Version2.4 2021-05-21T10:50:29Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 08-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cn1cc(cc1C(=O)NNC(=O)CCCN(C)S(=O)(=O)c2ccc(cc2)F)Br C16270692 RHF 6-31G(d) (6D,7F) Cn1cc(cc1C(=O)NNC(=O)CCCN(C)S(=O)(=O)c2ccc(cc2)F)Br C01[X(C17H20Br1F1N4O4S1)] 138 C1 479 O=C(NNC(=O)c1cc(cn1C)Br)CCCN(S(=O)(=O)c1ccc(cc1)F)C O=C(NNC(=O)c1cc(cn1C)Br)CCCN(S(=O)(=O)c1ccc(cc1)F)C CN(CCCC(=O)NNC(=O)c1cc(Br)cn1C)[S](=O)(=O)c2ccc(F)cc2 InChIKey=JJXKWEQNOJACFI-UHFFFAOYSA-N InChI=1S/C17H20BrFN4O4S/c1-22-11-12(18)10-15(22)17(25)21-20-16(24)4-3-9-23(2)28(26,27)14-7-5-13(19)6-8-14/h5-8,10-11H,3-4,9H2,1-2H3,(H,20,24)(H,21,25) InChI=1/C17H20BrFN4O4S/c1-22-11-12(18)10-15(22)17(25)21-20-16(24)4-3-9-23(2)28(26,27)14-7-5-13(19)6-8-14/h5-8,10-11H,3-4,9H2,1-2H3,(H,20,24)(H,21,25)/f/h20-21H Cn1cc(cc1C(=O)NNC(=O)CCCN(C)S(=O)(=O)c2ccc(cc2)F)Br C01[X(C17H20Br1F1N4O4S1)] 138 C01 479 O=C(NNC(=O)c1cc(cn1C)Br)CCCN(S(=O)(=O)c1ccc(cc1)F)C O=C(NNC(=O)[C]1[CH][C]([CH][N]1C)Br)CCCN(S(=O)(=O)[C]1[CH][CH][C]([CH][CH]1)F)C CN1[CH][C](Br)[CH][C]1C(=O)NNC(=O)CCCN(C)[S](=O)(=O)[C]2[CH][CH][C](F)[CH][CH]2 InChIKey=JJXKWEQNOJACFI-UHFFFAOYSA-N InChI=1S/C17H20BrFN4O4S/c1-22-11-12(18)10-15(22)17(25)21-20-16(24)4-3-9-23(2)28(26,27)14-7-5-13(19)6-8-14/h5-8,10-11H,3-4,9H2,1-2H3,(H,20,24)(H,21,25) InChI=1/C17H20BrFN4O4S/c1-22-11-12(18)10-15(22)17(25)21-20-16(24)4-3-9-23(2)28(26,27)14-7-5-13(19)6-8-14/h5-8,10-11H,3-4,9H2,1-2H3,(H,20,24)(H,21,25)/f/h20-21H 3038.5559953914 -4239.3931548 1-A 32658.4034 121 358 479 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -490.06730 -92.20757 -64.47875 -58.61835 -58.61642 -58.61632 -26.33083 -20.55231 -20.55217 -20.55093 -20.54656 -15.64154 -15.63000 -15.62882 -15.60363 -11.37398 -11.36354 -11.35278 -11.28231 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474.03727 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| 7.6806 8.6288 14.4233 21.9400 32.7535 42.8726 49.6466 68.8002 79.3706 88.4900 96.0259 111.3245 128.6947 135.9967 157.2468 162.8774 192.9575 196.5751 198.7741 207.4280 246.7028 249.6278 281.8394 298.0288 303.6135 318.0990 331.6733 353.7882 367.3487 386.8008 389.8558 411.1914 429.7007 464.9006 466.2933 475.2993 493.6911 531.3230 548.3575 562.4756 582.3202 610.0954 622.4407 632.7718 655.1945 676.7686 691.2789 695.1963 735.8624 778.9889 780.9652 796.2436 817.0105 839.9123 853.8365 911.0802 929.8308 941.1092 945.4365 952.3637 969.0200 983.7969 1016.4946 1041.3533 1070.3021 1083.5734 1112.3370 1112.7668 1126.1414 1142.6874 1152.7360 1183.0958 1187.5079 1188.9850 1198.4577 1225.3184 1236.5372 1256.5998 1258.9970 1260.3402 1271.2204 1283.4443 