Version2.4 2021-05-26T09:38:12Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 03-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1,RFO) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCn1c(=O)c2ccc(cc2nc1S[C@@H](C)C(=O)Nc3cc(ccc3Cl)[N+](=O)[O-])C(=O)[O-] C13201589 RHF 6-31G(d) (6D,7F) CCn1c(=O)c2ccc(cc2nc1S[C@@H](C)C(=O)Nc3cc(ccc3Cl)[N+](=O)[O-])C(=O)[O-] C01[X(C20H16Cl1N4O6S1)] 138 C1 520 CCn1c(S[C@H](C(=O)Nc2cc(ccc2Cl)[N+](=O)[O-])C)nc2c(c1=O)ccc(c2)C(=O)[O-] CCn1c(S[C@H](C(=O)Nc2cc(ccc2Cl)[N+](=O)[O-])C)nc2c(c1=O)ccc(c2)C(=O)[O-] CCN1C(=O)c2ccc(cc2N=C1S[C@@H](C)C(=O)Nc3cc(ccc3Cl)[N+]([O-])=O)C([O-])=O InChIKey=NGOUMHAVQUIJCJ-JTQLQIEISA-M InChI=1S/C20H17ClN4O6S/c1-3-24-18(27)13-6-4-11(19(28)29)8-15(13)23-20(24)32-10(2)17(26)22-16-9-12(25(30)31)5-7-14(16)21/h4-10H,3H2,1-2H3,(H,22,26)(H,28,29)/p-1/t10-/m0/s1 InChI=1/C20H17ClN4O6S/c1-3-24-18(27)13-6-4-11(19(28)29)8-15(13)23-20(24)32-10(2)17(26)22-16-9-12(25(30)31)5-7-14(16)21/h4-10H,3H2,1-2H3,(H,22,26)(H,28,29)/p-1/t10-/m0/s1/fC20H16ClN4O6S/h22H/q-1 CCn1c(=O)c2ccc(cc2nc1S[C@@H](C)C(=O)Nc3cc(ccc3Cl)[N+](=O)[O-])C(=O)[O-] C01[X(C20H16Cl1N4O6S1)] 138 C01 520 CCn1c(S[C@H](C(=O)Nc2cc(ccc2Cl)[N+](=O)[O-])C)nc2c(c1=O)ccc(c2)C(=O)[O-] CCN1C(=N[C]2[C]([CH][CH][C]([CH]2)[C]([O])=O)C1=O)S[C@H](C(=O)N[C]1[CH][C]([CH][CH][C]1[Cl])[N]([O])[O])C CCN1C(=O)[C]2[CH][CH][C]([CH][C]2N=C1S[C@@H](C)C(=O)N[C]3[CH][C]([CH][CH][C]3Cl)N([O])[O])C([O])=O InChIKey=AHLUZPGIOXCWSY-JTQLQIEISA-N InChI=1S/C20H16ClN4O6S/c1-3-24-18(27)13-6-4-11(19(28)29)8-15(13)23-20(24)32-10(2)17(26)22-16-9-12(25(30)31)5-7-14(16)21/h4-10H,3H2,1-2H3,(H,22,26)/t10-/m0/s1 InChI=1/C20H16ClN4O6S/c1-3-24-18(27)13-6-4-11(19(28)29)8-15(13)23-20(24)32-10(2)17(26)22-16-9-12(25(30)31)5-7-14(16)21/h4-10H,3H2,1-2H3,(H,22,26)/t10-/m0/s1/f/h22H 3566.8118436523 -2290.6437477 1-A 16549.2830 123 397 520 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475.04791 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 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 15.5130 22.0948 28.5445 42.1218 44.6694 51.6808 60.2211 75.3757 79.3498 90.7937 96.6527 104.5942 110.3906 118.9085 148.0144 173.0413 188.4972 205.3694 232.7692 245.5562 252.4788 256.2150 265.1813 272.5086 293.6767 313.2467 332.9854 333.6637 345.1890 347.0031 369.6319 385.8863 432.9763 447.2560 460.5235 479.5476 498.1628 505.0768 536.0556 554.0927 582.7911 594.1121 613.6045 627.6878 637.3463 658.6823 668.1817 686.5445 702.3679 723.9469 737.8532 767.5398 770.7072 781.0577 787.2891 825.5353 849.1352 858.3062 862.0838 868.8540 874.3507 887.5854 921.5686 924.8069 948.1494 977.1365 1015.9016 1030.4097 1043.8198 1052.0565 1060.5249 1062.2686 1094.7555 1101.2232 1113.5136 1125.0151 1162.8174 1182.9591 1196.1368 1206.9786 1208.7947 1216.8798 1226.5927 1241.5726 1245.5268 