Version2.4 2021-05-20T04:51:23Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 10-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)c1ccc(cc1)C2=NC3=NN=C([C@H]3C(=C2)C(=O)[O-])c4ccc(cc4)Br C20492237 RHF 6-31G(d) (6D,7F) CC(C)c1ccc(cc1)C2=NC3=NN=C([C@H]3C(=C2)C(=O)[O-])c4ccc(cc4)Br C01[X(C22H17Br1N3O2)] 129 C1 469 Brc1ccc(cc1)C1=NN=C2[C@@H]1C(=CC(=N2)c1ccc(cc1)C(C)C)C(=O)[O-] Brc1ccc(cc1)C1=NN=C2[C@@H]1C(=CC(=N2)c1ccc(cc1)C(C)C)C(=O)[O-] CC(C)c1ccc(cc1)C2=NC3=NN=C([C@H]3C(=C2)C([O-])=O)c4ccc(Br)cc4 InChIKey=UEZLPTLSLBPPHO-LJQANCHMSA-M InChI=1S/C22H18BrN3O2/c1-12(2)13-3-5-14(6-4-13)18-11-17(22(27)28)19-20(25-26-21(19)24-18)15-7-9-16(23)10-8-15/h3-12,19H,1-2H3,(H,27,28)/p-1/t19-/m1/s1 InChI=1/C22H18BrN3O2/c1-12(2)13-3-5-14(6-4-13)18-11-17(22(27)28)19-20(25-26-21(19)24-18)15-7-9-16(23)10-8-15/h3-12,19H,1-2H3,(H,27,28)/p-1/t19-/m1/s1/fC22H17BrN3O2/q-1 CC(C)c1ccc(cc1)C2=NC3=NN=C([C@H]3C(=C2)C(=O)[O-])c4ccc(cc4)Br C01[X(C22H17Br1N3O2)] 129 C01 469 Brc1ccc(cc1)C1=NN=C2[C@@H]1C(=CC(=N2)c1ccc(cc1)C(C)C)C(=O)[O-] O=[C]([O])C1=CC(=NC2=NN=C([C@@H]12)[C]1[CH][CH][C]([CH][CH]1)Br)[C]1[CH][CH][C]([CH][CH]1)C(C)C CC(C)[C]1[CH][CH][C]([CH][CH]1)C2=NC3=NN=C([C]4[CH][CH][C](Br)[CH][CH]4)[C@H]3C(=C2)C([O])=O InChIKey=OFJKVDTXVCTWKM-LJQANCHMSA-N InChI=1S/C22H17BrN3O2/c1-12(2)13-3-5-14(6-4-13)18-11-17(22(27)28)19-20(25-26-21(19)24-18)15-7-9-16(23)10-8-15/h3-12,19H,1-2H3/t19-/m1/s1 InChI=1/C22H17BrN3O2/c1-12(2)13-3-5-14(6-4-13)18-11-17(22(27)28)19-20(25-26-21(19)24-18)15-7-9-16(23)10-8-15/h3-12,19H,1-2H3/t19-/m1/s1 2695.2775820283 -3725.9699584 1-A 23482.4991 111 358 469 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -489.98156 -64.39312 -58.53254 -58.53082 -58.53070 -20.34517 -20.34261 -15.48132 -15.46747 -15.46115 -11.21049 -11.20792 -11.19706 -11.19043 -11.18421 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631.4153 676.0869 693.2361 701.0022 704.8436 750.3861 778.0844 791.1673 805.5248 820.9195 839.4616 859.6610 887.5520 938.1990 950.2070 950.7491 959.3075 965.3433 968.7592 987.5518 998.5274 1004.4721 1012.4883 1041.6308 1063.3291 1096.4459 1098.8666 1107.1665 1111.8975 1113.6553 1117.1942 1155.1677 1163.7245 1165.9183 1174.8669 1198.0844 1201.6924 1211.2728 1213.7146 1224.4325 1254.5216 1291.2740 1299.4490 1312.3249 1317.3383 1320.6692 1343.2054 1351.3520 1409.0517 1448.7074 1455.7522 1465.4958 1481.0616 1492.6098 1502.1582 1507.0875 1524.9167 1552.6701 1557.5958 1568.0653 1582.5999 1632.7335 1638.0400 1647.5836 1652.7192 1671.8922 1694.5437 1740.2192 1751.6171 1767.1923 1794.4524 1805.1685 1817.1215 1824.3313 