1303.4728 1325.4305 1337.6869 1362.4081 1387.9190 1397.0404 1416.8543 1436.9164 1444.2968 1447.1227 1450.8843 1471.4828 1492.0247 1530.9245 1541.3377 1554.1425 1561.2223 1584.6791 1601.5323 1615.7155 1615.9837 1631.9075 1638.9504 1647.4560 1648.6958 1650.9688 1651.6133 1657.9002 1658.7523 1683.8250 1723.5340 1744.2169 1788.7601 1806.5480 1956.3521 1997.8429 3196.4622 3201.5359 3226.3981 3236.7098 3244.5382 3257.7886 3291.6644 3306.0801 3328.6851 3339.4026 3339.4117 3350.3702 3400.7484 3404.7412 3415.4435 3424.2115 3447.5389 3462.6426 3869.8169 3881.2149 6.6359 8.0241 7.6955 8.2915 4.4282 6.2965 6.3166 3.6151 4.1570 6.7053 3.1395 3.1377 5.4909 4.2468 1.5680 5.4831 3.3030 5.0367 3.0667 1.1423 4.6603 3.9230 4.3653 8.2786 8.9034 7.2434 4.7435 5.3521 4.4881 4.8915 3.2017 6.0179 5.2090 3.8502 3.9643 4.0417 1.6578 3.4155 6.0996 3.8524 4.1888 7.5632 1.8945 2.9459 2.5676 2.9821 7.1864 4.6000 6.5274 4.5533 3.9936 2.6350 1.6366 4.3540 5.3691 6.6781 1.2680 1.5983 1.5146 1.5568 1.4990 5.2950 6.8683 3.4312 4.1464 1.3313 2.6540 1.3812 3.2891 3.0941 3.4512 1.9418 2.0437 1.8159 3.3155 1.4750 1.9622 1.6414 1.2958 2.8517 2.1782 1.3047 4.2904 1.9546 2.2497 2.3278 1.7152 3.9841 1.7622 1.5600 1.8213 3.6419 1.5143 2.8326 1.2553 4.5240 4.7716 1.5211 2.9806 1.5621 1.5498 1.1766 1.1005 1.0454 1.0858 1.0545 1.4659 1.5367 1.0919 1.0854 1.5318 2.5588 1.7514 3.4227 6.9475 5.5342 10.7998 10.2583 1.0693 1.0676 1.0391 1.0959 1.0686 1.0324 1.1028 1.0990 1.1047 1.1063 1.0937 1.1082 1.0906 1.0923 1.0970 1.0953 1.0984 1.0994 1.0800 1.0779 0.0002 0.0004 0.0009 0.0024 0.0028 0.0068 0.0092 0.0101 0.0154 0.0309 0.0171 0.0229 0.0536 0.0463 0.0228 0.0857 0.0725 0.1147 0.0714 0.0290 0.1671 0.1440 0.2043 0.4332 0.4836 0.4318 0.3074 0.3947 0.3568 0.4312 0.2867 0.5995 0.5667 0.4903 0.5078 0.5380 0.2381 0.5681 1.0806 0.7181 0.8369 1.6586 0.4325 0.6950 0.6494 0.8047 2.0233 1.3099 2.0825 1.6280 1.4351 0.9843 0.6437 1.8097 2.3062 3.2660 0.6459 0.8340 0.7976 0.8320 0.8293 3.0195 4.1813 2.1923 2.7985 0.9210 1.9347 1.0077 2.4576 2.3803 2.7020 1.6014 1.6980 1.5125 2.8057 1.3048 1.7677 1.5271 1.2102 2.6688 2.0739 1.2663 4.2949 2.0231 2.3719 2.5457 1.9466 4.5814 2.0843 1.8978 2.2384 4.4935 1.8781 3.6136 1.6465 6.2471 6.6789 2.1647 4.2804 2.3112 2.3421 1.8097 1.6932 1.6403 1.7184 1.6862 2.3476 2.4679 1.7548 1.7578 2.4832 4.2744 3.0653 6.1351 13.0974 10.6416 24.3535 24.1239 6.4371 6.4473 6.3729 6.7646 6.6277 6.4558 7.0400 7.0777 7.2118 7.2691 7.1863 7.3289 7.4315 7.4604 7.5393 7.5668 7.6917 7.7662 9.5290 9.5670 0.5890 0.0985 0.5097 0.2082 0.5101 5.9171 4.3073 1.0878 1.5363 1.6016 1.4601 1.6717 6.3609 4.1716 1.3222 2.2507 3.5320 3.1751 1.9753 0.5293 