Version2.4 2021-05-20T04:42:57Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 12-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1cc(oc1)CN2[C@@H](C(=C(C2=O)[O-])C(=O)c3cccs3)c4ccc(c(c4)Cl)Cl C34934456 RHF 6-31G(d) (6D,7F) c1cc(oc1)CN2[C@@H](C(=C(C2=O)[O-])C(=O)c3cccs3)c4ccc(c(c4)Cl)Cl C01[X(C20H12Cl2N1O4S1)] 114 C1 456 O=C(C1=C([O-])C(=O)N([C@@H]1c1ccc(c(c1)Cl)Cl)Cc1ccco1)c1cccs1 O=C(C1=C([O-])C(=O)N([C@@H]1c1ccc(c(c1)Cl)Cl)Cc1ccco1)c1cccs1 [O-]C1=C([C@H](N(Cc2occc2)C1=O)c3ccc(Cl)c(Cl)c3)C(=O)c4sccc4 InChIKey=LJTRRWJCWUFPIM-QGZVFWFLSA-M InChI=1S/C20H13Cl2NO4S/c21-13-6-5-11(9-14(13)22)17-16(18(24)15-4-2-8-28-15)19(25)20(26)23(17)10-12-3-1-7-27-12/h1-9,17,25H,10H2/p-1/t17-/m1/s1 InChI=1/C20H13Cl2NO4S/c21-13-6-5-11(9-14(13)22)17-16(18(24)15-4-2-8-28-15)19(25)20(26)23(17)10-12-3-1-7-27-12/h1-9,17,25H,10H2/p-1/t17-/m1/s1/fC20H12Cl2NO4S/h25h/q-1 c1cc(oc1)CN2[C@@H](C(=C(C2=O)[O-])C(=O)c3cccs3)c4ccc(c(c4)Cl)Cl C01[X(C20H12Cl2N1O4S1)] 114 C01 456 O=C(C1=C([O-])C(=O)N([C@@H]1c1ccc(c(c1)Cl)Cl)Cc1ccco1)c1cccs1 O=[C]([C]1[C](=O)C(=O)N([C@@H]1[C]1[CH][CH][C]([C]([CH]1)Cl)Cl)CC1=[CH][CH]=CO1)C1=[CH][CH]=CS1 Cl[C]1[CH][CH][C]([CH][C]1Cl)[C@@H]2[C](C(=O)C(=O)N2Cc3occc3)C(=O)c4sccc4 InChIKey=KGMFTYDBGUDSLX-QGZVFWFLSA-N InChI=1S/C20H12Cl2NO4S/c21-13-6-5-11(9-14(13)22)17-16(18(24)15-4-2-8-28-15)19(25)20(26)23(17)10-12-3-1-7-27-12/h1-9,17H,10H2/t17-/m1/s1 InChI=1/C20H12Cl2NO4S/c21-13-6-5-11(9-14(13)22)17-16(18(24)15-4-2-8-28-15)19(25)20(26)23(17)10-12-3-1-7-27-12/h1-9,17H,10H2/t17-/m1/s1 3093.6091643842 -2434.7177465 1-A 11372.2478 111 345 456 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -104.75288 -104.74494 -91.87412 -20.53999 -20.40834 -20.38283 -20.36944 -15.47779 -11.22580 -11.22416 -11.21334 -11.19571 -11.19394 -11.19142 -11.18044 -11.17461 -11.16872 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431.98641 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 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 18.2633 20.6288 22.4800 27.1279 28.6900 41.2988 49.9665 66.6543 84.1825 92.4095 120.9207 137.9049 166.7858 184.9152 200.7975 217.1942 227.6349 245.4491 256.0543 296.1493 307.4097 326.9227 358.2784 378.2485 384.0255 412.2209 425.3038 482.0038 491.5094 502.6803 532.9422 566.5714 583.2813 627.2252 637.3691 649.6144 662.4804 663.2794 702.8829 732.9836 764.4775 773.3228 791.5612 801.4803 806.4573 815.8223 832.3613 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5.4283 6.9166 6.3924 4.4396 1.5354 1.3470 1.7731 5.9567 3.1938 1.5283 2.0726 1.8132 1.3791 2.4903 4.6206 1.4248 1.5640 1.9250 4.0829 5.0951 1.5865 2.0792 3.4032 3.0409 2.2805 2.6224 2.2533 2.1825 2.5525 2.6084 2.6355 2.7851 1.5797 2.0028 1.3698 1.8519 