1841.4748 1926.2051 3177.2572 3194.7463 3196.5264 3203.5435 3252.5289 3260.3260 3270.9420 3274.7297 3348.7924 3357.5117 3386.6374 3390.0530 3400.3258 3402.8048 3414.4057 3418.4569 3437.6773 7.6286 3.4421 6.6783 4.7127 3.7042 5.3999 6.9271 9.0399 8.3279 5.6925 8.1461 8.0992 5.6157 7.9211 4.0214 4.7390 1.1200 4.6079 2.4439 1.7826 4.7070 7.2872 3.1906 4.5071 5.5431 7.1421 5.1644 2.9664 3.3175 6.1463 7.1252 3.4892 3.5950 5.0943 5.7519 3.0714 3.5606 4.1072 6.9781 6.5803 6.4415 6.4052 4.5750 5.1345 3.8181 7.1525 3.7648 6.9519 6.4028 1.9273 2.1442 1.6296 1.7471 2.5618 2.0007 1.8154 5.7138 2.0153 1.1518 1.5631 5.3206 1.4314 4.5930 4.6025 1.4040 1.3857 3.1303 3.4273 1.3964 1.6834 2.5704 2.9213 1.8674 2.0160 2.3421 2.1280 2.3080 3.1311 1.7409 1.4997 1.2477 1.6200 2.3017 1.9980 3.7385 1.5330 3.7656 1.3646 1.3242 1.9214 2.8116 4.6116 3.2292 1.2668 2.4396 1.3678 1.9804 1.0463 1.0502 1.0503 1.0638 2.2716 2.4036 8.3286 6.5360 6.7719 6.9522 6.4944 7.2296 7.8014 8.3726 12.5967 1.0797 1.0376 1.0687 1.0534 1.1011 1.1010 1.1034 1.1028 1.0907 1.0899 1.0949 1.0914 1.0938 1.0948 1.0933 1.0944 1.0897 0.0009 0.0008 0.0031 0.0052 0.0050 0.0126 0.0211 0.0396 0.0529 0.0475 0.1004 0.1296 0.1043 0.1727 0.1129 0.1524 0.0421 0.1786 0.1090 0.0839 0.2520 0.4908 0.2406 0.4041 0.5614 0.7780 0.6241 0.3666 0.4204 0.8124 1.0431 0.5660 0.6864 0.9937 1.2125 0.7058 0.8364 1.1061 1.9758 1.9052 1.8855 2.1250 1.6319 1.8936 1.4597 2.8399 1.5631 3.0270 2.9717 0.9995 1.1406 0.8679 0.9473 1.4066 1.1063 1.0431 3.3566 1.1980 0.6957 0.9992 3.5444 1.0139 3.2676 3.3241 1.0227 1.0126 2.3020 2.6946 1.1142 1.3483 2.0904 2.4706 1.5888 1.7427 2.0327 1.8797 2.1402 3.0759 1.7319 1.5217 1.2757 1.6648 2.4467 2.1497 4.3732 1.8956 4.7017 1.7268 1.7114 2.5221 3.7379 6.1714 4.4242 1.7993 3.4872 1.9816 2.9225 1.6434 1.6602 1.6797 1.7120 3.7411 4.0665 14.8603 11.8153 12.4603 13.1897 12.4689 14.0648 15.2979 16.7279 27.5367 6.4215 6.2394 6.4340 6.3696 6.8629 6.8957 6.9552 6.9681 7.2066 7.2387 7.3990 7.3901 7.4514 7.4687 7.5097 7.5347 7.5875 3.1875 0.0809 1.2766 1.6420 0.0773 0.6971 0.7934 1.8693 7.6386 1.0190 5.1906 3.8047 2.6472 19.6920 1.5661 1.7036 0.2729 5.0130 0.7415 0.1990 1.6775 13.4586 0.6639 0.6081 0.7204 2.9906 0.4049 0.3120 1.6016 10.9903 27.9502 2.9142 7.7913 12.8224 8.3241 10.3237 3.6736 2.4762 1.8977 1.9475 1.8571 12.8559 7.3585 23.7205 1.9084 65.5011 7.6994 32.1083 42.6007 40.9001 1.4209 4.7752 35.4830 2.0977 15.7123 41.8710 4.8782 22.2981 0.3935 0.0223 22.8466 5.4756 53.1976 14.9538 1.4019 0.3954 1.3816 45.0019 21.9398 13.9918 15.5386 2.6094 9.4606 21.4853 