Version2.4 2021-05-29T11:13:28Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 21-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCOc1ccc(cc1)c2cc3c(=O)n(ccn3n2)CC(=O)Nc4ccc(c(c4)C)Br C45921762 RHF 6-31G(d) (6D,7F) CCCCOc1ccc(cc1)c2cc3c(=O)n(ccn3n2)CC(=O)Nc4ccc(c(c4)C)Br C01[X(C25H25Br1N4O3)] 168 C1 560 CCCCOc1ccc(cc1)c1nn2c(c1)c(=O)n(cc2)CC(=O)Nc1ccc(c(c1)C)Br CCCCOc1ccc(cc1)c1nn2c(c1)c(=O)n(cc2)CC(=O)Nc1ccc(c(c1)C)Br CCCCOc1ccc(cc1)c2cc3n(C=CN(CC(=O)Nc4ccc(Br)c(C)c4)C3=O)n2 InChIKey=UCXHGBSZZDCNAJ-UHFFFAOYSA-N InChI=1S/C25H25BrN4O3/c1-3-4-13-33-20-8-5-18(6-9-20)22-15-23-25(32)29(11-12-30(23)28-22)16-24(31)27-19-7-10-21(26)17(2)14-19/h5-12,14-15H,3-4,13,16H2,1-2H3,(H,27,31) InChI=1/C25H25BrN4O3/c1-3-4-13-33-20-8-5-18(6-9-20)22-15-23-25(32)29(11-12-30(23)28-22)16-24(31)27-19-7-10-21(26)17(2)14-19/h5-12,14-15H,3-4,13,16H2,1-2H3,(H,27,31)/f/h27H CCCCOc1ccc(cc1)c2cc3c(=O)n(ccn3n2)CC(=O)Nc4ccc(c(c4)C)Br C01[X(C25H25Br1N4O3)] 168 C01 560 CCCCOc1ccc(cc1)c1nn2c(c1)c(=O)n(cc2)CC(=O)Nc1ccc(c(c1)C)Br CCCCO[C]1[CH][CH][C]([CH][CH]1)[C]1[CH][C]2[N]([N]1)C=CN(C2=O)CC(=O)N[C]1[CH][CH][C]([C]([CH]1)C)Br CCCCO[C]1[CH][CH][C]([CH][CH]1)[C]2[CH][C]3N([N]2)C=CN(CC(=O)N[C]4[CH][CH][C](Br)[C](C)[CH]4)C3=O InChIKey=UCXHGBSZZDCNAJ-UHFFFAOYSA-N InChI=1S/C25H25BrN4O3/c1-3-4-13-33-20-8-5-18(6-9-20)22-15-23-25(32)29(11-12-30(23)28-22)16-24(31)27-19-7-10-21(26)17(2)14-19/h5-12,14-15H,3-4,13,16H2,1-2H3,(H,27,31) InChI=1/C25H25BrN4O3/c1-3-4-13-33-20-8-5-18(6-9-20)22-15-23-25(32)29(11-12-30(23)28-22)16-24(31)27-19-7-10-21(26)17(2)14-19/h5-12,14-15H,3-4,13,16H2,1-2H3,(H,27,31)/f/h27H 3407.6808283206 -3973.5582209 1-A 38917.6673 131 429 560 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -490.05788 -64.46914 -58.60842 -58.60661 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1567.9793 1570.5854 1571.8661 1584.7477 1589.7990 1608.7478 1631.7087 1632.6213 1632.8861 1636.6933 1642.5608 1643.5031 1644.1623 1655.7528 1664.7111 1677.3849 1707.9850 1741.2220 1744.5155 1778.8507 1795.2307 1811.3634 1824.0303 1875.8485 1917.2607 1973.4862 3186.7413 3198.0187 3201.1817 3211.7990 3213.9606 3217.6942 3230.4241 3256.7501 3266.6377 3268.6323 3278.4892 3292.6486 3294.3221 3352.9671 3356.3017 3372.0190 3386.8591 3399.0343 3405.6506 3408.4352 3448.6918 3465.1650 3475.5086 3476.9439 3814.3483 7.8020 4.1560 3.6439 3.7937 6.4203 5.6246 7.5668 7.4761 1.8057 6.8504 5.7140 5.2326 5.7793 4.1171 5.4631 1.8831 1.0871 5.9356 5.7195 6.2718 4.7287 5.4522 3.2517 6.0076 1.1330 6.3477 4.8454 4.5316 6.7068 7.2900 5.6510 5.8915 4.1934 4.6652 3.1185 2.7008 5.6213 3.3183 3.4297 5.6713 4.6363 3.8817 5.2452 3.7796 3.9165 4.4501 3.5833 5.2953 6.9866 5.5791 6.6610 4.4856 1.2764 3.9716 5.6362 1.0764 3.0051 5.6135 3.4116 1.3828 5.3337 5.8362 1.1523 5.8362 1.2814 1.7761 4.2214 1.7561 1.3645 4.0225 1.9282 1.4949 1.3281 1.1518 3.8211 3.6086 1.3807 2.8244 3.0751 1.3452 2.7571 2.1730 1.3941 5.3399 2.5068 2.2464 3.5994 1.5318 3.2120 1.9042 1.8350 3.2293 2.5724 1.6416 2.8254 2.9111 1.6598 1.3143 1.3875 1.7624 2.0882 1.2855 3.0500 1.7848 2.3764 1.5447 3.0288 2.1447 1.1387 1.8546 1.0534 2.7399 3.1207 1.6335 1.3961 2.3750 2.5593 