1.1564 3.5727 4.3522 1.6864 2.2966 3.4457 3.5095 14.6708 9.3387 20.0094 6.7414 53.0523 13.2142 2.8612 2.6215 3.0818 0.4926 6.7217 10.1993 1.5102 10.3358 81.1259 138.0529 118.3479 23.0033 21.7483 0.2044 0.7053 38.6040 31.3013 4.2790 51.1511 13.4257 92.5788 72.9405 54.9966 3.5449 5.9125 6.6021 62.6612 24.5829 32.7618 42.0451 240.0253 53.3210 0.3523 3.0196 0.0929 2.3818 35.0528 43.5772 8.0909 9.4883 10.9039 77.2284 3.3477 83.6613 42.2213 3.4208 198.0386 138.1374 16.6621 8.4670 122.9754 56.7249 51.3587 82.6957 92.4340 36.4319 67.8906 35.0698 237.5644 6.7483 70.9441 3.7765 38.5122 157.8259 19.0993 13.5766 6.6298 36.1371 1.8985 4.9780 5.9149 0.3448 3.8032 362.9089 41.6691 14.4053 19.6908 14.6596 87.0454 75.0765 30.5382 24.8643 125.6397 393.1350 168.4517 9.5405 40.4842 35.9149 14.3212 19.8389 37.9198 20.8951 21.7791 28.1638 17.6041 6.2889 11.4424 2.0279 1.8426 1.4702 1.9985 2.6750 0.3365 24.6731 63.3272 1.6334 2.0199 0.7767 0.3295 5.9309 1.0755 1.1649 1.0414 1.0877 0.9968 0.1812 0.3843 1.4644 0.1638 0.5554 0.2185 1.1965 1.7746 0.6811 0.2913 1.2156 0.3052 1.0756 3.9198 5.5029 1.0997 2.5031 1.9681 1.5049 1.6677 0.7161 2.4094 1.2621 0.1475 0.3599 2.4063 2.0713 1.3356 1.6149 1.2932 0.9926 0.3660 6.0935 1.9974 0.5737 0.8925 6.7844 1.3646 4.6996 4.1652 2.6432 1.8239 2.8171 6.1812 4.7236 23.4705 1.9270 1.3122 1.3498 1.5675 0.9989 1.5746 12.6830 3.4730 6.8566 0.3866 0.0686 0.0443 8.2822 2.0760 40.3018 5.6334 2.1146 4.5103 3.8211 8.1516 7.6238 7.7446 2.6569 11.9601 4.4847 3.3892 1.1799 14.4668 1.0018 0.7128 0.6716 4.1682 2.4603 1.7126 3.7862 6.3726 20.9140 22.0451 7.5202 2.9382 179.8212 10.4434 0.4096 0.4722 31.6746 5.5342 11.6131 18.4222 6.7420 26.3873 6.4012 10.9586 15.0351 8.1108 39.4058 0.8954 2.0656 23.2478 6.2359 27.3304 76.2675 9.8799 9.0698 122.4213 102.6953 50.0077 41.5265 110.8108 16.4819 72.5114 54.0507 61.5427 18.3982 60.3682 40.7520 107.7441 97.0118 91.3093 47.2484 63.9698 64.5185 18.8208 0.7462 0.7499 0.7400 0.7454 0.7492 0.7250 0.7239 0.7108 0.5697 0.7149 0.7422 0.7407 0.7022 0.7458 0.7500 0.3752 0.7363 0.1148 0.6529 0.1956 0.6869 0.7494 0.6982 0.6736 0.2008 0.1946 0.5042 0.7174 0.7171 0.7474 0.7497 0.3690 0.5637 0.6996 0.7025 0.2581 0.6184 0.5129 0.6028 0.7288 0.7425 0.7499 0.2180 0.5844 0.3097 0.6639 0.7327 0.7263 0.1039 0.2866 0.0914 0.6020 0.1882 0.1461 0.1118 0.1043 0.7177 0.6657 0.3793 0.7500 0.5724 0.3084 0.1129 0.7500 0.2244 0.6419 0.2326 0.7344 0.7385 0.7156 0.3225 0.4840 0.6794 0.6261 0.3768 0.6545 0.4172 0.1062 0.7463 0.0519 0.5434 0.7371 0.5522 0.2869 0.4703 0.5706 0.6726 0.1108 0.7402 0.6239 0.4110 0.7437 0.7500 0.7444 0.7279 0.6867 0.3565 0.2491 0.7054 0.2498 0.6308 0.7466 