1.3757 0.7631 7.9337 2.8202 3.6610 20.1699 0.6518 9.3135 3.5961 11.6015 144.2823 15.4023 0.4028 1.0660 2.3557 23.9821 85.4780 502.9789 88.0367 2.1529 20.7229 9.8387 28.0306 0.0212 1.4785 4.9378 4.6119 76.1617 3.6148 118.6654 10.9937 19.1673 16.8580 33.5139 226.9356 147.0179 408.3088 566.7619 0.6843 31.2253 36.1676 56.0391 4.9600 135.0188 29.2344 51.0229 37.4175 33.0306 90.0753 21.3186 8.5229 16.6925 2.6732 3.3411 3.8120 0.5051 2.4995 1.5044 2.4863 8.2790 0.6088 0.6738 0.0585 1.2862 0.7416 3.7450 2.5178 1.6948 1.2447 1.3759 1.4821 0.1282 0.9710 0.4433 1.0955 4.4212 3.9940 1.4303 2.6479 3.0630 0.7788 3.8930 0.9081 4.2459 9.5772 1.1482 1.6607 2.9751 3.8561 2.6175 1.8266 1.6763 8.2891 9.1259 4.5443 9.6356 12.7447 20.2820 2.0880 2.5748 4.9081 21.5525 22.1919 4.2282 0.9632 1.6648 5.9822 1.5212 8.3781 5.2253 3.3138 8.5079 4.9293 0.5452 10.5376 4.1574 3.6756 3.1365 62.1556 2.1044 2.2733 47.2396 114.0788 8.9357 12.5364 9.3018 78.3624 11.7506 4.6865 26.0599 6.6111 2.5819 23.4682 13.3075 23.9988 83.9087 15.1521 91.6660 6.2912 196.4434 22.7004 309.0312 21.1145 14.5392 44.2453 3.6562 7.0948 144.5538 1.1712 48.1940 9.6380 54.6288 30.0287 4.4512 37.7789 13.4624 20.1125 113.8934 611.1189 347.9655 107.5370 76.4536 2055.8487 880.0539 38.5846 378.6686 2.0402 54.2383 3.1452 109.1056 267.2853 9.3643 242.0668 34.3089 56.2203 103.1965 84.4729 56.3086 108.8042 47.4993 86.6796 55.2468 76.4644 71.0181 0.7040 0.6970 0.6737 0.6987 0.7194 0.6708 0.7331 0.7308 0.7488 0.7499 0.3143 0.6306 0.3340 0.3999 0.7500 0.7448 0.7047 0.7418 0.2699 0.5677 0.7289 0.2525 0.4515 0.7242 0.7048 0.7499 0.4540 0.4736 0.3267 0.3275 0.7498 0.0219 0.3428 0.2888 0.7299 0.3697 0.6910 0.2988 0.7456 0.7095 0.6910 0.1331 0.3442 0.3734 0.7492 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0.8570 0.8552 0.8218 0.8495 0.4817 0.5213 0.8563 0.4606 0.3353 0.7075 0.3152 0.8423 0.5364 0.8553 0.5140 0.5615 0.8565 0.2962 0.2634 0.7386 0.4060 0.3483 0.8118 0.4613 0.8239 0.5523 0.5677 0.4544 0.5299 0.8571 0.4862 0.8534 0.5406 0.5479 0.8570 0.4419 0.2991 0.4312 0.8571 0.8569 0.8420 0.4756 0.3962 0.5043 0.3626 0.4605 0.2958 0.2439 0.4822 0.5435 0.8292 0.5743 0.7841 0.5683 0.8563 0.5608 0.0900 0.8560 0.7862 0.8571 0.7857 0.5119 0.5298 0.6468 0.5789 0.5223 0.2698 0.3317 0.3057 0.2533 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 6 6 6 6 6 6 6 6 6 6 7 6 7 7 6 6 1 6 6 6 8 8 6 6 6 6 6 6 35 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 14.00307 14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 78.91834 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 