1.8796 2.0322 1.6412 2.4278 2.8808 1.9910 2.7008 1.1730 6.4420 2.6121 5.1486 5.5414 6.3207 5.6920 6.0951 12.7705 12.7642 12.0881 1.0842 1.0600 1.1070 1.0897 1.0900 1.0955 1.0927 1.0950 1.0993 1.0924 1.0994 1.1058 0.0018 0.0016 0.0022 0.0028 0.0027 0.0082 0.0164 0.0331 0.0321 0.0444 0.0919 0.0733 0.1475 0.1357 0.1477 0.6117 0.2669 0.2467 0.2943 0.3900 0.5734 0.5407 0.1805 0.5654 0.6957 0.6394 0.7645 1.1067 0.7058 0.6362 1.5885 1.3163 1.3836 1.0915 1.3490 1.7663 1.2179 1.0311 1.3459 2.2992 2.0057 1.8554 0.4778 2.0483 1.5945 1.4266 1.2940 0.6953 2.3492 3.2615 3.1556 2.2320 0.7977 0.7206 0.9860 3.3241 1.7935 0.8986 1.2553 1.1395 0.8781 1.6224 3.1096 0.9871 1.1208 1.4300 3.0346 4.0018 1.3529 1.7923 2.9426 2.7621 2.1091 2.4903 2.1526 2.1366 2.5774 2.7464 2.7996 3.0301 1.7681 2.2858 1.5806 2.3512 2.4325 2.7041 2.2241 3.3758 4.1949 2.9133 4.0708 1.8151 10.1183 4.1538 8.7300 10.0376 11.5723 10.7886 11.6919 24.7152 28.6144 27.3838 6.4970 6.5853 7.0845 7.3079 7.3382 7.4460 7.4951 7.5210 7.6170 7.5712 7.7519 7.8660 0.3106 0.2226 0.5343 0.6516 2.0202 0.1414 1.2038 4.3676 0.9723 2.1003 0.5085 1.7129 1.1434 1.1563 1.1954 0.1962 0.3544 0.2529 3.4982 0.9039 0.9123 2.7886 0.9889 12.1687 3.3383 1.0825 1.5403 2.2469 0.5656 13.5723 12.4558 10.2530 26.9961 19.0030 17.5399 15.5979 12.5496 6.4323 10.6372 11.9260 4.9424 10.9636 41.5735 10.6113 18.5439 2.4429 120.9628 56.4791 14.8112 5.8354 9.2976 10.3456 14.9657 38.3051 0.9481 4.6644 24.5793 3.7170 4.7956 11.5734 0.8943 9.5999 4.5371 0.6338 26.4350 6.6730 34.5736 22.7663 15.5564 13.1948 1.6451 21.0522 40.6783 1.7393 7.3172 13.9006 31.8793 8.2399 26.4232 173.1640 90.4455 52.2128 11.6915 91.4110 29.4801 9.3860 384.9262 409.4155 144.7406 131.6791 243.5206 28.2414 60.3265 59.7798 19.0803 9.2829 4.2880 6.5459 4.0368 430.1463 625.4450 632.5028 44.4978 27.2427 11.7593 8.0714 19.4434 11.6941 0.2889 5.5085 12.9137 9.8767 0.2179 7.1680 4.1985 3.1562 1.1987 1.8149 2.5014 4.0804 3.6109 2.7667 0.7629 1.4265 0.3910 2.3450 0.7467 5.5570 1.0500 1.4194 0.4857 1.7674 0.9939 3.0986 2.9849 1.6585 1.2390 2.4922 2.2824 1.0894 5.5980 4.2158 0.2921 0.7248 9.7616 3.1719 2.7939 2.7567 2.5193 4.6274 2.2440 2.7506 3.7055 14.6757 1.7118 0.2498 2.1639 5.3593 2.0551 0.9847 1.9480 3.5309 1.1820 6.1111 1.9249 5.8304 1.2575 0.6343 5.6659 3.1929 4.8365 1.5211 5.2768 1.9030 4.6987 3.4953 2.8075 1.1795 0.7888 2.0576 5.6967 3.1111 7.0540 14.9084 4.4764 1.8169 4.2396 10.0604 0.6812 2.8947 10.1859 10.3394 3.6184 9.7372 20.1460 1.1845 0.5375 9.5768 3.4741 11.0906 15.4604 23.2297 10.9547 0.7527 16.1992 19.8352 116.1671 0.6313 64.3089 15.3083 5.0518 37.3467 9.8906 75.9937 48.1355 43.7955 40.1876 79.9166 49.1178 37.6728 118.9734 111.0037 32.6112 