Version2.4 2021-06-06T22:22:43Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 15-Jan-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cc(n(n1)c2nc3c(cnn3c4ccc(cc4)F)c(n2)[O-])NC(=O)c5cc(ccc5Cl)[N+](=O)[O-] C21113023 RHF 6-31G(d) (6D,7F) Cc1cc(n(n1)c2nc3c(cnn3c4ccc(cc4)F)c(n2)[O-])NC(=O)c5cc(ccc5Cl)[N+](=O)[O-] C01[X(C22H13Cl1F1N8O4)] 141 C1 570 Fc1ccc(cc1)n1ncc2c1nc(nc2[O-])n1nc(cc1NC(=O)c1cc(ccc1Cl)[N+](=O)[O-])C Fc1ccc(cc1)n1ncc2c1nc(nc2[O-])n1nc(cc1NC(=O)c1cc(ccc1Cl)[N+](=O)[O-])C Cc1cc(NC(=O)c2cc(ccc2Cl)[N+]([O-])=O)n(n1)c3nc([O-])c4cnn(c5ccc(F)cc5)c4n3 InChIKey=VOHVEWNYVSPTCG-UHFFFAOYSA-M InChI=1S/C22H14ClFN8O4/c1-11-8-18(26-20(33)15-9-14(32(35)36)6-7-17(15)23)31(29-11)22-27-19-16(21(34)28-22)10-25-30(19)13-4-2-12(24)3-5-13/h2-10H,1H3,(H,26,33)(H,27,28,34)/p-1 InChI=1/C22H14ClFN8O4/c1-11-8-18(26-20(33)15-9-14(32(35)36)6-7-17(15)23)31(29-11)22-27-19-16(21(34)28-22)10-25-30(19)13-4-2-12(24)3-5-13/h2-10H,1H3,(H,26,33)(H,27,28,34)/p-1/fC22H13ClFN8O4/h26H/q-1 Cc1cc(n(n1)c2nc3c(cnn3c4ccc(cc4)F)c(n2)[O-])NC(=O)c5cc(ccc5Cl)[N+](=O)[O-] C01[X(C22H13Cl1F1N8O4)] 141 C01 570 Fc1ccc(cc1)n1ncc2c1nc(nc2[O-])n1nc(cc1NC(=O)c1cc(ccc1Cl)[N+](=O)[O-])C F[C]1[CH][CH][C]([CH][CH]1)[N@@]1[N][CH][C]2[C]1[N][C]([N]C2=O)[N]1[N][C]([CH]=C1NC(=O)[C]1[CH][C]([CH][CH][C]1Cl)[N]([O])[O])C C[C]1[N]N([C]2[N][C]3[C]([CH][N]N3[C]4[CH][CH][C](F)[CH][CH]4)C(=O)[N]2)C(=C1)NC(=O)[C]5[CH][C]([CH][CH][C]5Cl)N([O])[O] InChIKey=LUTYIKMHBYARJN-UHFFFAOYSA-N InChI=1S/C22H13ClFN8O4/c1-11-8-18(26-20(33)15-9-14(32(35)36)6-7-17(15)23)31(29-11)22-27-19-16(21(34)28-22)10-25-30(19)13-4-2-12(24)3-5-13/h2-10H,1H3,(H,26,33) InChI=1/C22H13ClFN8O4/c1-11-8-18(26-20(33)15-9-14(32(35)36)6-7-17(15)23)31(29-11)22-27-19-16(21(34)28-22)10-25-30(19)13-4-2-12(24)3-5-13/h2-10H,1H3,(H,26,33)/f/h26H 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507.07323 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 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 8.6712 13.4277 26.5376 29.3546 33.7307 51.2805 57.4979 62.2738 71.8941 98.6217 99.1577 121.7365 127.2372 140.7729 150.2903 155.2769 179.1619 184.8370 223.8868 234.9530 248.3372 256.5841 262.9288 290.0461 313.9925 314.2756 338.7981 345.3015 366.1879 386.8300 408.7397 418.9114 422.3130 434.8431 461.2778 469.2966 478.3268 509.2166 568.1395 572.1271 585.3554 592.6934 619.6357 625.7460 632.4521 685.5372 696.9941 705.0869 725.7990 730.7901 749.2996 765.5760 779.0200 784.1669 796.3694 799.6938 829.6284 835.8940 840.3404 855.1163 863.6850 893.7798 898.2160 902.3049 911.0532 931.9240 944.6273 952.9167 961.5613 974.1251 1033.5320 1034.1452 1052.3385 1064.4872 1070.7283 1081.1389 1083.7149 1107.6867 1113.1297 1125.9388 1127.9423 1152.8703 1170.0712 1185.3287 1196.0581 1212.2157 1224.6454 1233.1959 1246.4195 1268.7957 1278.5631 1282.4070 