3173.8737 42105.2530 44302.2674 0.99998 0.00671 -0.00207 -0.00671 0.99997 0.00314 0.00210 -0.00313 0.99999 1 0.02729 0.00206 0.00196 0.56862 0.04286 0.04074 20.56 28.71 40.08 62.14 68.94 90.42 103.38 124.11 149.37 171.17 208.09 237.07 255.41 276.78 314.06 336.17 363.60 368.99 395.91 406.67 433.67 486.43 514.76 561.27 596.51 618.64 651.59 658.93 667.23 681.45 717.18 754.95 819.06 827.86 860.62 898.53 908.47 972.74 997.41 1008.59 1014.11 1079.64 1119.49 1138.31 1158.97 1181.12 1207.80 1236.86 1276.99 1349.86 1367.14 1367.92 1380.23 1388.91 1393.83 1420.87 1436.66 1445.21 1456.74 1498.67 1529.89 1577.54 1581.02 1592.97 1599.77 1602.30 1607.39 1662.03 1674.34 1677.50 1690.37 1723.78 1728.97 1742.75 1746.26 1761.69 1804.98 1857.86 1869.62 1888.14 1895.36 1900.15 1932.57 1944.29 2027.31 2084.37 2094.50 2108.52 2130.92 2147.53 2161.27 2168.36 2194.01 2233.95 2241.03 2256.10 2277.01 2349.14 2356.77 2370.51 2377.89 2405.48 2438.07 2503.79 2520.19 2542.60 2581.82 2597.23 2614.43 2624.81 2649.47 2771.38 4571.36 4596.53 4599.09 4609.18 4679.66 4690.88 4706.16 4711.61 4818.17 4830.71 4872.62 4877.53 4892.31 4895.88 4912.57 4918.40 4946.05 0.369132 0.391770 0.392714 0.312819 -3725.600826 -3725.578188 -3725.577244 -3725.657139 2.679691D-04 MUNgauss RevisionA2.1 retrievium 20-May-2021 DUDE CC(C)c1ccc(cc1)C2=NC3=NN=C([C@H]3C(=C2)C(=O)[O-])c4ccc(cc4)Br C20492237 RHF 6-31G(d) (6D,10F) C1 434.050413 |X|Y|Z| 39.709039 146.561350 20.654894 49.352664 21 6 7 18 3 |36.858105| |12.410956|36.858105| |7.527276|12.410819|36.858105| |7.519495|12.519866|7.519313|36.858105| |5.307322|7.527636|5.308085|13.695858|36.858105| |4.005467|4.998914|4.006897|7.878113|13.783167|36.858105| |3.720646|4.387269|3.717628|6.753900|7.895352|13.686089|36.858105| |4.304777|4.986237|4.299962|7.881573|6.920058|7.988430|13.692454|36.858105| |6.061541|7.487563|6.062670|13.707213|8.007439|6.912411|7.886422|13.760196|36.858105| |2.897469|3.264451|2.897854|4.415622|5.048963|7.636478|12.751127|7.530118|5.014184|36.858105| |2.584170|2.934187|2.632238|3.804469|4.577524|6.831567|8.053767|5.255085|3.999536|14.917586|53.358707| |2.193163|2.427543|2.225679|3.000183|3.441156|4.579859|5.266872|4.012851|3.179901|8.509720|18.840367|36.858105| |1.972295|2.190805|2.047413|2.633256|3.001779|3.804135|4.122546|3.306419|2.738937|5.685686|11.178570|15.030175|53.358707| |1.761849|1.919436|1.809104|2.258561|2.500535|3.044753|3.336126|2.824827|2.374421|4.427528|7.450419|8.836044|18.569587|53.358707| |1.785205|1.917356|1.796251|2.263166|2.467856|3.001821|3.398312|2.923676|2.423322|4.627245|7