65.1964 181.0273 91.2115 26.8411 100.1659 0.7419 0.7498 0.5941 0.6990 0.7279 0.7330 0.7438 0.6952 0.6267 0.7458 0.5183 0.7491 0.5906 0.7095 0.7499 0.7262 0.5465 0.5029 0.3695 0.4188 0.2191 0.1760 0.6003 0.7497 0.3720 0.5762 0.0624 0.7153 0.7496 0.4910 0.4082 0.5320 0.6403 0.2071 0.6976 0.1455 0.4738 0.4801 0.7438 0.1218 0.6161 0.7092 0.7240 0.6271 0.6842 0.2755 0.5202 0.5991 0.5640 0.1074 0.6852 0.1623 0.6803 0.7393 0.1843 0.7469 0.6045 0.7500 0.4389 0.4100 0.7006 0.2620 0.6519 0.7077 0.3356 0.2202 0.1345 0.5533 0.6565 0.1162 0.6637 0.5461 0.1794 0.2510 0.6990 0.2236 0.0425 0.7155 0.4756 0.7194 0.3300 0.2827 0.5907 0.7352 0.7399 0.2550 0.5410 0.4032 0.6771 0.5134 0.2347 0.5458 0.2837 0.7469 0.2388 0.3628 0.3261 0.6142 0.4088 0.6382 0.2833 0.2677 0.1735 0.0639 0.6131 0.5952 0.5323 0.1943 0.2227 0.3147 0.2119 0.5323 0.1986 0.1540 0.8518 0.8570 0.7454 0.8228 0.8425 0.8459 0.8531 0.8202 0.7705 0.8544 0.6827 0.8566 0.7426 0.8300 0.8571 0.8414 0.7068 0.6692 0.5396 0.5904 0.3595 0.2993 0.7502 0.8569 0.5423 0.7311 0.1175 0.8340 0.8569 0.6586 0.5797 0.6945 0.7807 0.3431 0.8219 0.2540 0.6429 0.6488 0.8531 0.2171 0.7624 0.8299 0.8399 0.7708 0.8125 0.4320 0.6844 0.7493 0.7212 0.1940 0.8132 0.2793 0.8097 0.8501 0.3113 0.8551 0.7535 0.8571 0.6101 0.5816 0.8239 0.4152 0.7893 0.8288 0.5026 0.3610 0.2372 0.7124 0.7926 0.2082 0.7978 0.7064 0.3043 0.4013 0.8229 0.3655 0.0815 0.8342 0.6446 0.8368 0.4963 0.4408 0.7427 0.8474 0.8505 0.4063 0.7022 0.5747 0.8074 0.6785 0.3802 0.7061 0.4421 0.8551 0.3856 0.5324 0.4919 0.7610 0.5804 0.7791 0.4415 0.4224 0.2957 0.1202 0.7601 0.7462 0.6948 0.3254 0.3643 0.4788 0.3497 0.6948 0.3314 0.2669 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 6 6 6 8 6 6 7 6 1 6 6 6 8 8 6 8 6 6 6 6 16 6 6 6 6 6 6 17 17 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 14.00307 12.00000 1.00783 12.00000 12.00000 12.00000 15.99491 15.99491 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 31.97207 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 34.96885 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 10445.2229 13258.4411 18528.4351 0.99683 -0.07949 0.00159 0.07948 0.99682 0.00498 -0.00198 -0.00484 0.99999 1 0.00829 0.00653 0.00467 0.17278 0.13612 0.09740 26.28 29.68 32.34 39.03 41.28 59.42 71.89 95.90 121.12 132.96 173.98 198.41 239.97 266.05 288.90 312.49 327.52 353.15 368.41 426.09 442.29 470.37 515.48 544.22 552.53 593.09 611.92 693.50 707.17 723.24 766.78 815.17 839.21 902.44 917.03 934.65 953.16 954.31 1011.29 1054.60 1099.91 1112.64 1138.88 1153.15 1160.31 1173.79 1197.58 1225.07 1233.10 1287.16 1316.97 1329.07 1351.05 1370.95 1397.74 1400.24 1404.64 1437.28 1458.77 1485.92 1495.64 1512.92 1537.71 