49.9842 7.2236 22.8911 5.6400 12.0195 30.5074 5.0448 11.1799 87.3947 4.8616 2.7332 6.8962 22.6518 11.0205 4.8619 29.0369 3.6832 2.3370 27.1267 82.2992 33.2973 35.6832 34.2035 28.3954 108.6450 73.6136 52.0152 36.2791 100.9885 52.3394 80.1025 44.7888 83.6685 145.7604 138.4566 48.2279 141.4315 40.0472 48.0175 45.0641 48.2031 0.7496 0.7441 0.7325 0.7479 0.7304 0.7407 0.7145 0.7500 0.7499 0.7232 0.7471 0.5693 0.7238 0.7473 0.5538 0.3075 0.7408 0.6259 0.7324 0.7343 0.1585 0.7444 0.7491 0.7354 0.3312 0.4490 0.3916 0.3291 0.2751 0.7147 0.6801 0.7458 0.4775 0.6758 0.7492 0.7389 0.3211 0.7405 0.7495 0.3639 0.1388 0.7271 0.7294 0.5384 0.6124 0.2805 0.5176 0.1431 0.5590 0.6619 0.2617 0.3182 0.5204 0.3329 0.3089 0.4973 0.2951 0.7039 0.6984 0.6831 0.1093 0.4727 0.7277 0.7027 0.0736 0.0833 0.7500 0.1063 0.2262 0.6871 0.7496 0.3201 0.7500 0.7218 0.1247 0.4828 0.6268 0.6557 0.6388 0.4670 0.2735 0.3066 0.4930 0.3001 0.6203 0.4211 0.3619 0.1008 0.2654 0.4930 0.7499 0.2348 0.7259 0.5263 0.2460 0.0335 0.5420 0.6663 0.2436 0.1967 0.1620 0.2808 0.2728 0.1968 0.6010 0.1528 0.4500 0.2120 0.3148 0.7258 0.6766 0.6261 0.7498 0.3007 0.3258 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0.7784 0.5726 0.6909 0.8463 0.8412 0.4560 0.4579 0.0398 0.0774 0.8571 0.8569 0.7074 0.8329 0.6997 0.4237 0.7343 0.3032 0.3160 0.4772 0.3189 0.4277 0.3197 0.2194 0.2948 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 6 8 6 6 6 6 6 6 7 6 8 6 8 6 8 6 6 6 6 6 6 8 7 16 8 8 6 6 6 6 16 17 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 31.97207 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 31.97207 34.96885 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 11335.4725 32558.5861 41484.8211 0.99996 0.00933 0.00038 -0.00932 0.99995 -0.00393 -0.00042 0.00392 0.99999 1 0.00764 0.00266 0.00209 0.15921 0.05543 0.04350 6.73 10.43 23.83 31.15 38.00 57.17 65.83 85.55 92.31 102.02 121.52 147.97 171.89 178.19 207.80 212.28 245.42 257.25 297.58 315.10 340.51 359.00 397.94 398.92 439.13 456.66 491.07 503.35 520.87 553.22 579.99 588.52 610.20 613.11 647.55 687.25 695.40 712.19 727.15 753.82 822.24 846.75 849.78 857.48 865.61 904.58 928.80 943.03 945.72 977.81 996.91 1002.38 1013.68 1045.38 1088.06 1126.73 1150.25 1152.71 1167.30 1190.39 1237.74 1256.84 1267.65 1327.72 1328.83 1337.70 1367.80 1409.14 1421.04 1450.18 1494.81 1509.37 1524.82 1531.71 1545.76 1549.42 1609.06 1612.33 1617.58 1660.93 1663.69 1674.96 1731.28 1754.26 1764.73 1777.27 1788.92 1820.97 1836.19 1860.72 1861.28 1893.15 1910.46 1949.07 1956.85 1983.54 1987.10 2019.50 2050.53 2066.94 2088.07 2118.44 2121.46 2173.79 2195.40 2228.46 2256.94 2280.61 2290.82 2328.66 2340.28 2370.85 2373.23 2385.97 2395.10 2400.98 2493.92 2512.07 2558.80 2586.88 2605.50 2625.52 2785.61 2867.61 4631.66 4680.22 4730.69 4750.25 4799.98 4891.58 4892.30 4901.47 4904.58 4915.16 4918.90 4939.93 4957.20 4996.80 5499.47 5566.90 5696.20 0.383326 0.411446 0.412391 0.316446 -2654.251105 -2654.222985 -2654.222040 -2654.317985 3.218011D-04 MUNgauss RevisionA2.0 retrievium 24-Jan-2021 DUDE COc1ccc(cc1NC(=O)COC(=O)c2cc(ccc2O)NS(=O)(=O)c3cccs3)Cl C03255133 RHF 6-31G(d) (6D,10F) C1 496.016572 |X|Y|Z| 73.482046 28.468599 128.570735 64.550036 24 6 7 8 16 19 2 1 2 |36.858105| |13.575022|73.516695| |7.981168|24.992771|36.858105| |6.706458|13.987067|13.835240|36.858105| |4.502726|9.220146|7.933315|13.692293|36.858105| |3.802399|8.248495|6.917703|7.996687|13.884121|36.858105| |3.976194|9.400961|7.912519|6.859351|7.902531|13.713002|36.858105| |5.241132|14.543968|13.565027|7.905128|6.843673|7.970671|13.793303|36.858105| |4.767858|13.043504|7.992302|5.208489|4.550429|5.134229|7.730449|13.553925|53.358707| |3.577488|8.604750|5.162180|3.901908|3.675354|4.318285|6.290097|7.657916|19.096613|36.858105| |3.055979|7.010996|4.431445|3.599340|3.607296|4.480804|6.565571|6.509338|11.426237|15.965629|73.516695| |3.268126|7.433004|4.035445|3.156388|2.913769|3.237724|4.217781|5.064023|10.855199|12.501355|14.177366|36.858105| |2.644376|5.732685|3.202767|2.643703|2.525884|2.840132|3.581592|3.938369|7.271020|8.057058|12.897060|13.589424|73.516695| |2.368181|4.955166|2.702744|2.280402|2.169725|2.382917|2.884024|3.157029|5.520365|5.284210|8.613962|8.173999|25.669071|36.858105| |2.432454|5.017251|2.651383|2.230683|2.085308|2.241401|2.672804|2.997888|5.228828|4.636384|7.205035|7.267852|15.346332|15.847169|73.516695| |2.018650|4.136764|2.300251|1.997431|1.938975|2.138461|2.529242|2.661431|4.394404|4.075660|7.235121|5.232145|14.506970|12.934926|14.281199|36.858105| |1.931516|3.968302|2.265223|1.992107|1.973202|2.215149|2.618410|2.661894|4.278735|4.024988|7.711566|4.636455|12.496876|7.627447|9.373473|13.589176|36.858105| |1.698680|3.428508|1.963267|1.761360|1.760289|1.963217|2.261549|2.263240|3.514271|3.153634|6.068673|3.476445|8.297907|5.067723|7.087979|7.897603|13.888745|36.858105| |1.572673|3.129686|1.768454|1.594726|1.581894|1.736571|1.972528|1.996986|3.084516|2.684840|4.998285|3.019647|6.879107|4.485229|6.737426|6.866022|7.967772|13.611753|36.858105| |1.614806|3.202514|1.781384|1.594809|1.562111|1.697051|1.931013|1.992964|3.119193|2.692948|4.853591|3.155133|7.134730|5.062359|7.959265|7.895797|6.873605|7.909396|13.898434|36.858105| |1.814379|3.636419|2.000979|1.762331|1.706842|1.853392|2.141224|2.252574|3.624444|3.183193|5.585622|3.959097|9.345915|7.661929|11.836451|13.612550|7.873271|6.817560|7.930182|13.630589|36.858105| |1.816171|3.598630|1.944508|1.710774|1.637562|1.752643|2.009367|2.147910|3.457038|2.942473|5.004101|3.725947|8.095121|6.619050|12.685094|7.915064|5.203616|4.622670|5.313477|8.196631|14.340278|73.516695| |1.607949|3.233194|1.880714|1.712208|1.738324|1.954364|2.223648|2.169606|3.277241|2.896416|5.748981|3.016785|6.813140|3.859400|5.606984|5.113423|7.809841|13.368388|7.815180|5.148924|4.515642|6.108044|53.358707| |1.499017|2.993336|1.754511|1.618497|1.660222|1.868062|2.092730|2.011157|2.