1.2890 2.6596 1.2855 3.2307 1.5762 3.1795 1.3393 1.0829 1.6392 1.0600 2.0604 1.0936 1.0415 1.0976 1.9713 1.1398 2.9259 3.0184 7.0505 6.4268 3.2389 3.7085 5.4700 6.9327 9.5342 7.7857 1.0588 1.0527 1.0427 1.1041 1.0596 1.0363 1.1076 1.1067 1.1027 1.1055 1.1025 1.0604 1.1040 1.1104 1.0918 1.0903 1.0900 1.0928 1.0956 1.0936 1.0923 1.0938 1.0992 1.1020 1.0801 0.0003 0.0004 0.0007 0.0010 0.0037 0.0060 0.0121 0.0131 0.0049 0.0194 0.0249 0.0361 0.0508 0.0424 0.0748 0.0280 0.0189 0.1118 0.1189 0.1406 0.1322 0.1734 0.1086 0.2180 0.0470 0.3107 0.2637 0.2605 0.4183 0.5258 0.4141 0.4913 0.4598 0.5360 0.3926 0.3485 0.7924 0.4826 0.5114 0.9116 0.8627 0.7830 1.0908 0.7971 0.8363 0.9839 0.8981 1.4089 1.9947 1.6238 1.9728 1.4133 0.4274 1.4039 2.0686 0.4063 1.1403 2.1807 1.3386 0.5659 2.2484 2.6986 0.5349 2.7972 0.6471 0.9208 2.2002 0.9493 0.7414 2.3018 1.1050 0.8700 0.8365 0.7360 2.4447 2.3785 0.9307 1.9248 2.2035 0.9707 2.0018 1.5964 1.0256 3.9458 1.8699 1.7366 2.8817 1.2452 2.6625 1.6438 1.6054 2.9363 2.3448 1.5462 2.7205 2.8793 1.6682 1.3216 1.3971 1.8245 2.1816 1.4291 3.4236 2.1097 2.8233 1.8395 3.6319 2.6446 1.4074 2.2953 1.3052 3.4289 4.1439 2.2374 1.9315 3.3029 3.6455 1.8672 3.8654 1.8713 4.7805 2.3471 4.8482 2.1010 1.7006 2.5751 1.6730 3.2752 1.7403 1.6588 1.7730 3.2186 1.8895 5.0290 5.3918 12.6421 11.9819 6.1503 7.1691 10.7226 14.3731 20.6488 17.8655 6.3352 6.3433 6.2952 6.7104 6.4488 6.3216 6.8098 6.9157 6.9325 6.9587 6.9820 6.7735 7.0590 7.3551 7.2464 7.3039 7.3668 7.4391 7.4869 7.4852 7.6544 7.7380 7.8232 7.8494 9.2586 0.0597 0.1711 0.4903 0.0511 0.5485 0.2116 2.6369 5.2799 0.2018 2.8964 0.0524 0.4773 3.9933 2.2684 1.2397 1.7174 0.2404 5.2680 1.7781 4.6949 2.3079 0.5381 1.6049 2.3472 0.0820 1.6500 2.0584 12.2974 16.9856 13.5905 2.4282 1.7689 1.5094 4.4219 0.2575 9.9597 12.4594 7.8712 5.5070 20.4865 2.0265 6.1639 7.0519 4.0232 2.2556 8.8642 5.9435 13.6258 9.4659 3.4314 20.7207 31.4587 144.3524 0.9744 4.7816 1.8465 2.3611 1.0230 0.6287 56.6804 32.0975 31.7228 0.1017 12.3249 7.1959 53.0854 24.6554 30.7734 26.7865 4.9356 11.0651 42.7250 4.5827 0.8644 16.3985 36.3784 0.4104 3.0005 2.2079 0.1100 1.1526 11.0402 1.5715 54.1080 1.5669 0.7391 42.8990 3.2659 53.6522 17.2396 1.0368 0.9138 20.6575 15.4425 57.5957 2.4661 2.7550 120.2858 16.2973 46.0130 4.9045 1.7039 44.9297 141.1766 335.3404 86.2673 345.4386 12.0792 0.0486 124.1139 0.0294 21.4451 70.1525 6.6054 7.2906 38.7822 48.3867 0.7835 16.0976 1.7872 4.7146 162.1983 256.4126 29.4068 9.5907 54.2210 0.3752 269.1379 9.1340 5.4644 2.7225 152.0973 27.3478 110.6370 432.8217 8.7603 26.0553 23.5679 302.6235 158.7906 119.6849 455.4042 329.9186 17.0517 37.7808 33.3593 9.7579 43.5787 20.2720 11.2928 3.7336 57.7252 149.0604 15.7380 13.5349 23.2093 4.4108 16.1726 20.2824 8.2502 3.8335 8.7686 14.7874 12.1813 2.2137 0.3079 7.2793 156.2001 1.7902 3.6164 6.0763 2.4630 2.4562 0.5962 0.9918 2.1239 1.2065 0.4244 0.2871 0.5733 0.2259 0.3555 1.1006 0.2010 0.2993 2.1806 2.0997 2.0283 0.1593 1.0746 1.1032 2.1732 0.0190 0.2955 0.9721 0.4983 3.2763 1.5681 2.2305 0.9524 2.1380 3.4960 0.1949 1.3508 4.4485 2.2317 2.1997 1.2547 3.0559 0.9147 10.3215 1.4134 