1560.13 1586.75 1615.54 1615.97 1661.18 1730.91 1740.30 1742.97 1786.43 1802.63 1826.62 1832.09 1854.64 1883.56 1923.38 1931.90 1955.16 1983.05 2002.48 2013.45 2112.01 2132.39 2162.24 2182.03 2210.31 2261.91 2267.36 2301.24 2331.69 2349.15 2363.75 2440.80 2522.74 2536.27 2580.60 2596.10 2607.64 2806.50 2821.21 4588.53 4672.02 4741.78 4854.17 4863.54 4886.88 4909.24 4912.39 4934.05 4934.69 4977.27 4999.25 0.298942 0.321916 0.322860 0.240652 -2434.418805 -2434.395830 -2434.394886 -2434.477094 2.757270D-04 MUNgauss RevisionA2.1 retrievium 20-May-2021 DUDE c1cc(oc1)CN2[C@@H](C(=C(C2=O)[O-])C(=O)c3cccs3)c4ccc(c(c4)Cl)Cl C34934456 RHF 6-31G(d) (6D,10F) C1 431.986410 |X|Y|Z| 64.561835 75.561263 38.657128 57.345791 23 6 7 8 16 20 1 1 1 |36.858105| |13.232063|36.858105| |8.573596|14.197332|36.858105| |8.636383|8.631886|14.106471|73.516695| |14.230011|8.594392|8.765678|25.194951|36.858105| |5.127861|7.301922|12.674262|13.915031|5.322838|36.858105| |4.261074|5.809523|7.677191|9.829147|4.248701|13.204993|53.358707| |3.524320|4.303664|5.420953|8.260026|3.672916|7.439805|17.793165|36.858105| |3.169213|3.767381|4.811150|7.697589|3.386474|6.844987|12.544900|17.527120|0.500000| |2.988286|3.599117|4.096175|6.247135|2.985328|5.110501|11.154174|12.529103|0.241146|36.858105| |3.090289|3.866711|4.169265|6.035761|2.952697|5.119151|11.119114|7.901349|0.167501|13.441488|36.858105| |3.844361|5.275112|5.832989|7.603038|3.596824|7.810867|19.161757|8.072104|0.172911|8.082933|12.371237|36.858105| |3.949019|5.601223|5.619756|7.181271|3.528441|6.802631|11.456178|5.431172|0.128175|5.404522|7.714032|15.855626|73.516695| |2.738044|3.342790|3.437162|5.084889|2.573586|3.989740|7.501720|5.283472|0.122691|7.883007|15.794423|7.978434|11.710402|73.516695| |2.505465|2.879500|3.194694|5.133590|2.527444|3.756163|6.982736|7.269163|0.175465|13.355422|7.581847|5.087006|6.948659|11.022076|36.858105| |2.268131|2.574619|2.761138|4.452831|2.252769|3.134950|5.562432|5.098497|0.125881|8.092840|6.447658|4.317889|6.245673|11.121995|15.732233|73.516695| |2.314396|2.582432|2.919486|4.905685|2.404504|3.400292|5.830455|6.208487|0.173528|7.498115|4.926881|3.927107|5.612089|7.431707|12.507605|14.657734|36.858105| |2.133232|2.314852|2.570514|4.437883|2.227323|2.863517|4.674089|4.611361|0.126989|5.171037|3.820883|3.175320|4.711262|6.048356|7.476488|11.523617|14.137325|36.858105| |1.955209|2.090194|2.334215|4.121541|2.071120|2.589145|4.036386|3.833810|0.111876|3.965588|3.087561|2.702702|4.106477|4.936039|5.024806|7.932794|8.181582|13.277577|36.858105| |1.961096|2.113722|2.399786|4.233809|2.092087|2.732033|4.204508|4.000399|0.124715|3.978784|3.097001|2.770049|4.207526|4.889559|4.771978|7.239