973997|2.579755|5.161948|2.620357|5.654995|3.164046|4.762203|3.919008|5.263088|7.084169|5.566684|4.069206|3.595681|5.141989|15.805314|388.023441| |1.404038|2.777891|1.609713|1.486921|1.512709|1.678810|1.866616|1.818878|2.695712|2.304368|4.483403|2.396200|5.109973|2.976340|4.599191|3.726132|4.613352|6.294703|6.004324|4.395830|3.666797|5.309253|10.485954|94.980629|73.516695| |1.429072|2.838832|1.677997|1.567047|1.624609|1.831076|2.021379|1.913975|2.774367|2.363253|4.754699|2.338900|4.893200|2.678075|4.102246|3.166382|4.070819|5.030480|4.164495|3.227270|2.914327|4.313969|10.652075|94.928635|13.539647|73.516695| |1.625755|3.280050|1.944125|1.787785|1.846347|2.107212|2.385380|2.263375|3.342043|2.944824|6.069717|2.918212|6.252694|3.364820|5.023006|3.956561|5.202483|5.726956|4.445115|3.610805|3.452871|5.033093|9.503337|77.321412|13.249965|13.149577|36.858105| |1.638488|3.299007|1.939423|1.776914|1.819829|2.058715|2.331339|2.243411|3.336035|2.925195|5.888341|2.957517|6.262793|3.448570|5.236084|3.985228|4.844836|5.040422|4.225636|3.638954|3.547432|5.263974|7.138145|49.091117|11.395700|8.908354|14.123797|36.858105| |1.745576|3.535258|2.102968|1.930667|1.992254|2.275266|2.581571|2.452216|3.603374|3.144929|6.423638|3.071543|6.240166|3.301812|5.090459|3.546127|4.099773|3.934279|3.343833|3.033457|3.097792|4.766062|5.455857|33.874306|7.720634|7.006519|8.260187|13.314753|36.858105| |1.818900|3.712392|2.256643|2.086028|2.194580|2.565760|2.916687|2.676427|3.850004|3.367404|7.212413|3.116132|6.220445|3.143178|4.811936|3.295728|3.899976|3.685773|3.046767|2.738942|2.816610|4.344218|5.348383|32.465069|6.863076|7.236877|7.781323|8.257261|14.133722|36.858105| |1.734071|3.529660|2.145550|1.989890|2.101552|2.462595|2.789328|2.543884|3.658575|3.217998|6.987766|2.985408|6.149634|3.109093|4.670617|3.400249|4.322597|4.304370|3.383238|2.891995|2.889488|4.347333|6.988786|44.403593|8.119029|10.542785|11.003732|7.415710|7.433110|11.082649|388.023441| |2.831809|5.790204|4.235554|4.771549|7.053271|10.924039|7.052648|4.778207|5.020436|3.426035|6.697865|2.689698|4.417325|2.121891|3.512349|1.966669|2.082838|1.888280|1.666617|1.604428|1.719269|2.864325|2.621598|13.360988|2.979624|3.340752|2.125681|2.049687|2.273858|2.626946|18.186563|448.794386| |17.576673|16.448156|7.023535|6.714179|4.569184|3.751338|3.783976|4.748895|5.723596|3.254403|5.059369|2.962850|4.335965|2.198609|4.007250|1.894105|1.820360|1.612051|1.496194|1.533123|1.711926|3.046428|2.086067|10.274605|2.413987|2.451411|1.576857|1.598843|1.717302|1.788174|11.986964|22.711588|0.500000| |17.576927|16.448522|7.031596|6.716502|4.572209|3.755441|3.789536|4.756037|5.731433|3.252266|5.057444|2.952464|4.352466|2.198039|3.978779|1.900980|1.835238|1.626959|1.506559|1.538727|1.714543|3.038734|2.112100|10.273022|2.399420|2.467954|1.553867|1.552518|1.643875|1.722180|11.829446|22.731531|0.298611|0.500000| |17.652806|16.976949|5.865082|4.895132|3.611121|3.193020|3.408205|4.409224