8.7696 1.8455 1.7433 0.9885 2.9158 7.5839 5.7167 8.0193 9.7794 0.1189 3.8571 0.0981 0.3403 7.4842 7.4169 2.6732 2.2468 1.8623 0.1270 10.7318 2.7516 1.5879 11.9880 1.1637 1.7876 2.1674 21.3225 3.6260 12.1934 0.4650 50.3330 6.6145 5.6699 0.6525 2.3046 1.0819 0.9496 2.8083 1.2748 15.1028 5.6325 11.2516 19.7377 0.9217 1.8852 11.1998 2.6598 3.3092 21.5314 1.0115 0.8371 12.4508 0.9364 19.6848 57.3758 11.7401 14.9147 2.4016 42.9022 13.8569 9.1330 5.3448 29.9667 2.0747 1.4637 33.6409 35.4431 24.3162 76.0939 1.6112 1.4017 22.3267 3.6638 1.1219 181.4240 12.3373 9.0964 38.6701 351.8761 10.8498 9.8514 88.7949 37.1578 300.4182 1.4082 21.3359 4.5017 0.5389 4.8650 145.7268 43.3970 57.8245 3.4015 70.7136 68.6699 754.5331 351.2055 36.4286 18.7966 23.0545 39.3692 182.3536 114.1989 73.8522 118.5729 44.9131 10.8325 107.7712 33.5470 68.4849 89.6248 51.9776 53.0880 69.2029 34.8200 80.2021 78.9882 59.8095 131.2748 46.6825 52.8546 54.8836 81.9855 106.9174 0.7298 0.7500 0.7495 0.7256 0.7217 0.7495 0.7156 0.6552 0.7434 0.5385 0.7012 0.6301 0.4580 0.3951 0.6477 0.7426 0.6455 0.5295 0.4150 0.5861 0.7443 0.1814 0.6510 0.1876 0.7265 0.6005 0.3336 0.7046 0.6055 0.3302 0.6990 0.7008 0.7302 0.7317 0.7368 0.4386 0.2476 0.4437 0.6578 0.3205 0.2506 0.7079 0.2454 0.6790 0.7275 0.6876 0.6332 0.2813 0.5060 0.3397 0.3588 0.3597 0.2262 0.7354 0.6088 0.7491 0.1513 0.2163 0.7489 0.7167 0.6875 0.7422 0.6403 0.1084 0.5956 0.7497 0.7167 0.6478 0.7145 0.1694 0.2099 0.6534 0.6101 0.2537 0.2174 0.3875 0.7477 0.7456 0.7332 0.6413 0.7473 0.7171 0.7453 0.1649 0.2097 0.6649 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1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 14.00307 14.00307 12.00000 12.00000 15.99491 14.00307 12.00000 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 11964.5868 62599.7934 72237.0436 0.99949 0.03173 -0.00287 -0.03167 0.99933 0.01853 0.00346 -0.01843 0.99982 1 0.00724 0.00138 0.00120 0.15084 0.02883 0.02498 11.70 18.69 25.81 31.16 45.07 60.97 75.05 78.48 97.30 99.70 123.70 155.63 175.68 190.29 219.30 228.45 247.02 257.22 270.29 280.62 313.42 334.23 342.57 357.04 381.95 414.69 437.32 449.43 468.13 503.40 507.43 541.29 620.69 635.38 665.07 673.36 703.74 714.85 723.79 751.51 808.54 841.85 854.80 860.80 866.16 881.38 938.41 966.86 1001.56 1011.23 1020.09 1052.16 1084.73 1114.43 1135.57 1151.62 1154.66 1168.29 1174.13 1199.08 1217.01 1274.60 1277.02 1297.68 1331.97 1349.68 1353.22 1378.17 1381.65 1417.91 1419.00 1429.99 1487.64 1498.35 1499.32 1521.77 1538.96 1547.38 1586.69 1592.25 1597.20 1606.59 1607.74 1611.27 1618.89 1648.05 1677.17 1689.98 1706.59 1741.51 1753.27 1787.35 1789.57 1819.14 1839.29 1864.17 1879.18 1879.60 1880.86 1907.15 1915.89 1976.36 1985.91 2037.95 2043.10 2045.48 2052.55 2081.44 2083.83 2085.26 2086.44 2096.91 2159.94 2193.73 2204.78 2210.45 2237.10 2255.97 2259.72 2261.56 2280.10 2287.37 2314.63 2347.66 2348.98 2349.36 2354.84 2363.28 2364.63 2365.58 2382.26 2395.15 2413.38 2457.41 2505.23 2509.97 2559.37 2582.94 2606.15 2624.37 2698.93 2758.51 2839.41 4585.01 4601.24 4605.79 4621.06 4624.17 4629.54 4647.86 4685.74 4699.96 4702.83 4717.01 4737.39 4739.79 