285|7.648300|8.235895|14.163410|36.858105| |2.190572|2.436856|2.819333|4.810572|2.316683|3.387346|5.462240|5.533063|0.186162|5.579270|4.061048|3.552056|5.212321|6.161242|6.601108|8.968745|10.956822|7.487387|7.476886|11.032957|388.023441| |3.804509|4.330197|5.415106|9.238508|4.152898|6.077858|10.537365|12.434360|0.250207|7.382846|5.371711|5.482818|7.475523|7.247880|5.838623|7.854298|5.662120|4.773161|4.011091|3.979383|34.331907|36.858105| |3.442248|3.691310|4.634884|8.842374|3.975765|5.045437|7.422965|7.503495|0.206903|5.131535|3.955147|4.070500|5.939281|5.677825|4.588866|6.450363|5.090149|4.608484|4.249805|4.331066|34.629740|13.766280|36.858105| |3.328983|3.351397|3.987604|8.093589|3.927406|3.959944|5.560897|4.986492|0.134239|3.906172|3.203060|3.277609|4.997804|4.806580|3.681619|5.500025|4.074041|4.040634|3.861445|3.756979|27.216368|7.897491|13.746954|36.858105| |3.526536|3.441472|3.872434|7.760484|4.057027|3.624055|5.166621|4.404915|0.111416|3.683326|3.131093|3.179328|4.918790|4.785642|3.488142|5.395336|3.656735|3.715703|3.413967|3.184935|23.008894|6.821122|7.952907|13.816592|36.858105| |3.930761|3.950830|4.302235|8.041836|4.258040|3.958243|5.950020|4.992208|0.116928|4.306156|3.712715|3.735286|5.696243|5.624458|3.956453|6.146958|3.854863|3.804128|3.287365|3.036117|22.912828|7.902209|6.910868|7.966579|13.697498|36.858105| |4.107990|4.526343|5.130717|8.749733|4.308421|5.025257|8.396534|7.496210|0.155958|6.142001|5.047259|5.047570|7.205567|7.171808|5.153351|7.566892|4.683585|4.271762|3.522354|3.320126|26.854182|13.697054|7.997857|6.902809|7.935860|13.809066|36.858105| |3.690541|3.557795|3.541825|6.468591|3.741100|3.160228|4.673571|3.648579|0.087134|3.438036|3.190030|3.175723|5.080198|5.109034|3.246225|5.385326|3.065799|3.097553|2.697017|2.463787|18.265752|4.765617|4.236183|4.753291|6.965214|10.942760|7.083624|448.794386| |3.018489|2.815932|3.029472|6.138880|3.441292|2.789425|3.861792|3.139712|0.082001|2.770520|2.452037|2.483617|3.983049|3.887666|2.700057|4.355754|2.843940|2.989649|2.864915|2.656351|18.387457|4.200104|4.775798|7.077680|10.927940|6.938023|4.736751|47.528599|448.794386| |17.790835|8.435757|5.841363|10.456728|8.834682|4.024566|4.795506|3.000983|0.075420|2.642040|2.758038|3.316742|6.156259|4.460116|2.264983|3.711727|2.092801|1.953577|1.794994|1.787323|14.011686|3.226968|2.948872|2.916622|3.151646|3.508385|3.555227|28.199324|22.608893|0.500000| |8.409843|17.810797|8.868494|10.467180|5.847255|6.357496|7.642358|4.080511|0.098412|3.616526|4.119823|5.764346|12.080590|6.502248|2.879982|4.655719|2.518909|2.246369|2.011058|2.027671|16.734088|3.903439|3.268113|2.949752|3.041457|3.540466|4.119565|26.527837|20.254679|0.191890