1284.6709 1306.5992 1310.9370 1339.1754 1372.9301 1395.1473 1398.6482 1414.3042 1434.6306 1453.3542 1473.1261 1524.7706 1532.0027 1549.7474 1557.6956 1579.8397 1588.7667 1601.3066 1628.2174 1633.9198 1636.3940 1654.2869 1661.8139 1699.0020 1712.7734 1731.8637 1759.8643 1767.3896 1777.2957 1793.4409 1799.1629 1816.4879 1824.3948 1868.4629 1903.3299 1953.8827 3201.1900 3248.0263 3299.0122 3384.0613 3388.4046 3407.8453 3430.7648 3437.7461 3438.8449 3440.9995 3443.1849 3493.9141 3538.8666 11.3742 11.6636 6.0780 5.8321 6.3902 11.0265 11.4107 9.9887 6.2624 5.8237 6.3380 1.1981 9.0823 6.4884 4.9667 7.3937 8.5991 9.4670 9.4484 7.6272 5.5165 7.8071 9.6756 10.2727 8.9789 5.8215 10.9192 14.7532 8.1154 5.4807 6.4616 7.1375 6.6464 6.8475 6.9736 3.1810 5.3038 3.7241 6.1809 6.6470 2.6089 6.6814 10.2512 7.2540 7.5331 5.0995 7.2813 5.9692 6.9049 6.7352 7.9449 3.1148 4.0756 7.9377 9.6572 6.4786 9.0792 9.8872 8.6499 4.6173 4.8788 5.9290 2.2689 2.9433 6.7335 1.2819 1.2302 1.5412 1.5302 7.5154 6.4772 1.3833 5.0119 2.4462 1.5814 1.3320 6.0671 1.3577 2.5913 1.3059 2.3615 5.5783 1.5142 2.8942 2.5000 5.3725 3.3749 4.3074 1.9147 3.4905 2.7397 2.0769 1.3593 2.4599 3.3713 2.0830 3.5045 3.9831 1.9631 2.3670 3.4014 1.6066 6.4132 4.3195 2.7502 3.6369 3.1997 3.8176 2.5691 6.0992 1.0456 1.3676 3.0367 4.4158 5.6576 3.2434 5.9469 4.5127 4.2114 7.0230 8.1029 6.2933 7.5346 4.9392 5.6994 12.2012 10.1877 10.9594 1.0391 1.1020 1.1006 1.0924 1.0928 1.0926 1.0977 1.0935 1.0949 1.0933 1.0950 1.0987 1.0850 0.0005 0.0012 0.0025 0.0030 0.0043 0.0171 0.0222 0.0228 0.0191 0.0334 0.0367 0.0105 0.0866 0.0758 0.0661 0.1050 0.1626 0.1906 0.2790 0.2481 0.2004 0.3028 0.3941 0.5092 0.5216 0.3388 0.7385 1.0364 0.6412 0.4832 0.6360 0.7380 0.6984 0.7629 0.8742 0.4128 0.7150 0.5689 1.1755 1.2819 0.5267 1.3829 2.3190 1.6735 1.7753 1.4120 2.0841 1.7485 2.1431 2.1193 2.6281 1.0756 1.4573 2.8758 3.6085 2.4411 3.6818 4.0703 3.5989 1.9893 2.1442 2.7906 1.0785 1.4118 3.2929 0.6559 0.6468 0.8245 0.8336 4.2018 4.0765 0.8716 3.2701 1.6331 1.0682 0.9173 4.1982 0.9815 1.8917 0.9754 1.7702 4.3683 1.2214 2.3958 2.1072 4.6514 2.9822 3.8595 1.7526 3.3107 2.6388 2.0124 1.3218 2.4743 3.4136 2.2009 3.8920 4.5678 2.2626 2.7896 4.1247 1.9994 8.1999 5.9169 3.8031 5.1464 4.5743 5.6139 3.8208 9.2145 1.6332 2.1512 4.7911 7.1199 9.2055 5.5161 10.2788 7.9748 7.6848 12.9252 15.0804 11.9261 14.3699 9.6022 11.1767 25.0970 21.7447 24.6510 6.2739 6.8494 7.0576 7.3709 7.3926 7.4759 7.6122 7.6141 7.6288 7.6268 7.6484 7.9025 8.0059 0.3404 0.5974 0.4430 1.1937 0.6363 0.7005 0.6586 0.2980 0.1604 6.9522 0.6914 0.1618 7.2331 0.0113 1.9488 3.8623 0.1046 1.8132 8.6768 0.6408 0.5989 2.9138 3.0428 6.1910 5.2266 2.2373 0.9580 0.1197 0.0232 11.6778 7.6277 6.2550 6.0546 1.9955 0.6268 0.0070 1.2653 3.3433 5.6657 17.7412 5.0690 4.4212 2.1999 