4824.17 4828.97 4851.58 4872.93 4890.45 4899.97 4903.98 4961.90 4985.60 5000.48 5002.55 5488.00 0.500221 0.528896 0.529840 0.433654 -3973.058000 -3973.029325 -3973.028381 -3973.124566 3.226061D-04 MUNgauss RevisionA2.1 retrievium 29-May-2021 DUDE CCCCOc1ccc(cc1)c2cc3c(=O)n(ccn3n2)CC(=O)Nc4ccc(c(c4)C)Br C45921762 RHF 6-31G(d) (6D,10F) C1 508.111002 |X|Y|Z| 179.868284 75.892025 28.401718 72.917501 24 6 7 20 4 |36.858105| |12.466063|36.858105| |7.487650|12.453939|36.858105| |4.887155|7.517813|12.547852|36.858105| |3.882408|5.094109|8.062990|13.549457|73.516695| |3.083511|3.883549|5.225287|7.979349|25.171803|36.858105| |2.645964|3.142783|4.083933|5.244180|14.580011|13.655659|36.858105| |2.241295|2.613404|3.198671|3.979090|9.425763|7.927323|13.865593|36.858105| |2.132176|2.511378|2.964685|3.766869|8.173565|6.801170|7.894880|13.626308|36.858105| |2.345478|2.849162|3.334419|4.498229|9.248319|7.944492|6.916012|7.992760|13.767043|36.858105| |2.829392|3.592766|4.393684|6.689474|13.995183|13.752925|7.939755|6.879861|7.866004|13.713372|36.858105| |1.832206|2.110030|2.412326|2.926526|6.027090|4.453970|5.061024|7.623483|12.905641|7.640047|5.043169|36.858105| |1.701124|1.951539|2.171989|2.606169|5.124920|3.613042|3.810708|4.977774|7.326300|6.169027|4.259737|13.485162|36.858105| |1.528584|1.724336|1.905232|2.224115|4.359846|2.965992|3.203121|4.097897|5.234401|4.359994|3.314901|8.692445|13.955411|36.858105| |1.381093|1.542301|1.676530|1.923413|3.692201|2.433024|2.573264|3.118009|3.755899|3.355618|2.696662|5.224213|7.338899|13.013011|36.858105| |1.356117|1.515749|1.628777|1.867116|3.522278|2.297030|2.367482|2.788835|3.369238|3.172777|2.585106|4.381804|6.235617|8.103901|15.782845|73.516695| |1.283951|1.418590|1.541222|1.741395|3.353350|2.175530|2.334908|2.798495|3.198180|2.821823|2.343810|4.250744|5.125364|7.992248|13.932168|15.007766|53.358707| |1.290690|1.420138|1.556656|1.749594|3.416928|2.216644|2.440570|2.961438|3.265382|2.781735|2.331858|4.330414|4.681287|6.961273|7.850571|9.585829|18.525986|36.858105| |1.395667|1.543099|1.713984|1.941246|3.862300|2.547909|2.885485|3.638369|3.976219|3.212466|2.651725|5.524444|5.421879|7.927351|6.715931|8.377199|10.891260|14.402789|36.858105| |1.531205|1.716359|1.920295|2.222552|4.456653|3.034722|3.440172|4.568476|5.416246|4.154577|3.242669|9.049837|8.734652|14.116881|7.817908|9.551762|9.570350|8.215684|13.750965|53.358707| |1.692771|1.913962|2.184812|2.567197|5.311179|3.749971|4.477932|6.601746|7.833452|5.183737|3.933008|14.460482|8.478604|8.601107|5.314726|7.418569|6.445635|5.353187|7.948198|19.661924|53.358707| |1.176756|1.290654|1.387095|1.549602|2.945248|1.876033|1.985218|2.309034|2.587670|2.358358|2.013084|3.232245|3.809896|5.097276|7.843240|12.443015|17.768914|7.732991|5.160120|6.222303|4.730810|36.858105| |1.131191|1.237398|1.321569|1.470050|2.772352|1.751720|1.836281|2.105842|2.349566|2.179162|1.881594|2.859530|3.310707|4.186090|5.820515|10.044596|10.444684|5.790500|4.252146|5.202197|4.138459|12.462149|36.858105| |1.074935|1.168798|1.247239|1.376154|2.596655|1.627101|1.712738|1.947693|2.130677|1.971898|1.726706|2.542283|2.834917|3.487238|4.