0.7078 0.7281 0.5924 0.6769 0.1963 0.1684 0.7125 0.6975 0.5424 0.3568 0.4631 0.4758 0.7430 0.6277 0.2816 0.1360 0.7438 0.1310 0.0558 0.7498 0.0895 0.0063 0.5405 0.4813 0.7091 0.7080 0.3182 0.7470 0.5643 0.4847 0.1394 0.1652 0.3179 0.2841 0.1108 0.5924 0.8546 0.8571 0.8506 0.8542 0.8566 0.8406 0.8398 0.8309 0.7258 0.8338 0.8520 0.8510 0.8251 0.8544 0.8571 0.5457 0.8481 0.2059 0.7900 0.3273 0.8144 0.8568 0.8223 0.8050 0.3344 0.3258 0.6704 0.8354 0.8352 0.8555 0.8570 0.5390 0.7210 0.8232 0.8252 0.4103 0.7642 0.6780 0.7522 0.8431 0.8522 0.8571 0.3579 0.7377 0.4729 0.7980 0.8457 0.8415 0.1882 0.4455 0.1675 0.7516 0.3168 0.2549 0.2011 0.1889 0.8356 0.7993 0.5499 0.8571 0.7280 0.4714 0.2028 0.8571 0.3665 0.7819 0.3774 0.8469 0.8496 0.8343 0.4877 0.6523 0.8091 0.7701 0.5473 0.7912 0.5888 0.1920 0.8547 0.0988 0.7041 0.8487 0.7115 0.4459 0.6397 0.7266 0.8042 0.1995 0.8507 0.7684 0.5825 0.8530 0.8571 0.8535 0.8425 0.8143 0.5256 0.3989 0.8272 0.3997 0.7736 0.8549 0.8289 0.8427 0.7440 0.8073 0.3282 0.2883 0.8321 0.8218 0.7033 0.5259 0.6330 0.6448 0.8526 0.7713 0.4394 0.2395 0.8531 0.2317 0.1056 0.8570 0.1643 0.0126 0.7017 0.6499 0.8298 0.8290 0.4827 0.8552 0.7215 0.6529 0.2447 0.2835 0.4824 0.4424 0.1995 0.7440 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 7 6 6 6 6 6 8 7 7 6 8 6 6 6 7 6 16 8 8 6 6 6 6 6 6 9 35 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 14.00307 12.00000 31.97207 15.99491 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 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 5784.3842 60621.7339 63507.4344 0.99997 0.00779 -0.00267 -0.00783 0.99982 -0.01716 0.00254 0.01718 0.99985 1 0.01497 0.00143 0.00136 0.31200 0.02977 0.02842 11.05 12.41 20.75 31.57 47.13 61.68 71.43 98.99 114.20 127.32 138.16 160.17 185.16 195.67 226.24 234.34 277.62 282.83 285.99 298.44 354.95 359.16 405.50 428.80 436.83 457.67 477.20 509.02 528.53 556.52 560.92 591.61 618.24 668.89 670.89 683.85 710.31 764.46 788.96 809.28 837.83 877.79 895.55 910.42 942.68 973.72 994.60 1000.23 1058.74 1120.79 1123.63 1145.62 1175.50 1208.45 1228.48 1310.84 1337.82 1354.05 1360.27 1370.24 1394.20 1415.46 1462.51 1498.28 1539.93 1559.02 1600.40 1601.02 1620.27 1644.07 1658.53 1702.21 1708.56 1710.68 1724.31 1762.96 1779.10 1807.97 1811.42 1813.35 1829.00 1846.59 1875.41 1907.00 1924.63 1960.20 1996.91 2010.03 2038.54 2067.40 2078.02 2082.09 2087.50 2117.14 2146.69 2202.66 2217.64 2236.06 2246.25 2280.00 2304.25 2324.65 2325.04 2347.95 2358.08 2370.32 2372.11 2375.38 2376.30 2385.35 2386.57 2422.65 2479.78 2509.54 2573.63 2599.22 2814.75 2874.45 4599.00 4606.30 4642.07 4656.90 4668.17 4687.23 4735.97 4756.71 