1283.1857 1295.0343 1320.0439 1322.8129 1372.5395 1375.3981 1383.4200 1387.3872 1395.6405 1416.7959 1446.9301 1511.0266 1515.8632 1522.4895 1536.7716 1568.3734 1569.7586 1572.0319 1573.2777 1632.1310 1634.1678 1635.2176 1639.2295 1642.9312 1646.0151 1647.9056 1659.3675 1724.6288 1753.4030 1779.6996 1791.2183 1800.2005 1813.1297 1860.5959 1925.5508 1928.9574 1961.2922 3210.8971 3228.2172 3270.6475 3290.9299 3295.2638 3305.0999 3311.4026 3333.9288 3351.2638 3388.9970 3408.1568 3418.5378 3444.6655 3445.9993 3492.1692 3799.1059 10.0143 8.1016 10.4261 12.5272 6.7803 6.4759 14.2381 9.5157 6.9113 3.4800 4.1027 10.2769 9.4076 6.0289 6.6611 7.9744 5.4451 5.6935 1.2133 2.0462 4.4134 4.1338 3.1580 2.7526 7.5367 7.4092 6.9591 6.3749 14.4700 5.7134 5.3707 6.1626 3.8151 5.0679 5.0437 6.3103 3.9187 3.3006 7.6099 4.8697 7.7024 5.9162 6.3371 5.3544 6.6338 7.1210 7.7393 5.1286 1.6125 2.8509 5.4714 5.7497 6.4681 5.7483 4.9362 4.6671 1.3108 4.6588 3.7007 4.6394 10.0618 6.0791 8.8307 3.2597 1.5346 1.6661 3.4908 4.5259 2.9914 2.5651 1.8606 1.6071 1.9160 1.3433 4.8039 1.3170 4.5015 2.2285 2.5918 1.6628 1.6948 1.7644 1.9826 2.2459 2.1297 3.2610 3.2130 2.2445 4.3924 2.0026 2.5228 1.3937 2.3053 2.1228 1.5548 3.5123 1.6588 11.5933 1.5986 1.4023 1.2595 1.4398 3.5841 4.3558 4.0546 1.0448 1.0678 1.0710 2.5530 1.0861 3.4367 1.0957 2.2981 8.8053 4.9784 4.7497 6.3455 10.6810 12.1393 12.0231 12.3344 8.3784 1.0393 1.0359 1.0981 1.0774 1.1039 1.0925 1.1031 1.0878 1.1035 1.0904 1.0927 1.0940 1.0915 1.0951 1.0928 1.0802 0.0014 0.0023 0.0050 0.0131 0.0080 0.0102 0.0304 0.0319 0.0256 0.0169 0.0226 0.0662 0.0675 0.0502 0.0860 0.1407 0.1140 0.1415 0.0387 0.0727 0.1658 0.1599 0.1308 0.1204 0.3830 0.4283 0.4546 0.4182 1.0159 0.4053 0.4323 0.5407 0.4214 0.5973 0.6302 0.8550 0.5730 0.4961 1.2884 0.8809 1.5413 1.2303 1.4058 1.2429 1.5877 1.8203 2.0358 1.4243 0.4687 0.8803 1.7550 1.9957 2.2636 2.0661 1.8027 1.8740 0.5568 2.0221 1.6204 2.0635 4.5321 2.8217 4.4188 1.6426 0.8128 0.9373 2.1227 2.8312 1.9203 1.6727 1.2330 1.0685 1.3529 0.9598 3.5095 0.9821 3.5861 1.8374 2.1848 1.4272 1.4591 1.5394 1.7574 2.0398 1.9466 3.1636 3.1748 2.3043 4.5285 2.2228 2.8118 1.5716 2.6144 2.4361 1.8389 4.3325 2.2314 15.6956 2.1833 1.9513 1.8254 2.0904 5.2186 6.3523 6.3637 1.6439 1.6823 1.6956 4.0601 1.7338 5.4986 1.7776 4.0273 15.9499 9.2904 8.9787 12.1159 20.6881 24.7598 26.2650 27.0404 18.9888 6.3132 6.3608 6.9209 6.8748 7.0623 7.0314 7.1264 7.1237 7.3023 7.3784 7.4784 7.5329 7.6308 7.6616 7.8519 9.1859 0.3774 3.8760 6.4373 0.3001 3.3467 5.8043 1.1770 3.9000 1.1874 2.7364 2.8836 6.2540 5.2504 4.9945 0.3761 3.3020 1.9076 2.0717 0.4300 1.1674 2.3695 1.9126 0.2997 3.0888 2.9401 11.7710 1.8251 0.7815 0.7366 6.9469 6.3740 12.1027 4.9249 5.6472 10.1755 5.4007 1.9221 2.3259 8.5151 5.2282 13.2867 