.201355|8.432066|11.743023|20.427152|36.858105| |2.056676|2.209768|2.029259|2.681928|2.953145|3.740129|4.436387|3.662484|2.913023|6.765885|10.218214|12.694622|11.196135|11.309734|12.495064|36.858105| |2.024023|2.145598|1.945603|2.578322|2.857296|3.572945|4.076956|3.380876|2.754412|5.763699|8.627200|8.878241|8.773858|8.965163|9.067569|17.444443|0.500000| |2.239161|2.379276|2.183842|2.927275|3.104963|3.893438|5.033509|4.393023|3.338128|7.758381|8.961981|7.725121|7.425195|7.211338|6.978161|12.597484|0.253618|36.858105| |2.632743|2.839825|2.575355|3.651686|3.846468|5.014281|7.439987|6.341722|4.351283|12.962722|10.712542|7.132844|6.790809|5.974255|5.063270|7.828641|0.177359|14.281533|36.858105| |2.063703|2.131284|1.971086|2.540390|2.610064|3.095030|3.830796|3.635654|2.907188|4.968115|5.878604|4.839748|5.326110|5.563270|5.383726|7.110630|0.182697|12.339663|7.707524|36.858105| |1.931054|1.974360|1.813337|2.317777|2.408097|2.825080|3.340972|3.121390|2.581053|4.196521|5.249473|4.390193|4.957293|5.315308|5.193279|6.515004|0.195999|8.244153|5.676491|15.421003|73.516695| |2.063963|2.118161|1.987972|2.501414|2.498077|2.887959|3.599740|3.625428|2.927189|4.387127|5.069794|3.986194|4.567359|4.719037|4.297991|5.175697|0.130249|8.095697|6.625698|15.627692|15.132623|73.516695| |1.593892|1.687199|1.593389|1.949976|2.086223|2.453428|2.741482|2.457334|2.088028|3.491708|5.126731|5.099895|7.185965|10.917690|12.826052|6.964425|0.175323|5.265660|3.932744|4.942024|9.055788|7.261120|36.858105| |1.561213|1.627725|1.530485|1.868893|1.976033|2.294219|2.571783|2.352406|2.011903|3.200086|4.497952|4.180583|5.492271|7.133736|7.542067|5.878872|0.164383|5.054543|3.736604|5.492723|11.220883|7.915460|13.727527|36.858105| |1.409169|1.459193|1.382111|1.649517|1.728212|1.965865|2.171461|2.024166|1.766660|2.600489|3.627556|3.218836|4.338526|5.433738|5.021482|4.115339|0.115805|3.751914|2.973003|4.189468|8.451081|6.535571|7.900625|13.702405|36.858105| |1.313752|1.367329|1.306181|1.534555|1.608617|1.816686|1.983423|1.851660|1.632269|2.344592|3.317004|2.928754|4.114346|5.225431|4.477180|3.525840|0.096599|3.171278|2.606529|3.366621|6.426834|5.443677|6.874893|7.972664|13.846942|36.858105| |1.330683|1.399430|1.342379|1.575238|1.662652|1.887899|2.052747|1.897114|1.668662|2.444631|3.534399|3.184324|4.679673|6.246819|5.073182|3.705997|0.098217|3.209386|2.661984|3.216536|5.907125|5.203265|7.878417|6.855053|7.917226|13.748301|36.858105| |1.455618|1.544905|1.475984|1.761482|1.878038|2.170682|2.378336|2.157392|1.869169|2.918691|4.317344|4.097770|6.222263|9.324400|7