4789.24 4804.66 4804.67 4820.44 4892.92 4898.66 4914.06 4926.68 4960.24 4981.97 5567.80 5584.20 0.398942 0.425656 0.426600 0.334131 -4238.994213 -4238.967499 -4238.966554 -4239.059024 3.101459D-04 MUNgauss RevisionA2.1 retrievium 21-May-2021 DUDE Cn1cc(cc1C(=O)NNC(=O)CCCN(C)S(=O)(=O)c2ccc(cc2)F)Br C16270692 RHF 6-31G(d) (6D,10F) C1 474.037266 |X|Y|Z| 48.459533 30.985243 171.321181 63.598723 20 6 7 16 15 4 1 |36.858105| |13.076441|53.358707| |7.691139|19.228633|36.858105| |5.281649|11.761410|13.979813|36.858105| |5.229322|11.660638|8.529194|13.563672|36.858105| |7.513549|18.929840|8.633290|8.568176|13.905343|36.858105| |6.257906|10.412854|5.272478|5.187250|7.413099|12.925635|36.858105| |6.644764|8.959042|4.546616|4.187364|5.256860|8.073149|15.901325|73.516695| |4.351373|7.082923|4.157733|4.452937|6.488457|7.950499|13.836170|15.037912|53.358707| |3.626323|5.392973|3.255050|3.378197|4.422509|5.206475|8.091422|12.699843|18.899579|53.358707| |3.514314|4.957147|2.997834|3.014878|3.737540|4.441902|6.357372|11.128282|10.957025|18.857196|36.858105| |3.735280|5.258280|3.181911|3.166514|3.862955|4.604966|6.120796|10.299974|9.616942|11.545376|15.960656|73.516695| |2.923546|3.975335|2.467198|2.456760|2.920341|3.372412|4.479361|8.491951|7.029734|10.685229|12.579272|14.133388|36.858105| |2.575355|3.458761|2.197147|2.177467|2.512036|2.834564|3.509224|6.533572|5.303243|6.946970|7.531730|11.962717|12.474762|36.858105| |2.222531|2.949825|1.901871|1.878263|2.125748|2.367349|2.850518|5.393446|4.194146|5.262751|4.914150|7.834295|7.561063|12.482415|36.858105| |1.995957|2.642487|1.730625|1.706751|1.898723|2.085435|2.427756|4.529256|3.523896|4.203746|3.811043|6.535129|4.982765|7.710188|12.947086|53.358707| |2.016453|2.617930|1.713882|1.666492|1.828375|2.023605|2.325064|4.395578|3.271195|3.782531|3.411278|6.078135|4.189324|5.920411|7.713066|17.749131|36.858105| |1.712635|2.287685|1.521663|1.512764|1.670156|1.801311|2.058094|3.795514|3.000786|3.514293|3.007614|5.113144|3.753357|4.937130|7.143437|15.707903|7.257195|388.023441| |1.611763|2.131247|1.421213|1.403363|1.534998|1.658310|1.880417|3.507010|2.691858|3.103421|2.601640|4.423286|3.192976|3.924207|5.505368|10.205665|6.495661|94.454169|73.516695| |1.692028|2.291956|1.528240|1.536199|1.710857|1.829158|2.099595|3.829199|3.127487|3.714994|3.108563|5.140177|3.915830|4.876885|6.696761|10.475004|5.018526|94.601062|13.678542|73.516695| |1.596245|2.142666|1.442284|1.437695|1.571984|1.675872|1.874914|3.404979|2.727090|3.107329|2.641158|4.666477|3.078649|3.983392|4.775778|9.695272|5.903153|76.635109|13.103193|12.989186|36.858105| |1.469157|1.960762|1.328249|1.318316|1.426