428817|7.460402|7.851557|5.129352|3.866741|4.570811|3.736492|8.036426|15.894009|73.516695| |1.158435|1.272700|1.351850|1.511093|2.824419|1.786069|1.844213|2.101821|2.385608|2.262385|1.947368|2.879863|3.427796|4.172477|5.779928|11.236988|8.495527|4.663301|3.746538|4.923987|4.015133|7.883212|14.069090|14.885402|53.358707| |1.122788|1.230129|1.297749|1.443469|2.675551|1.676349|1.714707|1.924808|2.167134|2.089961|1.826420|2.539236|2.943706|3.393203|4.241727|8.189620|5.962645|3.630573|3.095658|4.115975|3.503548|5.029126|7.657279|11.522602|18.434454|36.858105| |1.055557|1.148517|1.209673|1.333218|2.471302|1.534276|1.575571|1.753530|1.936218|1.860235|1.649896|2.230887|2.499210|2.850805|3.403383|6.271695|4.980439|3.242464|2.789580|3.610095|3.127019|4.203051|6.286016|11.626021|10.510936|13.726015|36.858105| |1.024070|1.111079|1.162980|1.275676|2.347438|1.445621|1.472735|1.618938|1.777260|1.729346|1.553025|2.004912|2.216105|2.450539|2.812543|5.209861|3.988587|2.664494|2.376036|3.125057|2.780431|3.231086|4.322125|7.952981|6.995314|7.978650|13.760925|36.858105| |1.049710|1.141962|1.188839|1.306960|2.386209|1.467171|1.478248|1.614889|1.785793|1.765233|1.589813|1.993828|2.218240|2.394744|2.709550|5.134448|3.692706|2.443891|2.226184|3.007078|2.712339|2.911038|3.687161|6.413709|6.220577|6.890982|7.922550|13.810340|36.858105| |1.115495|1.221747|1.271546|1.409537|2.566543|1.588370|1.589408|1.743024|1.958834|1.955300|1.744224|2.199916|2.505097|2.681160|3.066152|6.011958|4.025272|2.587338|2.364709|3.270964|2.939872|3.131136|3.885801|6.355188|7.049482|7.831723|6.770947|7.889144|13.697303|36.858105| |1.156383|1.271890|1.333253|1.488351|2.731350|1.708706|1.721679|1.915675|2.179736|2.151819|1.885402|2.512518|2.942615|3.241198|3.897977|7.876388|5.072687|3.116087|2.777981|3.848458|3.364113|4.009498|5.173918|7.877895|10.888519|13.686384|7.936865|6.950456|8.039960|13.748535|36.858105| |1.140203|1.251279|1.291248|1.431866|2.577242|1.586154|1.564637|1.695751|1.910610|1.948293|1.755652|2.101577|2.385312|2.464514|2.730301|5.402008|3.482966|2.261183|2.118481|2.993907|2.752695|2.639252|3.076570|5.022581|5.305612|5.002914|4.408058|4.999264|7.493093|12.629726|7.586132|36.858105| |0.992748|1.073359|1.108678|1.207814|2.187940|1.329131|1.330679|1.432212|1.563943|1.560474|1.430887|1.706041|1.858988|1.961690|2.147903|4.023281|2.914585|1.981239|1.846405|2.503511|2.312408|2.256608|2.705406|4.801300|4.270112|4.081106|4.597588|6.725508|10.005276|6.638774|4.595737|5.982281|2539.412838| |17.541534|8.777368|6.787798|4.516638|6.686663|2.994385|2.616290|2.213942|2.086258|2.266815|2.710801|1.797603|1.665948|1.502241|1.358199|2.366446|1.723690|1.275650|1.379695|2.054600|2.271057|1.161562|1.111614|1.879275|1.542953|1.094573|1.029588|0.996192|1.017721|1.080022|1.122812|1.099716|32.682735|0.500000| |17.541692|8.777460|6.787870|4.516673|6.686834|2.994244|2.616203|2.213709|2.085942|2.266603|2.710586|1.797272|1.659066|1.499397|1.354171|2.354293|1.721696|1.278208|1.384995|2.058607|2.279674|1.158789|1.117679|1.894563|1.555258|1.110134|1.047532|1.017870|1.041812|1.103069|1.140990|1.125199|33.605502|0.301682|0.500000| |17.553882