.699071|4.832778|0.122906|3.913525|3.165634|3.705733|6.655581|5.823954|13.619285|7.942753|6.886782|8.001478|13.820999|36.858105| |1.168716|1.207311|1.159905|1.335448|1.388010|1.539490|1.661315|1.574838|1.413354|1.905584|2.667091|2.264452|3.167130|3.797673|3.090875|2.614542|0.072450|2.441465|2.090917|2.621471|4.980899|4.395726|4.070836|4.585577|6.679187|9.980712|6.678705|4.600620|2539.412838| |17.526840|8.775480|6.889093|5.482419|4.271364|3.335410|3.091081|3.477708|4.580082|2.496614|3.091465|1.960302|2.432313|2.189678|1.623692|1.843833|0.050521|1.985852|2.290229|1.847182|3.095284|3.289894|1.462470|1.433831|1.304420|1.222388|1.237932|1.346169|37.284265|0.500000| |17.559927|8.761248|5.475183|6.898967|5.410411|4.151018|3.793594|4.230371|5.578466|2.973212|3.616758|2.252291|2.734795|2.443711|1.827896|2.123860|0.058815|2.304261|2.697519|2.127543|3.577026|3.739818|1.630672|1.605483|1.445789|1.340950|1.353009|1.480393|40.528736|0.300862|0.500000| |17.549237|8.740143|6.794527|6.723203|4.668496|3.756684|3.704989|4.535486|6.487817|2.912096|3.465707|2.180188|2.657062|2.393220|1.797327|2.074027|0.056418|2.301603|2.720579|2.148697|3.544623|3.876608|1.612540|1.587943|1.434944|1.334054|1.346205|1.469318|40.417075|0.301596|0.301856|0.500000| |8.952204|17.528010|8.953121|9.016772|7.463980|4.843217|3.995746|4.205578|5.607138|3.059582|3.867993|2.357999|2.927400|2.555569|1.858563|2.125656|0.057761|2.238863|2.626272|1.998431|3.329216|3.491340|1.635314|1.572456|1.412498|1.328457|1.363189|1.504189|39.989061|0.215379|0.213491|0.173748|0.500000| |6.795839|8.739819|17.548717|6.721469|4.668156|3.757220|3.701156|4.528602|6.487497|2.912032|3.530496|2.213245|2.760277|2.459747|1.808899|2.044493|0.054123|2.238893|2.654385|2.040373|3.306396|3.711517|1.611843|1.554156|1.405100|1.325687|1.358739|1.491064|40.086329|0.168878|0.139096|0.200451|0.173755|0.500000| |5.475197|8.761342|17.559651|6.899817|5.412278|4.154153|3.788627|4.223276|5.581088|2.974234|3.741266|2.313654|2.928099|2.563780|1.848400|2.073319|0.054764|2.204537|2.595083|1.963355|3.201750|3.505868|1.629851|1.549866|1.397110|1.327371|1.374273|1.517636|39.993777|0.140790|0.122540|0.139090|0.213495|0.301808|0.500000| |6.888309|8.775798|17.527014|5.482491|4.272075|3.336404|3.089379|3.475079|4.580393|2.496894|3.136117|1.983682|2.508394|2.238833|1.632087|1.823832|0.048909|1.946596|2.251789|1.779253|2.937883|3.190508|1.462087|1.409700|1.282672|1.216227|1.247429|1.362396|37.034556|0.207114|0.140790|0.168799|0.215435|0.301625|0.300855|0.500000| |5.004444|6.999592|5.005903|8.911356|17.693125|8.963