25.6197 35.6111 12.0124 3.6364 5.8683 9.7016 1.8889 33.6431 0.4994 0.2061 39.1329 0.5299 1.0471 31.5944 0.5592 29.8903 44.4264 7.7056 30.7170 4.7949 79.0433 16.6092 8.9361 81.0540 24.2192 91.5284 50.4630 30.0754 1.5616 217.4831 17.0727 29.0469 2.4198 8.5732 0.0795 0.9239 2.0709 40.0665 51.1191 1.7858 34.8154 12.7601 9.9897 50.7103 38.7924 8.8949 21.7495 1.9963 27.2415 22.1557 18.8394 63.0693 71.8466 100.2889 57.2164 34.1093 16.0881 175.4235 63.1756 205.7369 434.0482 274.0006 66.7774 165.8913 63.4393 46.6881 401.3731 3.6500 77.6510 212.6845 93.1837 927.9022 546.8941 179.3335 1039.2970 235.3425 8.2548 366.1544 51.5305 38.2426 250.2646 3.7588 448.9612 1014.2456 325.0013 54.9539 38.0468 19.5885 21.8165 12.6319 3.3822 23.2724 4.7164 31.9565 1.2785 0.7281 1.3642 746.0104 4.2911 2.2449 4.5652 2.3681 3.3945 0.1146 2.6363 0.4137 0.4181 0.6644 0.8288 0.5789 1.2760 0.7252 0.6125 2.2206 0.9000 1.1160 1.2044 1.6692 0.9025 1.6231 1.1808 3.1249 1.8254 3.1552 1.5154 6.1595 1.1668 2.3956 1.6103 2.1650 0.5696 6.7795 0.5806 0.0484 1.2148 0.9537 1.8108 1.3223 0.8458 1.1197 1.6631 2.4519 2.7465 4.7099 9.4194 1.2623 4.6375 2.3854 11.2683 0.3979 3.1083 3.2293 1.0852 5.0482 3.1154 1.3970 4.2617 2.2114 2.4476 26.3359 4.0964 1.3095 12.0975 2.5089 1.3961 2.3304 0.6882 10.4858 5.8861 3.5063 0.4767 4.3255 0.9790 2.5010 15.8182 1.1957 2.9363 0.4940 12.0438 18.3986 1.9968 4.6200 16.6910 17.9101 4.0866 6.6836 1.9440 26.4082 17.2779 2.7182 4.9718 3.3969 4.6799 2.7788 1.7607 3.7756 4.2216 9.5612 128.4003 34.9068 27.1830 72.6811 23.0476 28.2613 28.4514 11.9789 37.1042 81.0811 18.5512 41.3234 83.7988 54.1093 43.3488 145.5075 56.0202 140.4624 112.7107 28.2722 25.6721 77.8027 5.2305 14.9033 143.9269 3.0571 28.0302 55.9691 178.3249 109.5086 67.4241 161.0352 90.6906 90.6842 135.4744 45.4423 96.9246 32.6070 102.8955 56.5254 174.6415 0.7493 0.7492 0.7500 0.7376 0.7346 0.7011 0.6957 0.6615 0.7321 0.6626 0.7272 0.7443 0.6354 0.7471 0.4095 0.6599 0.7494 0.7264 0.7303 0.4377 0.6898 0.5243 0.7370 0.5477 0.4581 0.3188 0.5626 0.1600 0.7415 0.4174 0.6329 0.6496 0.5413 0.7311 0.3912 0.7499 0.7472 0.6374 0.2044 0.7333 0.7500 0.7436 0.6220 0.2883 0.5317 0.4092 0.6869 0.7497 0.5877 0.6209 0.2138 0.5932 0.7500 0.7417 0.6119 0.1492 0.7152 0.7489 0.2640 0.5833 0.7031 0.1498 0.4938 0.4408 0.0889 0.7500 0.5015 0.7363 0.7490 0.1287 0.6143 0.7500 0.6102 0.5607 0.6090 0.7500 0.1338 0.6984 0.2822 0.7499 0.3322 0.0829 0.7496 0.5506 0.4090 0.1829 0.5084 0.7316 0.5897 0.2750 0.3239 0.6819 0.1660 0.6736 0.6689 0.1395 0.3744 0.6299 0.0504 0.6547 0.2428 0.2160 0.6831 0.1658 0.7005 0.1901 0.1909 0.3562 0.5697 0.4951 0.7500 0.6765 0.1516 0.3280 0.4315 0.3025 0.2312 0.1949 0.4756 0.4825 0.3160 0.6787 0.7353 0.7400 0.4389 0.3450 0.2416 0.2099 0.0572 0.7499 0.7312 0.3160 0.3922 0.3657 0.3153 0.2328 0.1765 