7.9178 8.7732 5.2404 15.2788 6.4402 3.3210 9.2871 68.6533 16.1608 11.5174 3.7866 18.2217 3.9052 3.1484 1.8453 4.6963 44.5089 102.1324 3.6396 140.9861 1.1906 52.9852 24.4511 11.1320 2.8820 11.7851 4.7094 21.6950 11.1079 19.2801 22.0117 9.2906 0.2358 1.9592 0.1439 70.2695 22.3842 10.6555 40.8626 9.4656 14.3079 46.2605 9.1870 9.8863 1.1388 59.0169 128.9382 34.8863 86.4787 4.6713 34.6258 175.0736 16.8408 40.7295 153.7091 160.1557 532.3477 48.0213 39.5594 3.1923 20.2233 30.7286 96.8432 395.7183 10.6171 12.8845 3.8392 23.4790 5.5572 87.0287 20.3046 189.6766 165.9913 500.8851 18.2897 32.7957 529.9872 280.9287 907.9109 370.8495 290.6997 36.0080 30.0636 33.7123 16.9560 23.2230 32.9178 15.5430 3.0469 15.2272 6.3009 1.4343 6.2461 2.6281 0.8817 14.3215 213.9238 5.2296 3.3595 2.5224 1.5237 1.1461 0.3257 1.4012 0.7223 1.5033 0.8246 0.4347 0.0790 1.8427 3.7920 1.3061 0.7841 0.6763 0.9889 0.1377 0.1424 2.3391 1.2651 0.7379 1.7277 4.8983 2.4738 1.0381 2.4529 6.1928 1.9195 1.0620 2.2488 1.2666 1.3973 1.1250 2.6919 0.2132 0.6455 0.3328 0.6171 1.6392 1.7511 0.6595 3.0036 2.4751 5.3926 1.0459 6.4993 2.3718 3.5382 1.6898 7.9085 15.0298 2.0741 2.4478 5.3083 1.0234 2.8505 1.9896 9.6183 4.5291 0.6632 5.2498 2.5931 1.7398 2.9161 11.1935 9.2216 12.1504 4.5359 3.0728 2.2839 3.0608 1.1769 2.8508 0.0644 10.5806 3.7002 11.7634 1.6863 4.4351 2.4562 1.8774 19.6785 2.6527 2.0045 13.0244 12.7819 7.7446 29.6270 24.8217 18.9510 23.0087 10.2906 10.1950 86.2067 19.7112 42.3007 4.9674 13.4242 1.3341 5.3011 11.5787 7.3770 105.6060 18.3563 22.4093 21.0279 10.9770 30.0885 88.2552 7.4106 14.5034 82.0594 30.6540 119.8845 83.3022 91.9688 4.7120 24.5640 4.1946 12.3217 142.4431 124.4735 84.9668 84.2354 89.8708 52.7933 60.1610 15.3367 38.9314 60.0300 65.8209 139.0856 56.4671 96.9179 21.8415 86.9191 0.7294 0.7472 0.7489 0.7464 0.7500 0.6465 0.7133 0.7162 0.7475 0.7432 0.6389 0.3473 0.7410 0.7310 0.6035 0.7177 0.4986 0.7136 0.7174 0.4614 0.2159 0.6874 0.7362 0.7440 0.2832 0.7499 0.5892 0.5501 0.1768 0.2545 0.7500 0.1931 0.4738 0.7242 0.6286 0.0624 0.3505 0.7035 0.5611 0.3097 0.3424 0.5474 0.2718 0.2199 0.1864 0.7409 0.5556 0.5673 0.4826 0.3589 0.7493 0.7437 0.0850 0.7466 0.1998 0.1847 0.5784 0.7207 0.7450 0.2829 0.1690 0.7389 0.1169 0.7402 0.6969 0.7444 0.2753 0.3341 0.2756 0.5559 0.7496 0.7074 0.5343 0.7365 0.6152 0.6773 0.1392 0.3407 0.1686 0.3726 0.1587 0.6638 0.7500 0.3807 0.5530 0.4131 0.2387 0.2704 0.7345 0.3156 0.1645 0.3900 0.3051 0.6073 0.1802 0.1740 0.6792 0.2097 0.2776 0.6746 0.7409 0.6832 0.7125 0.5117 0.2199 0.7343 0.7055 0.5825 0.1479 0.7171 0.2382 0.4441 0.6272 0.3392 0.2792 0.5955 0.6139 0.2000 0.3971 0.2316 0.1986 0.1627 0.1166 0.0260 0.7420 0.1695 0.7494 0.4113 0.7207 0.0821 0.5013 0.4586 0.3674 0.2323 0.2321 0.2379 0.2202 0.2049 0.8435 0.8553 0.8564 0.8548 