|8.778466|5.461652|4.055154|5.808324|2.702005|2.338275|2.023566|1.953140|2.152959|2.550991|1.701155|1.598252|1.441782|1.313260|2.305303|1.662674|1.222502|1.313228|1.954398|2.140686|1.125953|1.085941|1.835578|1.517753|1.084659|1.020837|0.993727|1.021403|1.085183|1.120563|1.114000|33.018630|0.301652|0.301654|0.500000| |8.866275|17.509424|8.845514|6.898675|8.379041|3.751558|3.023036|2.554994|2.496487|2.866086|3.594861|2.108140|1.972642|1.735491|1.557757|2.738444|1.941204|1.418071|1.533876|2.329294|2.582065|1.300656|1.242750|2.079879|1.743106|1.234952|1.148912|1.110029|1.142680|1.226896|1.279798|1.259615|36.479749|0.210875|0.173036|0.213039|0.500000| |8.866349|17.509675|8.845643|6.898731|8.379348|3.751269|3.022897|2.554633|2.495943|2.865646|3.594342|2.107604|1.961318|1.731137|1.551726|2.719783|1.938373|1.421561|1.541115|2.335093|2.594657|1.296792|1.251180|2.100510|1.760776|1.257270|1.173825|1.140039|1.176848|1.260752|1.306717|1.298047|37.766999|0.173036|0.210879|0.213040|0.303796|0.500000| |6.846659|8.822880|17.538516|8.945498|13.140680|4.928538|4.048410|3.160852|2.875537|3.154282|4.044854|2.354550|2.101522|1.861569|1.637956|2.813086|2.064083|1.543347|1.704917|2.581669|2.945848|1.364117|1.305691|2.200697|1.813584|1.283200|1.201937|1.157715|1.181109|1.257370|1.314622|1.273434|37.583549|0.168612|0.203079|0.140060|0.173301|0.211071|0.500000| |6.846695|8.822802|17.538260|8.945272|13.139549|4.929182|4.048753|3.161535|2.876360|3.154848|4.045561|2.355290|2.115480|1.866987|1.645058|2.833765|2.067501|1.538876|1.695115|2.573824|2.927430|1.368620|1.296103|2.176968|1.794263|1.259464|1.175194|1.126282|1.146532|1.223731|1.287182|1.237035|36.312626|0.203078|0.168616|0.140060|0.211064|0.173301|0.303394|0.500000| |4.527003|6.834843|8.836454|17.533604|16.530583|7.093037|4.784825|3.811622|3.744682|4.603050|6.784895|2.938013|2.669680|2.257447|1.960323|3.412680|2.397109|1.751587|1.930255|3.023225|3.456520|1.571367|1.482682|2.455483|2.079726|1.454157|1.336281|1.276093|1.309882|1.419550|1.503757|1.446127|41.080900|0.119594|0.111157|0.108364|0.205819|0.170139|0.174128|0.213065|0.500000| |4.527252|6.835527|8.836858|17.534109|16.530611|7.090220|4.783840|3.810150|3.742616|4.600962|6.780851|2.936423|2.641465|2.247734|1.948186|3.376365|2.391678|1.758192|1.944819|3.035952|3.487048|1.564471|1.497172|2.489921|2.110193|1.491327|1.376314|1.322746|1.362609|1.473268|1.548383|1.505744|42.964814|0.111162|0.119599|0.108371|0.170157|0.205844|0.213068|0.174129|0.300927|0.500000| |2.689566|3.110053|4.112950|4.866524|13.498636|8.951861|17.737163|8.915797|5.616793|4.976004|5.663456|4.110950|3.209534|2.809299|2.311760|3.781280|2.915446|2.264599|2.662157|4.167686|5.277596|1.842247|1.709431|2.862290|2.318981|1.590160|1.475449|1.383343|1.382877|1.474278|1.587927|1.448249|42.641099|0.074838|0.074834|0.065368|0.081806|0.081802|0.116874|0.116889|0.120384|0.120359|0.500000| |2.045468|2.328849|2.808375|3.328334|7.622012|5.646715|8.980803|17.745772|8.904887|5.673910|4.957794|7.057790|4.656679|4.121911|3.147070|4.893683|3.959377|3.186786|4.042493|6.713787|10.082972|2.382260|2.156365|3.573971|2.878835|1.924444|1.766140|1.