589|5.636199|4.974588|5.670524|4.123832|5.411194|3.098999|3.782621|3.170968|2.273604|2.660766|0.072444|2.721313|3.237370|2.321151|3.873369|3.933794|1.940532|1.837178|1.620278|1.517852|1.571175|1.764985|44.883423|0.117763|0.143924|0.116873|0.231272|0.116882|0.144003|0.117800|0.500000| |3.382271|4.083202|3.386870|5.622493|8.921189|17.761136|8.955929|5.677661|4.975939|7.135087|10.529376|5.063315|5.787237|4.486951|3.175700|3.929422|0.105815|3.833293|4.661406|3.010088|4.986584|4.883704|2.558244|2.362695|2.015664|1.869439|1.956633|2.266662|53.627228|0.080952|0.098457|0.087575|0.115164|0.087670|0.098715|0.081039|0.216156|0.500000| |3.727607|4.086303|3.727372|5.644277|4.979913|5.658196|8.881318|17.756097|8.993166|6.906622|6.517407|3.907853|4.391776|3.862327|3.002026|3.749774|0.094628|4.789549|7.070643|4.082732|6.003589|7.567647|2.555271|2.469725|2.124787|1.933034|1.968770|2.231877|55.850584|0.086052|0.101223|0.112990|0.096716|0.112959|0.101228|0.086045|0.107948|0.124374|0.500000| |6.282619|6.913349|6.295214|8.889903|5.664452|4.971888|5.639489|8.978989|17.706085|4.096699|4.549075|2.776980|3.310256|2.935376|2.214592|2.611856|0.068721|3.019566|3.814741|2.728922|4.307769|5.009816|1.945128|1.891391|1.679588|1.555229|1.581694|1.753558|46.266374|0.133699|0.150934|0.212501|0.139865|0.213112|0.151351|0.133844|0.124155|0.107905|0.219346|0.500000| |2.794019|2.954342|2.688108|3.783605|3.769279|4.634301|6.897308|7.091810|4.773808|8.639896|7.718280|5.097103|5.329549|4.850170|4.060083|5.590065|0.136478|9.245677|17.800180|7.329158|9.438427|13.037103|3.383331|3.328574|2.740442|2.406761|2.420552|2.795634|67.240057|0.067020|0.079082|0.082143|0.074288|0.078528|0.073999|0.065080|0.087262|0.114407|0.255131|0.119918|0.500000| |1.661110|1.720380|1.602904|1.987854|2.097293|2.447009|2.777030|2.542353|2.155008|3.482830|4.766318|4.340971|5.364204|6.493621|6.898667|6.502553|0.194192|5.955827|4.216988|7.102144|16.861630|9.392982|8.892271|17.742803|8.944620|5.675736|4.945234|5.637971|130.126414|0.042160|0.047728|0.047073|0.045985|0.045287|0.044803|0.040905|0.053809|0.069530|0.074520|0.056175|0.104620|0.500000| |1.377427|1.413477|1.336713|1.588490|1.652933|1.863010|2.053969|1.936717|1.702885|2.418356|3.319036|2.860620|3.783719|4.532373|4.087727|3.611259|0.103939|3.439176|2.778089|4.013383|8.376269|6.375911|5.635050|8.911437|17.754252|8.932480|5.637610|4.962072|219.008635|0.035483|0.039354|0.039068|0.037961|0.037814|0.037327|0.034568|0.043095|0.052735|0.056617|0.045242|0.072601|0.216315|0.500000| 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