0.8571 0.7853 0.8326 0.8346 0.8555 0.8527 0.7797 0.5156 0.8512 0.8446 0.7527 0.8356 0.6654 0.8329 0.8355 0.6315 0.3551 0.8148 0.8481 0.8532 0.4414 0.8571 0.7415 0.7098 0.3005 0.4058 0.8571 0.3236 0.6430 0.8401 0.7720 0.1174 0.5190 0.8259 0.7188 0.4729 0.5101 0.7075 0.4275 0.3605 0.3142 0.8512 0.7143 0.7239 0.6510 0.5282 0.8567 0.8530 0.1567 0.8549 0.3331 0.3118 0.7329 0.8377 0.8538 0.4411 0.2892 0.8499 0.2094 0.8507 0.8214 0.8535 0.4318 0.5009 0.4321 0.7145 0.8569 0.8287 0.6965 0.8482 0.7618 0.8076 0.2444 0.5082 0.2886 0.5429 0.2739 0.7979 0.8571 0.5515 0.7122 0.5847 0.3854 0.4257 0.8469 0.4798 0.2826 0.5611 0.4676 0.7557 0.3053 0.2964 0.8090 0.3467 0.4345 0.8057 0.8512 0.8118 0.8321 0.6770 0.3606 0.8468 0.8273 0.7362 0.2577 0.8352 0.3847 0.6150 0.7709 0.5066 0.4365 0.7465 0.7608 0.3333 0.5685 0.3761 0.3314 0.2799 0.2089 0.0507 0.8519 0.2899 0.8568 0.5829 0.8377 0.1518 0.6678 0.6288 0.5374 0.3770 0.3768 0.3844 0.3610 0.3402 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 6 6 7 6 8 6 6 6 6 6 6 7 6 16 6 1 6 6 8 7 6 6 6 6 6 6 17 7 8 8 6 8 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 31.97207 12.00000 1.00783 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 14.00307 15.99491 15.99491 12.00000 15.99491 15.99491 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 12592.1310 20935.2774 27743.9415 0.99988 0.01424 0.00685 -0.01422 0.99989 -0.00428 -0.00691 0.00418 0.99997 1 0.00688 0.00414 0.00312 0.14332 0.08621 0.06505 22.32 31.79 41.07 60.60 64.27 74.36 86.64 108.45 114.17 130.63 139.06 150.49 158.83 171.08 212.96 248.97 271.21 295.48 334.90 353.30 363.26 368.64 381.54 392.08 422.54 450.69 479.09 480.07 496.65 499.26 531.82 555.20 622.96 643.50 662.59 689.96 716.75 726.69 771.26 797.22 838.51 854.79 882.84 903.10 917.00 947.70 961.36 987.78 1010.55 1041.60 1061.61 1104.32 1108.88 1123.77 1132.73 1187.76 1221.72 1234.91 1240.35 1250.09 1258.00 1277.04 1325.93 1330.59 1364.18 1405.88 1461.66 1482.53 1501.82 1513.67 1525.86 1528.37 1575.11 1584.41 1602.10 1618.65 1673.03 1702.01 1720.97 1736.57 1739.19 1750.82 1764.79 1786.35 1792.04 1846.22 1863.27 1899.25 1903.23 1974.78 1978.89 1990.43 1996.14 2008.02 2038.45 2081.81 2174.03 2180.99 2190.52 2211.07 2256.54 2258.53 2261.80 2263.60 2348.27 2351.20 2352.71 2358.49 2363.81 2368.25 2370.97 2387.46 2481.36 2522.76 2560.59 2577.16 2590.09 2608.69 2676.98 2770.44 2775.34 2821.86 4619.76 4644.68 4705.73 4734.91 4741.15 4755.30 4764.37 4796.78 4821.72 4876.01 4903.58 4918.51 4956.11 4958.02 5024.45 5466.07 0.374486 0.401680 0.402624 0.313155 -2290.269262 -2290.242068 -2290.241124 -2290.330593 3.000805D-04 MUNgauss RevisionA2.1 retrievium 26-May-2021 DUDE CCn1c(=O)c2ccc(cc2nc1S[C@@H](C)C(=O)Nc3cc(ccc3Cl)[N+](=O)[O-])C(=O)[O-] C13201589 RHF 6-31G(d) (6D,10F) C1 475.047909 |X|Y|Z| 97.391348 72.917355 41.798496 66.706883 20 6 7 16 16 3 1 |36.858105| |12.497522|36.858105| |7.640148|12.966146|53.358707| |5.895523|7.812727|18.468454|36.858105| |5.873672|7.171769|11.504687|15.836361|73.516695| |4.226988|5.076516|10.738583|13.085250|14.320218|36.858105| |3.414754|3.866553|6.973709|7.648581|11.724237|13.600115|36.858105| |2.806262|3.104523|5.386366|5.091201|7.955978|7.934991|13.875606|36.858105| |2.673536|2.963395|5.197530|4.489193|6.708572|6.832766|7.893204|13.569064|36.858105| |3.006885|3.408687|6.294269|5.103535|7.106747|7.911398|6.861748|7.943026|13.830841|36.858105| |3.818570|4.536356|9.497133|7.762890|9.458320|13.700453|7.899081|6.875700|7.922581|13.706161|36.858105| |4.245466|5.171772|11.077460|6.759626|8.428240|7.862561|5.155951|4.576562|5.199622|7.949196|13.680027|53.358707| |5.650716|7.606964|18.860510|7.897492|9.683199|6.992752|4.620105|3.877069|4.060318|5.377017|8.322757|20.540842|36.858105| |5.237606|6.356910|9.621607|4.733137|6.850437|4.220987|3.222002|2.858697|3.024500|3.788112|4.823891|9.823914|10.646371|388.023441| |3.543168|4.012950|6.313847|3.648270|5.368454|3.635299|2.906006|2.732735|3.050142|3.910477|4.504638|9.047917|6.763595|73.969370|36.858105| |3.322289|3.865866|6.447523|3.863135|5.567027|4.050914|3.209705|3.064453|3.526809|4.727056|5.354621|11.181390|7.125558|57.119187|17.671187|0.500000| |3.011078|3.387246|4.955285|2.961545|4.541511|2.907882|2.420065|2.296560|2.524155|3.083517|3.416909|6.119789|4.686189|49.526812|12.471102|0.245222|36.858105| |3.292507|3.450481|5.331077|3.234107|4.855571|3.279851|2.701454|2.588342|2.908543|3.650626|4.014936|7.420495|5.287322|49.122717|12.462554|0.245496|7.576881|36.858105| |2.993675|3.043821|4.466575|2.754890|4.262891|2.745219|2.323939|2.233153|2.466820|2.975170|3.216016|5.565353|4.118223|38.988087|8.004450|0.165853|6.891510|15.893082|73.516695| |3.236147|3.340514|5.400831|3.424916|5.076186|3.639561|3.007140|2.933534|3.384955|4.342641|4.626228|8.276530|5.322445|39.945173|7.827285|0.206760|5.141123|14.003631|14.962498|53.358707| |2.861072|2.834687|4.435795|2.943465|4.504207|3.138741|2.714600|2.699585|3.086364|3.731659|3.792746|6.066949|4.006649|29.188487|5.031261|0.134256|3.861336|7.741462|11.838222|18.479819|36.858105| |2.753815|2.637737|3.940954|2.603014|4.090970|2.678347|2.351173|2.309001|2.553324|2.972476|3.078608|4.845439|3.409386|26.207476|4.259602|0.108010|3.514536|6.381859|11.898067|10.621361|13.686413|36.858105| |2.397084|2.272040|3.352499|2.280523|3.656498|2.359007|2.132459|2.121161|2.325352|2.615422|2.646731|3.978566|2.794333|20.803714|3.263647|0.085259|2.817470|4.384199|8.197014|7.027116|7.960392|13.816553|36.858105| |2.193951|2.102181|3.144832|2.197560|3.533532|2.327651|2.149626|2.184950|2.418761|2.668000|2.613039|3.792177|2.595