621240|1.600319|1.712378|1.887281|1.647307|48.173363|0.056522|0.056514|0.051538|0.063096|0.063085|0.078119|0.078141|0.088557|0.088520|0.215129|0.500000| |2.195821|2.650825|2.982923|3.910417|7.471847|5.668724|4.974826|5.659005|8.918274|17.720146|8.984174|7.027843|6.839807|4.613632|3.614508|6.267248|4.010543|2.813400|3.163601|5.580576|6.484195|2.474977|2.298522|3.652944|3.311184|2.249846|1.974071|1.835248|1.891973|2.127755|2.354238|2.139857|56.541348|0.058685|0.058696|0.056837|0.075007|0.075030|0.078064|0.078037|0.113878|0.113955|0.107926|0.124277|0.500000| |3.036576|3.990659|4.663057|7.394489|12.467288|8.871184|5.632436|4.959718|5.635202|8.952241|17.766117|4.122627|3.737507|2.964115|2.489540|4.336065|2.946271|2.125095|2.365606|3.863371|4.493871|1.890446|1.783219|2.910506|2.535923|1.764627|1.594460|1.512778|1.561893|1.719549|1.842619|1.753896|48.212247|0.079487|0.079496|0.076781|0.113407|0.113434|0.115285|0.115256|0.225506|0.225708|0.124160|0.107676|0.218814|0.500000| |1.731245|1.999977|2.197166|2.656163|5.085068|3.544663|3.549232|4.360445|6.306649|6.281392|4.370486|8.484656|17.840273|8.746010|6.327487|11.113151|6.023027|3.885279|4.228952|8.059850|7.903767|3.515454|3.114653|4.720865|4.532181|2.904870|2.440584|2.188278|2.228582|2.559336|2.995377|2.489967|63.811378|0.046950|0.046569|0.045421|0.056723|0.056058|0.058403|0.059157|0.076930|0.075278|0.083007|0.109655|0.220243|0.110682|0.500000| |1.211389|1.322780|1.443692|1.604676|3.119859|1.994121|2.190111|2.598830|2.791186|2.417266|2.073916|3.517247|3.707368|5.007643|5.684309|7.784291|12.356100|17.812617|9.077348|7.823222|5.789225|7.350562|5.865188|10.161856|6.022226|3.518912|3.275184|2.677819|2.403388|2.484892|2.949060|2.151720|66.653036|0.033305|0.033405|0.031941|0.036632|0.036765|0.039894|0.039724|0.044512|0.044752|0.057279|0.077983|0.067594|0.052914|0.088705|0.500000| |1.392947|1.531384|1.710633|1.920496|3.857292|2.523749|2.917949|3.657264|3.779224|3.026486|2.559230|4.907965|4.459157|5.711096|4.881143|6.629197|7.671682|8.960768|17.833447|12.354563|9.870724|4.152287|3.593051|6.075441|4.328648|2.724856|2.526565|2.190788|2.049091|2.144197|2.460887|1.934840|58.907284|0.038329|0.038585|0.036299|0.042038|0.042375|0.047622|0.047144|0.052568|0.053237|0.076267|0.117344|0.080854|0.063129|0.099554|0.210830|0.500000| |1.131258|1.233727|1.327139|1.471344|2.804500|1.773823|1.891466|2.187766|2.397162|2.170148|1.877039|2.940813|3.324820|4.313664|5.830044|9.140847|12.497955|7.449104|4.945530|5.641453|4.395184|17.665284|9.008203|13.758312|7.885371|4.163409|3.740100|2.940838|2.617902|2.738622|3.361317|2.333210|70.845392|0.031119|0.030991|0.030055|0.034490|0.034317|0.036332|0.036538|0.041359|0.041059|0.049268|0.063478|0.062336|0.048880|0.084750|0.230570|0.115351|0.500000| |1.175153|1.290538|1.380589|1.543968|2.914411|1.852448|1.939173|2.237699|2.527325|2.342823|2.003514|3.117218|3.768187|4.832482|7.522740|14.087087|12.532788|5.793769|4.333643|5.604206|4.399870|17.650375|8.801983|10.798894|9.843839|4.748543|3.868682|3.053676|2.823693|3.101331|3.984335|2.662826|75.002830|0.032252|0.032013|0.031306|0.036321|0.035983|0.037502|0.037886|0.043823