0.3167 0.2405 0.2987 0.2302 0.8567 0.8566 0.8571 0.8490 0.8470 0.8243 0.8206 0.7963 0.8453 0.7970 0.8420 0.8534 0.7770 0.8553 0.5811 0.7951 0.8568 0.8415 0.8442 0.6089 0.8164 0.6879 0.8486 0.7078 0.6284 0.4834 0.7201 0.2759 0.8516 0.5889 0.7752 0.7876 0.7024 0.8446 0.5623 0.8571 0.8553 0.7785 0.3394 0.8461 0.8571 0.8529 0.7670 0.4476 0.6942 0.5808 0.8144 0.8570 0.7403 0.7661 0.3523 0.7447 0.8571 0.8517 0.7593 0.2596 0.8340 0.8564 0.4178 0.7368 0.8257 0.2606 0.6611 0.6119 0.1633 0.8571 0.6680 0.8481 0.8565 0.2280 0.7611 0.8571 0.7579 0.7185 0.7570 0.8571 0.2361 0.8225 0.4402 0.8570 0.4988 0.1531 0.8569 0.7102 0.5806 0.3093 0.6741 0.8450 0.7419 0.4313 0.4893 0.8109 0.2847 0.8050 0.8016 0.2448 0.5448 0.7730 0.0960 0.7913 0.3907 0.3553 0.8117 0.2844 0.8239 0.3194 0.3206 0.5253 0.7259 0.6623 0.8571 0.8070 0.2632 0.4939 0.6028 0.4645 0.3756 0.3262 0.6446 0.6509 0.4802 0.8086 0.8474 0.8506 0.6100 0.5130 0.3892 0.3469 0.1082 0.8571 0.8447 0.4802 0.5634 0.5356 0.4794 0.3776 0.3000 0.4811 0.3878 0.4600 0.3743 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 6 6 6 7 7 6 7 6 6 6 7 7 6 6 6 6 6 6 9 6 7 8 7 6 8 6 6 6 6 6 6 17 7 8 8 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 14.00307 14.00307 12.00000 14.00307 12.00000 12.00000 12.00000 14.00307 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 12.00000 14.00307 15.99491 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 14.00307 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 10022.3903 36611.4168 43385.7965 1.00000 0.00228 -0.00033 -0.00228 0.99984 0.01770 0.00037 -0.01770 0.99984 1 0.00864 0.00237 0.00200 0.18007 0.04929 0.04160 12.48 19.32 38.18 42.23 48.53 73.78 82.73 89.60 103.44 141.89 142.67 175.15 183.07 202.54 216.23 223.41 257.77 265.94 322.12 338.04 357.30 369.17 378.30 417.31 451.77 452.17 487.45 496.81 526.86 556.56 588.09 602.72 607.61 625.64 663.68 675.21 688.21 732.65 817.43 823.16 842.20 852.75 891.52 900.31 909.96 986.34 1002.82 1014.46 1044.26 1051.44 1078.08 1101.49 1120.84 1128.24 1145.80 1150.58 1193.65 1202.66 1209.06 1230.32 1242.65 1285.95 1292.33 1298.22 1310.80 1340.83 1359.11 1371.03 1383.47 1401.55 1487.02 1487.90 1514.08 1531.56 1540.54 1555.52 1559.22 1593.71 1601.55 1619.97 1622.86 1658.72 1683.47 1705.42 1720.86 1744.11 1761.99 1774.29 1793.32 1825.51 1839.57 1845.10 1848.35 1879.90 1886.15 1926.77 1975.34 2007.31 2012.34 2034.87 2064.11 2091.05 2119.50 2193.80 2204.21 2229.74 2241.18 2273.04 2285.88 2303.92 2342.64 2350.85 2354.41 2380.15 2390.98 2444.48 2464.30 2491.77 2532.05 2542.88 2557.13 2580.36 2588.59 2613.52 2624.90 2688.30 2738.47 2811.20 4605.80 4673.19 4746.54 4868.91 4875.16 4903.13 4936.11 4946.15 4947.73 4950.83 4953.98 5026.96 5091.64 0.366886 0.394205 0.395149 0.303567 -2134.212082 -2134.184763 -2134.183818 -2134.275400 