613|18.511949|2.899615|0.078548|2.506798|3.700994|6.579242|6.151719|6.774144|7.860296|13.784488|36.858105| |2.250798|2.200500|3.383579|2.393655|3.793680|2.613343|2.418422|2.507913|2.857220|3.176978|3.010883|4.302444|2.835007|19.498981|3.112851|0.087108|2.624389|3.924017|6.579653|7.005294|7.859553|6.877182|8.066088|13.835127|36.858105| |2.537072|2.528520|3.997671|2.780183|4.290577|3.079723|2.761470|2.848340|3.336677|3.920069|3.719200|5.496858|3.493412|23.767450|3.953953|0.112449|3.166852|5.190819|8.107669|10.689006|13.639215|7.962278|6.977833|7.927673|13.731829|36.858105| |2.449103|2.530069|4.141733|2.983972|4.536782|3.518134|3.210814|3.486008|4.417337|5.293882|4.471760|6.171149|3.635030|23.006283|3.831051|0.117982|3.061836|4.457157|6.649012|8.624665|6.985649|4.760373|4.273746|4.800469|7.126664|11.022550|448.794386| |2.233785|2.084937|2.988530|2.031345|3.316382|2.058907|1.876921|1.851412|1.990435|2.202316|2.253137|3.367199|2.430782|18.486549|2.811727|0.072477|2.526863|3.611440|7.073011|5.313802|5.122587|7.812480|13.066599|7.795870|5.155574|4.548747|25.853238|53.358707| |2.341857|2.166062|3.048015|2.038495|3.338422|2.028776|1.832268|1.784703|1.902921|2.117445|2.205808|3.348249|2.472923|19.449386|2.915239|0.073369|2.661730|3.739778|7.655313|5.200177|4.674495|7.096553|8.361851|5.425465|4.107416|3.917655|23.276125|21.734798|73.516695| |1.995040|1.865416|2.666174|1.841476|3.036856|1.875315|1.737458|1.727439|1.848327|2.009329|2.030958|2.973328|2.136672|15.953178|2.405168|0.063032|2.191592|2.971540|5.698597|4.377175|4.083839|5.434841|8.377884|7.107223|4.698203|3.918152|23.355608|21.676196|16.033409|73.516695| |2.210822|2.396815|3.992271|3.287297|5.145559|4.389389|4.959711|7.393661|12.268692|7.515409|4.982221|5.262604|3.141098|17.942357|2.641849|0.083938|2.254624|2.583237|3.982340|4.079688|2.840238|2.371320|2.213461|2.360058|2.819902|3.192262|35.115239|2.584035|3.190206|3.178297|36.858105| |2.033702|2.185826|3.552176|2.966042|4.807585|3.818708|4.568575|6.808964|8.115788|5.308840|4.010071|4.343789|2.707623|15.736716|2.273439|0.070804|1.980066|2.223535|3.490938|3.441616|2.430663|2.085635|1.976419|2.109464|2.467815|2.705525|28.029207|2.346363|2.902649|2.915340|15.527133|73.516695| |2.120001|2.287713|3.780348|2.983854|4.636354|3.835714|4.006256|5.255214|8.119064|6.935233|4.609978|5.224326|3.076236|18.125588|2.782743|0.089266|2.376455|2.766266|4.254869|4.429408|3.108688|2.547403|2.377054|2.563510|3.135647|3.593508|42.548867|2.739032|3.355804|3.364821|15.470671|15.145866|73.516695| |17.537965|8.862119|7.580023|4.586921|8.510044|3.462170|2.915532|2.446513|2.331082|2.579050|3.162053|4.732479|4.427646|31.550062|3.130174|0.080936|2.777912|2.917613|4.852005|3.830376|2.528045|2.483001|2.192339|2.002770|2.029280|2.251448|17.356143|2.837094|3.922