|0.043227|0.049841|0.063369|0.069050|0.052650|0.100032|0.148937|0.098778|0.300734|0.500000| |1.211173|1.337890|1.421562|1.600600|2.987155|1.901675|1.952149|2.235312|2.584148|2.468642|2.099210|3.155826|3.917127|4.767819|7.047267|15.733492|9.105782|4.672772|3.842108|5.291933|4.289890|7.768936|9.528978|10.877620|25.956696|9.300461|5.731772|4.294635|4.098950|4.919188|7.657445|3.935453|99.320231|0.032913|0.033068|0.032372|0.037537|0.037764|0.038731|0.038485|0.045213|0.045616|0.049677|0.061900|0.074840|0.055856|0.107877|0.117225|0.088959|0.152086|0.223049|0.500000| |1.028514|1.115458|1.178404|1.294056|2.410665|1.494681|1.547684|1.725994|1.886506|1.792253|1.593120|2.178864|2.409552|2.786865|3.324161|5.944964|5.094840|3.405059|2.872796|3.609626|3.107433|4.424790|6.839577|14.969778|9.490549|8.895256|17.830670|8.931525|5.651592|4.907482|5.643507|3.534318|130.588113|0.027942|0.028389|0.027589|0.030957|0.031563|0.032580|0.031913|0.035971|0.036941|0.040471|0.048743|0.052301|0.042546|0.064490|0.098932|0.072868|0.113670|0.109419|0.142603|0.500000| |0.978032|1.056145|1.104336|1.204096|2.215862|1.356797|1.385425|1.514871|1.644836|1.596872|1.446077|1.839118|2.001647|2.203536|2.487350|4.537135|3.569626|2.445136|2.196172|2.859689|2.568053|2.881133|3.743902|7.192525|5.653018|5.669203|8.952231|17.750557|8.961242|5.634433|4.994756|4.081911|222.678236|0.026449|0.027061|0.026382|0.029254|0.030083|0.030618|0.029745|0.033374|0.034632|0.036366|0.042308|0.046695|0.039124|0.054647|0.069304|0.057071|0.074821|0.075299|0.098105|0.215955|0.500000| |1.214342|1.343600|1.408281|1.584120|2.899886|1.825264|1.826355|2.038332|2.357886|2.353167|2.040871|2.731822|3.296937|3.574212|4.337845|9.317926|5.313021|3.175752|2.863892|4.089780|3.575596|4.078119|4.870210|7.114593|10.114147|8.932552|5.652270|4.990740|5.692580|8.968320|17.700079|7.085292|129.821826|0.032735|0.033157|0.032677|0.037705|0.038350|0.038376|0.037730|0.044718|0.045815|0.046420|0.055272|0.072734|0.055583|0.095629|0.081423|0.069635|0.093149|0.116603|0.237475|0.124189|0.108208|0.500000| |1.083213|1.183160|1.214902|1.338547|2.399796|1.466319|1.444453|1.554923|1.736892|1.773559|1.614088|1.894357|2.133205|2.199221|2.433795|4.808722|3.138090|2.049107|1.917259|2.692295|2.487010|2.411469|2.782744|4.607131|4.666002|4.287101|3.949283|4.573765|6.656844|8.860970|5.900496|17.568878|210.812371|0.029062|0.029669|0.029490|0.033147|0.034050|0.033248|0.032405|0.037630|0.038980|0.037321|0.042026|0.053808|0.044953|0.061908|0.054655|0.048954|0.060040|0.068204|0.095519|0.090111|0.107813|0.153605|0.500000| |1.197310|1.321571|1.363084|1.522076|2.731448|1.689132|1.655142|1.796881|2.049857|2.113102|1.891670|2.257188|2.607252|2.655205|2.940630|5.967200|3.643561|2.330948|2.195600|3.159825|2.908621|2.725632|3.092530|4.922572|5.388726|4.776325|3.968877|4.177753|5.560235|8.880459|7.334996|17.593350|152.024276|0.032057|0.032700|0.032489|0.037099|0.038100|0.037163|0.036231|0.042931|0.044518|0.042277|0.048127|0.065397|0.052729|0.077085|0.060756|0.055254|0.066182|0.077593|0.116436|0.090471|0.096069|0.228256|0.301085|0.500000| 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