149|1.516446|1.676043|3.053528|2.404208|2.691338|2.251389|4.006058|2.567846|3.180129|3.730345|7.002296|4.979810|49.575976|11.749536|9.080940|13.759354|36.858105| |1.383043|1.852849|1.265747|1.258937|1.352796|1.427114|1.557337|2.813940|2.229733|2.458491|2.037031|3.674203|2.255748|2.732682|3.036046|5.340605|3.898090|33.671580|7.938361|6.939782|7.952313|13.745072|36.858105| |1.401141|1.893033|1.298215|1.298804|1.397399|1.464484|1.590972|2.843771|2.296231|2.521332|2.089249|3.807151|2.272946|2.755116|2.939551|5.037549|3.563678|30.130605|6.629397|6.616231|6.980975|8.023255|13.837959|36.858105| |1.507885|2.052453|1.402519|1.411080|1.531982|1.604315|1.755091|3.115344|2.568062|2.847559|2.383121|4.348927|2.596134|3.215049|3.359110|5.764461|3.834635|33.714309|6.803020|7.699480|7.953448|6.839686|7.867043|13.772590|36.858105| |1.620221|2.200274|1.487862|1.495031|1.639529|1.732833|1.928437|3.446716|2.841981|3.223813|2.743892|4.924029|3.102432|4.015455|4.374649|8.026657|4.841869|49.570308|8.768600|10.986911|13.701947|7.892589|6.841199|8.025301|13.815599|36.858105| |1.312411|1.777320|1.228673|1.230807|1.314550|1.368170|1.469217|2.613490|2.111525|2.286644|1.872171|3.433989|1.996258|2.358628|2.459426|4.038341|2.914093|23.276990|5.295899|5.290432|4.700590|5.320927|8.193282|14.389901|8.187929|5.327688|97.533100| |3.562354|6.441533|6.586727|10.159719|6.486979|4.700967|3.494685|5.299589|4.441059|3.598789|2.396983|4.446126|2.023870|1.835848|1.613669|2.026858|1.452496|9.554509|2.223895|2.433364|1.291849|1.193172|1.149482|1.190229|1.287143|1.348400|2.560744|2539.412838| |17.660803|12.367781|6.060809|4.554866|4.661451|6.532414|6.085833|12.784013|5.754547|4.927108|3.445781|6.244083|2.946219|2.550695|2.235938|2.705247|2.003732|12.171345|2.884486|3.013664|1.576796|1.452775|1.360133|1.369218|1.469353|1.586963|2.877171|109.382573|0.500000| |17.655726|12.385403|5.938147|4.526320|4.714308|6.739426|6.406331|12.630421|6.159969|5.293244|3.963465|7.767516|3.255175|2.894721|2.455479|2.999225|2.246404|13.215262|3.094687|3.235326|1.731544|1.587623|1.490292|1.509805|1.629317|1.757540|3.168646|108.317937|0.301556|0.500000| |17.632644|12.580175|7.489548|4.929526|4.477627|5.662316|4.668046|8.584241|4.812730|4.112364|2.964250|5.635669|2.531306|2.287871|2.005359|2.492169|1.865678|11.280490|2.670342|2.773918|1.493145|1.385854|1.312952|1.329979|1.422043|1.514952|2.820285|120.230035|0.299534|0.300353|0.500000| |6.958254|12.263883|17.819166|8.642750|5.803706|5.914541|4.177262|6.788601|4.626145|3.790723|2.623760|4.958981|2.216169|2.007436|1.761023|2.204026|1.618603|10.175125|2.392155|2.539918|1.363086|1.264515|1.209364|1.237696|1.328290