115|3.333543|1.968728|3.253660|3.367719|0.500000| |17.597096|8.846044|9.413212|6.318925|12.147302|4.481419|3.720333|2.997620|2.781427|3.053780|3.850674|5.485404|5.033242|30.621099|3.142182|0.083936|2.663559|2.990423|4.824510|4.146264|2.761323|2.645077|2.346397|2.183434|2.251490|2.510305|19.641750|2.968133|4.007653|3.498132|2.285747|3.770174|3.844139|0.301001|0.500000| |17.568904|8.777203|9.326995|5.149785|8.514615|4.002695|3.220322|2.720929|2.661626|3.045450|3.826947|6.044311|5.890291|42.342790|3.958645|0.099905|3.285296|3.811288|6.182140|5.066698|3.284803|3.208809|2.738148|2.453089|2.491608|2.828455|21.250706|3.465030|4.797719|3.976484|2.221214|3.597228|3.842332|0.301157|0.300189|0.500000| |8.873283|17.687909|12.633228|7.617154|14.736663|4.868222|3.891554|3.078392|2.856521|3.181187|4.123551|5.963189|5.805153|34.323152|3.371271|0.092424|2.948715|2.920237|4.642395|3.885687|2.472840|2.306768|2.025827|1.899600|1.991128|2.256796|18.418317|2.548263|3.438325|3.014677|2.318925|3.818042|3.883878|0.213136|0.213786|0.173231|0.500000| |8.812907|17.648142|12.448447|5.794059|9.311932|4.269709|3.329706|2.779465|2.723826|3.165832|4.086539|6.678510|7.219104|53.836132|4.428104|0.114863|3.862844|3.644802|5.775395|4.580746|2.809291|2.634697|2.248481|2.058012|2.140240|2.465810|19.637957|2.825859|3.875740|3.287491|2.248670|3.635438|3.875282|0.212952|0.173319|0.209274|0.304069|0.500000| |3.391975|3.772609|6.367624|7.080983|12.981983|8.921621|17.734699|8.904111|5.609481|4.947727|5.642046|5.693663|3.998126|20.752918|2.583897|0.077561|2.198880|2.411846|3.757137|3.587951|2.414340|2.141094|1.962871|1.972290|2.181257|2.439749|22.082771|2.387776|3.059271|2.904309|4.041028|6.997300|5.924004|0.081685|0.105305|0.086642|0.109679|0.089106|0.500000| |2.486345|2.699748|4.476414|4.118461|6.833458|5.627797|8.905625|17.759946|8.956337|5.677400|4.957363|4.953704|3.190207|17.524926|2.371290|0.072872|2.037050|2.270107|3.543599|3.468084|2.395881|2.084504|1.947363|2.022980|2.304451|2.551562|24.732427|2.337328|2.935429|2.878067|6.968273|13.762741|8.611951|0.061291|0.074115|0.066797|0.075361|0.067683|0.212159|0.500000| |2.752771|3.083903|5.479513|4.147905|5.947003|5.636193|4.952714|5.659914|9.011324|17.800524|8.899710|9.890192|4.911605|26.664929|4.202887|0.146093|3.304341|3.988935|5.709915|6.602997|4.121578|3.180310|2.777836|2.851803|3.471195|4.418866|52.357481|3.137756|3.915035|3.727844|7.066197|8.697271|14.065878|0.066440|0.076319|0.078873|0.079169|0.081845|0.107545|0.125086|0.500000| |3.044655|3.321162|4.639232|2.764971|4.321784|2.653161|2.229674|2.101316|2.270917|2.714801|3.021559|5.266695|4.193884|46.331015|8.770755|0.172902|17.612073|6.834430|12.844488|6.296117|3.653184|3.507282|2.821659|2.459998|2.509897|2.959610|22.208368|3.534431|4.983686|3.981112|2.037791|3.219