3.071675D-04 MUNgauss RevisionA2.1 retrievium 06-Jun-2021 DUDE Cc1cc(n(n1)c2nc3c(cnn3c4ccc(cc4)F)c(n2)[O-])NC(=O)c5cc(ccc5Cl)[N+](=O)[O-] C21113023 RHF 6-31G(d) (6D,10F) C1 507.073232 |X|Y|Z| 134.267911 68.061960 31.539360 66.055633 28 6 7 21 7 |36.858105| |12.716429|36.858105| |7.287629|13.411205|36.858105| |5.213957|8.701643|14.016567|36.858105| |5.360617|9.004557|8.657308|13.930361|53.358707| |7.849587|14.762639|8.470981|8.526220|19.133333|53.358707| |3.959789|5.503601|5.306520|7.570119|18.287736|10.770022|36.858105| |3.786603|4.845184|4.268858|5.258055|11.239336|9.722013|14.529018|53.358707| |2.991858|3.622973|3.350085|4.054648|7.432955|6.477090|8.714029|19.364604|36.858105| |2.603125|3.147164|3.077862|3.807335|6.412194|5.298922|7.253382|10.703620|13.816800|36.858105| |2.231649|2.592857|2.515566|2.971901|4.800003|4.226133|4.777073|7.375251|8.628893|13.483833|36.858105| |2.242191|2.550160|2.403295|2.760993|4.527590|4.184643|4.343680|7.325092|8.495558|8.505068|14.760707|53.358707| |2.641265|3.035435|2.770049|3.184058|5.506292|5.199039|5.443688|10.738305|14.014145|8.658253|8.942927|18.913847|53.358707| |2.651564|2.926808|2.589546|2.854695|4.873008|4.946806|4.374359|8.422500|7.579929|5.309842|5.511480|10.819267|18.407462|36.858105| |2.248985|2.420525|2.178053|2.363481|3.863542|3.920355|3.338607|5.823923|5.114325|4.176705|4.735494|9.418943|10.738313|13.679453|36.858105| |2.161337|2.258704|2.013701|2.133095|3.428131|3.579370|2.833629|4.782723|3.875869|3.241213|3.524474|6.268731|7.030896|7.901335|13.768851|36.858105| |2.393424|2.447061|2.130485|2.215212|3.578610|3.874086|2.868808|4.858578|3.683386|3.004138|3.095461|5.219446|6.215961|6.894530|8.004053|13.847970|36.858105| |2.891864|2.965119|2.503316|2.594919|4.316726|4.835183|3.431673|6.048615|4.320553|3.336032|3.269773|5.398690|6.994649|7.915226|6.887354|7.945394|13.858489|36.858105| |3.115018|3.365951|2.844488|3.048438|5.306613|5.799683|4.470917|8.742721|6.294341|4.385343|4.163889|7.040243|10.595469|13.672441|7.927617|6.862161|7.982308|13.748215|36.858105| |2.206449|2.200447|1.924522|1.967776|3.105192|3.384428|2.423661|3.945209|2.934094|2.480789|2.546948|4.133052|4.704785|4.643005|5.290043|8.131714|14.217622|8.126624|5.280648|97.533100| |2.676421|3.336858|3.452328|4.527047|7.214638|5.469630|8.142558|9.042658|7.841981|13.189796|7.172351|7.068574|7.280220|3.894100|3.194492|2.628533|2.507829|2.794253|3.507034|4.804895|36.858105| |3.256528|4.327408|4.602118|6.731126|11.291380|7.306439|14.527886|10.904826|7.187256|8.080690|5.073396|5.742070|6.490765|3.719915|2.988451|2.529213|2.495767|2.863933|3.592089|4.813412|13.807615|53.358707| |2.347967|2.860883|3.038382|3.875675|5.686584|4.471887|5.528173|6.357358|5.343206|8.068277|6.004723|5.920574|5.684599|3.205508|2.759589|2.313591|2.193240|2.388995|2.890656