|0.500000| |8.612412|5.812011|6.029217|16.496651|17.831865|4.266245|4.822849|3.220947|0.084276|2.657337|2.585745|3.034029|5.254222|4.055597|2.312618|3.688996|2.246789|2.117862|1.998708|2.014181|15.513101|3.717079|3.748743|3.905209|4.057617|4.028501|3.850393|28.875598|29.252362|0.195220|0.122929|0.500000| |4.470929|5.588799|9.031030|13.742244|5.036130|17.594507|12.550706|7.208732|0.213034|4.726137|4.384272|5.813406|8.934459|6.184206|3.641509|5.338019|3.484195|2.943896|2.729919|2.945450|25.959663|6.215226|5.752813|4.361758|3.761072|3.882896|4.758002|24.189151|23.161542|0.099373|0.133185|0.118056|0.500000| |4.595836|6.529361|8.998529|10.720632|4.547868|17.604895|12.653431|5.739137|0.154349|4.465044|4.770949|7.415324|13.342201|6.911831|3.372961|5.139971|3.035021|2.566093|2.342358|2.488368|21.898103|4.598332|3.971335|3.244254|3.005808|3.252729|3.976726|21.869978|19.356449|0.103897|0.173308|0.103493|0.301770|0.500000| |2.105160|2.266096|2.465600|4.252676|2.174910|2.677287|4.360997|4.136264|0.108903|4.761277|3.684273|3.034997|4.555877|5.990191|6.769928|11.799471|8.975514|17.757883|8.568823|5.728419|37.844479|4.417057|4.139788|3.809790|3.714554|3.917787|4.284420|26.661920|24.472720|0.054070|0.061450|0.057544|0.075046|0.066816|0.500000| |1.820187|1.917781|2.116705|3.780170|1.929299|2.298789|3.510287|3.212501|0.092435|3.293183|2.667279|2.371736|3.668000|4.340216|4.023800|6.654741|5.707782|8.583372|17.727771|8.914687|37.751927|3.440216|3.696348|3.556544|3.220329|3.047747|3.139162|20.651393|22.697085|0.046821|0.051221|0.052264|0.067125|0.058115|0.200773|0.500000| |1.833503|1.958755|2.220063|3.960744|1.966151|2.509913|3.746663|3.423092|0.107824|3.326125|2.692514|2.472394|3.825576|4.299965|3.799255|5.928612|5.387126|5.683575|8.761323|17.777698|55.237761|3.413447|3.807818|3.403291|2.875084|2.692154|2.882985|17.812595|19.844453|0.046578|0.052071|0.053039|0.075934|0.064235|0.122395|0.203574|0.500000| |3.104330|3.356085|4.251515|8.053860|3.579829|4.914168|6.982445|6.968590|0.230071|4.803758|3.719846|3.843239|5.666801|5.382873|4.360681|6.116895|5.078186|4.483080|4.383735|4.822168|39.493502|8.932282|17.724026|8.957963|5.666254|4.972278|5.668199|27.447231|31.741252|0.074268|0.083426|0.094493|0.166702|0.110612|0.107365|0.104385|0.120411|0.500000| |2.964657|2.933882|3.448879|7.114234|3.522768|3.436602|4.683901|4.070827|0.114789|3.295214|2.757488|2.823007|4.395818|4.219677|3.175784|4.839607|3.597723|3.651209|3.699909|3.665804|25.316671|5.628307|8.894988|17.743898|8.976747|5.665341|4.969563|31.487876|54.541781|0.073202|0.072152|0.100549|0.107054|0.080555|0.094873|0.097274|0.095600|0.215631|0.500000| 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