668|3.789578|0.079506|0.073900|0.093591|0.079995|0.106694|0.057050|0.052218|0.079454|0.500000| |2.602494|2.872365|4.236759|2.631754|4.071656|2.650916|2.255826|2.185990|2.435202|2.946595|3.134488|5.394052|3.913454|36.555143|8.865939|0.209970|17.575805|6.989774|11.975113|6.761400|3.862161|3.503100|2.841913|2.549978|2.678503|3.219482|25.058088|3.456255|4.705969|3.935588|2.227915|3.474326|4.247108|0.067057|0.065316|0.078445|0.070845|0.088413|0.056852|0.054289|0.089894|0.302638|0.500000| |2.971849|3.466193|5.025863|3.008971|4.635703|2.929487|2.441062|2.302767|2.507439|3.038910|3.391021|5.954287|4.630260|46.301489|8.849976|0.215336|17.590844|5.515851|8.845974|5.729881|3.264842|2.968452|2.451234|2.224329|2.341151|2.784744|22.341163|3.020794|4.130108|3.476675|2.228791|3.500812|4.131816|0.076796|0.072885|0.087443|0.085366|0.112014|0.061876|0.056800|0.089198|0.299837|0.300342|0.500000| |3.369893|3.587060|6.143322|3.946455|5.667134|4.383731|3.522087|3.446776|4.096140|5.618359|6.021949|11.297114|6.356072|41.308937|7.633432|0.235280|4.856249|9.444445|10.864352|25.926489|9.221883|5.802212|4.301355|4.012925|4.768168|7.240345|58.097776|4.551499|5.766107|5.061716|3.502295|5.119411|6.750828|0.080017|0.089172|0.105240|0.085348|0.098494|0.083499|0.081187|0.177825|0.117329|0.128160|0.116230|0.500000| |2.904198|2.756071|4.013502|2.587172|4.086558|2.591600|2.253098|2.177846|2.373757|2.765828|2.938965|4.730689|3.465323|28.403268|4.543015|0.109458|3.831821|6.959388|14.850694|9.665332|8.905894|17.860868|8.963924|5.633726|4.965620|5.657145|31.442372|9.839209|14.225405|8.863205|2.181828|3.437611|4.118133|0.073436|0.075901|0.095678|0.066326|0.077771|0.057481|0.054626|0.081196|0.110436|0.104223|0.088301|0.146512|0.500000| |1.993197|1.901776|2.811755|1.985634|3.235689|2.094425|1.964800|2.004122|2.192651|2.367161|2.309502|3.298118|2.277803|16.208227|2.495789|0.067804|2.206234|3.074624|5.527275|4.906099|4.906972|5.621556|8.910825|17.800762|8.903130|5.635792|31.776885|9.766047|8.823087|14.175725|2.167962|3.499805|4.158852|0.051061|0.055430|0.061278|0.048220|0.051661|0.050584|0.052202|0.069626|0.060502|0.062413|0.055048|0.091190|0.124302|0.500000| |2.070163|2.036009|3.133338|2.262967|3.615844|2.504274|2.374551|2.514521|2.876376|3.100226|2.856136|3.948955|2.583729|17.420339|2.746604|0.078227|2.351872|3.305068|5.519696|5.701505|5.629178|4.957911|5.695770|8.937531|17.760857|8.971825|55.161722|5.672908|6.053466|7.162026|2.936743|4.605249|5.864572|0.052067|0.058063|0.062652|0.051816|0.054743|0.059598|0.065065|0.093986|0.062184|0.066864|0.059261|0.113062|0.107800|0.213492|0.500000| 2288.129451 -12556.952567 4649.974085 -238.606887 -5857.455918 3566.812100 -2290.643818 2.001099 BD4A3FFFFFFFFFCD 451C6362F4760080 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