|4.277739|15.715203|11.452393|73.516695| |3.810235|5.347710|7.616702|13.756811|10.826396|7.320333|6.397299|6.074456|3.760794|3.818792|2.983494|3.647115|4.039393|2.598050|2.194347|1.965982|2.000884|2.285030|2.669536|4.013908|4.927726|9.853154|7.970086|53.358707| |3.354887|4.344040|6.216254|7.849710|7.088618|5.564226|4.406310|4.617899|2.982358|3.067880|2.513391|3.094232|3.347863|2.195160|1.900398|1.726175|1.755597|1.974340|2.249382|3.574081|3.829513|6.706392|6.612119|19.255094|36.858105| |3.503418|4.365566|6.469062|6.664861|6.148022|5.234460|3.701007|4.062482|2.611699|2.625582|2.202881|2.766155|3.002352|2.013719|1.758472|1.619638|1.662669|1.868596|2.092624|3.420412|3.128989|5.293589|5.372199|11.426529|15.899306|73.516695| |2.661387|3.276399|4.189474|5.118361|5.447820|4.377498|3.759683|4.067766|2.764178|2.972112|2.482831|2.998600|3.147865|2.041554|1.795071|1.623345|1.627223|1.799123|2.042824|3.318838|3.794909|6.111421|7.054397|10.872984|12.583303|14.311597|36.858105| |2.452919|2.988193|3.643029|4.475082|5.106717|4.108065|3.713557|4.063010|2.832995|3.127673|2.624666|3.124221|3.231562|2.072678|1.829651|1.643876|1.633181|1.794026|2.044621|3.321066|4.062087|6.243236|7.866930|8.811122|7.620781|9.895365|13.723503|36.858105| |2.083446|2.460239|2.886046|3.398567|4.078765|3.398953|3.050405|3.481653|2.503857|2.809426|2.444876|2.901883|2.931080|1.886674|1.694537|1.526352|1.503569|1.628730|1.838564|3.073951|3.546632|5.051679|7.209176|6.075988|5.050411|7.341201|7.954910|13.803108|36.858105| |1.919670|2.230385|2.601037|2.982405|3.589468|3.052244|2.664001|3.095865|2.234040|2.488275|2.206376|2.642084|2.654841|1.725685|1.564352|1.418230|1.397124|1.504821|1.683393|2.873640|3.060382|4.309735|6.196639|5.179582|4.417672|6.742569|6.804311|7.893373|13.799176|36.858105| |2.014191|2.342681|2.779009|3.153344|3.704786|3.159005|2.684316|3.101350|2.202882|2.412360|2.123968|2.568546|2.611085|1.709224|1.544006|1.406039|1.394223|1.508664|1.683598|2.873597|2.948459|4.274428|5.794880|5.523927|4.982840|7.740674|7.871728|6.877544|8.028745|13.809889|36.858105| |2.344298|2.786970|3.441795|3.960677|4.423257|3.703780|3.099433|3.486117|2.412513|2.598756|2.233329|2.713217|2.811574|1.840991|1.641581|1.494274|1.493966|1.635440|1.835230|3.069294|3.216709|4.917200|6.101141|7.358018|7.470533|11.066378|13.694862|7.981712|6.966105|7.950402|13.745269|36.858105| |2.385062|2.777889|3.422302|3.716495|4.153442|3.601957|2.829360|3.249949|2.222213|2.331399|2.025569|2.508951|2.623153|1.747433|1.563503|1.437923|1.449300|1.588434|1.763546|2.997877|2.777447|4.269358|5.093125|6.297687|6.102431|10.687906|6.973957|4.757645|4.262703|4.801163|7.128873|10.976802|448.794386| |1.913628|2.226917|2.532647|2.938942|3.670434|3.113639|2.808395|3.293801|2.418974|2.739096|2.440760|2.891987|2.876782|1.851574|1.679