|5.946413|3.401734|5.109214|3.271133|4.697932|2.412038|4.495898|2.040983|1.923662|1.690853|1.579232|1.637903|1.850876|3.336132|2.158714|10.468005|2.468015|2.481952|1.585943|1.605054|1.696954|1.748007|11.862044|19.856882|0.299908|0.299882|0.500000| |7.457903|12.522158|8.928432|17.768305|8.949741|5.689186|4.948964|5.623682|5.741295|3.281314|5.370924|2.782723|4.190804|2.076328|3.656229|1.829102|1.811593|1.615757|1.478199|1.485154|1.635132|2.846711|2.135165|10.570445|2.447068|2.562096|1.627876|1.623172|1.752877|1.874526|12.733960|31.666598|0.224343|0.223971|0.145847|0.500000| |3.899313|7.433850|5.648667|8.892827|17.757320|8.944797|5.631142|4.939858|4.930432|3.051803|5.391374|2.503571|3.939250|1.935310|3.317842|1.752932|1.788104|1.615482|1.461290|1.440309|1.559943|2.666590|2.185452|10.990966|2.513663|2.708125|1.708871|1.683035|1.837269|2.019731|13.803301|53.737370|0.112711|0.112743|0.088779|0.215922|0.500000| |3.325045|7.599659|5.636789|4.954403|5.645262|8.905077|17.839429|8.946997|9.525100|6.871702|15.110269|4.439384|7.003750|3.099556|4.966155|2.756279|2.928930|2.513553|2.150554|2.077225|2.295331|3.762809|3.399471|16.724152|3.667648|4.039878|2.727175|2.631285|2.935551|3.414323|23.418313|53.952216|0.088024|0.088159|0.082048|0.107618|0.124204|0.500000| |5.570257|16.057728|7.782374|4.983782|4.110179|4.317379|5.772339|9.417524|26.047080|9.408546|10.840419|7.775102|8.910723|4.014792|7.104963|3.133146|2.954107|2.441435|2.185146|2.248067|2.635508|4.575370|3.060574|14.472347|3.326788|3.364454|2.252813|2.268162|2.421657|2.531906|17.111742|25.561045|0.130654|0.130973|0.147548|0.117539|0.093069|0.143385|0.500000| |3.300709|7.390418|3.906211|3.074222|2.807851|3.061467|3.884673|4.690906|9.484337|8.883878|11.224765|17.598966|16.536717|7.336942|13.252609|4.798466|4.132379|3.195274|2.853464|3.036389|3.817213|6.625621|3.767045|17.578720|4.101683|3.899038|2.788164|2.916986|3.082291|3.050737|19.998170|20.452054|0.084699|0.080910|0.093059|0.076217|0.067449|0.111021|0.202301|0.500000| |3.457835|7.794418|4.029383|3.134095|2.829638|3.059669|3.878466|4.787124|9.958960|8.811920|10.752466|17.600383|16.559670|7.147198|12.659172|4.736359|4.113572|3.187080|2.838525|3.006750|3.761843|6.502111|3.775924|16.975978|3.913464|3.837800|2.574497|2.580041|2.633561|2.669621|18.605601|20.273917|0.084717|0.087400|0.098382|0.077884|0.067848|0.109448|0.225178|0.302108|0.500000| |2.066322|4.311306|2.505310|2.191072|2.189246|2.504945|3.020380|3.023945|4.882180|4.801749|9.790314|5.216330|14.403031|7.084321|8.706646|8.914365|17.747349|8.958501|5.651897|4.954822|5.627459|7.467918|9.699906|36.380063|7.471749|7.371376|5.512321|4.934058|4.403723|4.438285|35.866642|18.893932|0.053995|0.054553|0.056539|0.054681|0.054662|0.096332|0.090904|0.123931|0.123859|0.500000| |1.448065|2.857219|1.619369|1.475584|1.471018|1.609338|1.805166|1.813243|2.755258|2.355466|4.401176|2.588757|5.676638|3.580743|5.566108|4.951409|5.677486|8.923362|17.754940|8.962335|5.639919|7.614018|9.851923|40.568042|12.021613|7.764007|4.202375|3.936028|3.093832|2.829836|22.632182|12.537564|0.038418|0.038707|0.040330|0.038157|0.038001|0.054491|0.054247|0.068417|0.068148|0.124547|0.500000| |1.509595|2.960889|1.638419|1.476565|1.443430|1.554536|1.749792|1.809044|2.802273|2.367273|4.229245|2.748708|5.944938|4.131181|6.904779|5.643249|4.955113|5.620737|8.920025|17.751423|8.955894|13.443905|5.671991|24.912089|6.957883|5.097609|3.105817|3.166220|2.680967|2.418929|17.963447|11.825824|0.039932|0.040029|0.042709|0.038459|0.037169|0.051805|0.056584|0.074578|0.073836|0.107604|0.214075|0.500000| |1.979558|3.944386|2.106439|1.832092|1.736673|1.852945|2.140881|2.325780|3.812261|3.244248|5.371845|4.296242|9.149759|7.969382|18.212201|7.762947|4.960248|4.163484|4.446319|6.070349|10.097477|35.453904|4.330202|19.210085|4.854888|4.080170|2.718451|2.853095|2.655373|2.442897|17.138142|13.491894|0.051644|0.051379|0.057196|0.047587|0.043949|0.062238|0.079907|0.121483|0.118504|0.116328|0.101235|0.152982|0.500000| |1.653583|3.337361|1.957055|1.784618|1.822542|2.063915|2.352329|2.272347|3.410170|3.017295|6.086105|3.065014|6.847767|3.723084|5.402672|4.673430|6.984815|9.137905|5.906419|4.321842|3.999208|5.570982|25.945599|61.056798|10.177557|13.553408|6.119340|4.544565|3.713302|3.837019|37.329107|16.417160|0.043617|0.044569|0.045080|0.045238|0.046705|0.074001|0.064433|0.076606|0.078794|0.199882|0.152583|0.099487|0.082298|0.500000| |1.563286|3.122193|1.812388|1.659815|1.684048|1.879238|2.115413|2.068080|3.092504|2.679076|5.232136|2.789762|5.903887|3.398055|5.255706|4.024219|4.674723|5.057538|4.576598|3.989070|3.773052|5.615942|6.759727|45.268173|12.612469|8.042949|8.934659|17.769763|8.563623|5.732281|37.609220|14.890173|0.042382|0.041109|0.042858|0.042434|0.043399|0.065229|0.059301|0.077425|0.068468|0.123809|0.119929|0.097639|0.083037|0.115395|0.500000| |1.747151|3.519562|2.079317|1.910951|1.958841|2.211313|2.491764|2.395859|3.514883|3.010335|5.968675|2.972710|5.867878|3.151532|4.994496|3.291904|3.604775|3.415921|3.023356|2.840501|2.938393|4.647114|4.578547|27.406719|6.590354|5.789723|5.740877|8.600588|17.759050|8.899057|37.641332|17.574532|0.048097|0.045417|0.047311|0.048432|0.050280|0.077287|0.066309|0.085293|0.070897|0.105170|0.077859|0.070906|0.072500|0.086737|0.200432|0.500000| |1.894416|3.874119|2.391978|2.232366|2.382660|2.820222|3.177818|2.846758|3.990471|3.414811|7.355302|3.049050|5.836919|2.900529|4.520254|2.934765|3.360232|3.125047|2.636474|2.420322|2.520209|3.969732|4.475777|26.109119|5.645015|6.073095|5.453704|5.696606|8.769253|17.783625|55.632719|23.581080|0.052123|0.049758|0.050118|0.055413|0.060941|0.104022|0.072198|0.083499|0.072650|0.106616|0.068251|0.060058|0.062717|0.091137|0.122484|0.203656|0.500000| 2651.608603 -13573.980067 4872.896585 -258.979675 -6308.454555 3653.820086 -2654.634468 2.001141 406200000000002F 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