239|1.511112|1.478050|1.587518|1.786423|3.024503|3.368836|4.589078|6.934660|4.947207|3.853902|5.838644|5.117169|7.784696|13.079224|7.797116|5.144825|4.545679|25.810404|53.358707| |1.998121|2.331718|2.629754|3.059467|3.868640|3.281987|2.972784|3.493607|2.561018|2.884041|2.556672|3.037463|3.037105|1.952408|1.763588|1.583963|1.550584|1.669958|1.885119|3.164459|3.519776|4.818590|7.063463|5.047496|3.795514|5.768265|4.671722|7.070807|8.386577|5.438244|4.106479|3.920001|23.257104|21.771087|73.516695| |1.712537|1.961676|2.197399|2.503089|3.173234|2.741576|2.439252|2.925400|2.176035|2.465625|2.256244|2.686080|2.636717|1.708228|1.568964|1.417520|1.380125|1.468617|1.639413|2.837967|2.948601|3.917492|6.107737|4.091548|3.177307|4.955851|4.084391|5.429278|8.387404|7.102774|4.692743|3.918394|23.337709|21.676614|16.015610|73.516695| |17.537104|8.891583|6.461607|4.657702|6.235372|8.248019|3.500478|4.533139|2.703900|2.393146|2.072627|2.826404|3.281206|2.418597|2.081732|2.011171|2.216693|2.633352|2.799990|4.646723|2.473061|4.041202|3.911434|4.836536|3.227440|6.113600|2.580196|2.403519|2.047671|1.879855|1.959922|2.267737|18.350990|2.578520|3.539553|3.012417|0.500000| |17.599955|8.962581|5.489552|4.442956|6.741314|10.254906|3.887587|5.367162|3.109092|2.637046|2.286092|3.188304|3.815026|2.896894|2.445043|2.379422|2.696724|3.338663|3.530498|5.597734|2.631399|4.266779|4.069733|4.572391|2.929851|5.305403|2.399362|2.250326|1.937640|1.786913|1.858545|2.130042|17.272432|2.452959|3.354649|2.885856|0.300276|0.500000| |17.537237|8.892018|6.462994|4.658203|6.235515|8.248157|3.501041|4.535605|2.705167|2.393796|2.073304|2.827733|3.283154|2.420509|2.083311|2.012873|2.218909|2.636343|2.802825|4.651427|2.473231|4.040845|3.911466|4.836232|3.229514|6.128399|2.575307|2.331848|1.997880|1.869504|1.987387|2.318023|19.487085|2.477830|3.338082|2.916333|0.302023|0.300268|0.500000| 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|3.145474|3.108120|2.567557|2.593566|4.267648|4.969296|3.246270|5.519221|3.747242|2.958552|2.837322|4.494502|5.656115|5.629251|4.960769|5.660795|8.968997|17.732885|8.895433|16.628787|2.567972|3.667965|3.933984|3.063998|1.957990|3.334302|1.765887|1.747091|1.580246|1.463596|1.475199|1.606789|12.633519|2.086650|2.864281|2.518399|0.079378|0.104002|0.079481|0.063216|0.068502|0.107766|0.124731|0.500000| |3.738305|4.150246|3.380234|3.633458|6.661187|7.619662|5.530282|11.610850|6.948152|4.623234|4.071411|6.413403|9.668769|8.905086|5.644433|4.952432|5.674577|8.929360|17.795297|9.580867|3.826375|5.625694|5.479420|4.178917|2.532914|4.180604|2.252063|2.234769|1.976806|1.799625|1.809830|1.999277|15.435531|2.586908|3.571847|3.070666|0.091233|0.119150|0.091329|0.079253|0.092112|0.124315|0.107533|0.214470|0.500000| 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