|1.401426|2.646543|201.389023|0.154870|0.149777|0.224607|0.500000| |4.103949|7.951426|5.830461|8.606434|17.805222|8.704875|6.432408|8.238074|9.157775|6.251283|3.748138|6.734086|2.935817|2.515889|2.129921|2.584487|1.804083|11.978466|2.736434|3.103056|1.586356|1.433023|1.360145|1.410787|1.554674|1.664679|2.985780|201.274816|0.105531|0.106709|0.099674|0.123333|0.500000| |4.001285|6.736240|4.183462|4.713392|7.054351|7.465257|9.336911|10.970767|26.064610|13.030964|6.869468|12.015250|4.542890|3.657482|2.889256|3.384910|2.305601|15.197477|3.385803|3.967749|1.979264|1.744902|1.632933|1.698596|1.909488|2.093085|3.533631|119.511407|0.104295|0.115392|0.093104|0.094613|0.220551|0.500000| |3.372864|4.921142|3.004504|3.101769|3.963694|4.597529|6.835517|11.842206|13.010851|26.056963|9.305869|10.906399|7.481993|4.736244|3.828720|4.093047|2.689951|18.193845|4.066518|4.864452|2.220410|1.931098|1.753517|1.782240|1.997911|2.270375|3.632037|84.142814|0.096725|0.098261|0.078696|0.072273|0.114588|0.192350|0.500000| |3.074810|4.053088|2.482275|2.424061|2.846788|3.362701|4.509958|9.244172|6.539183|9.206036|9.071617|11.512482|17.499603|8.800684|6.918892|6.298763|4.127988|25.029017|5.573721|6.342548|2.852728|2.438120|2.135941|2.117732|2.365449|2.793370|4.205814|67.479592|0.088206|0.095302|0.073508|0.062325|0.078014|0.113671|0.194985|0.500000| |2.635441|3.650283|2.307026|2.336172|2.784014|3.123591|4.061411|7.485264|6.629786|10.204478|8.903353|10.625370|17.532044|8.792416|6.865001|6.261457|3.726557|26.544584|5.629058|7.364043|3.016250|2.507338|2.200326|2.219009|2.541020|3.045686|4.387743|66.579823|0.074391|0.079357|0.063960|0.057589|0.079460|0.120254|0.222878|0.303402|0.500000| |2.409966|3.306671|2.135138|2.148993|2.482244|2.732665|3.302291|5.904015|5.153492|6.612815|6.814159|11.474711|8.851686|17.568864|8.905599|9.597638|5.219558|35.187248|6.682226|9.110825|4.248616|3.294653|2.872316|2.983157|3.618490|4.583991|5.720917|62.464083|0.065515|0.074511|0.059958|0.054117|0.070085|0.102606|0.122282|0.173102|0.211552|0.500000| |2.752985|3.627404|2.289178|2.234059|2.548244|2.915469|3.566341|6.718326|5.167155|6.386828|7.024264|12.982538|8.908396|17.603306|8.793544|9.533385|6.418256|31.453846|6.507343|7.283174|3.793266|3.119006|2.719398|2.740700|3.151044|3.818674|5.323111|63.632462|0.074833|0.088012|0.068073|0.058394|0.069667|0.099592|0.117790|0.210627|0.173682|0.304346|0.500000| |2.282323|2.975246|1.905384|1.860292|2.092836|2.358891|2.851101|5.556502|4.072225|5.039739|4.586316|7.267781|6.916090|8.799350|17.512969|12.365984|7.409261|41.822018|9.355670|9.465264|4.058334|3.375087|2.768746|2.630522|2.905074|3.625129|5.032448|54.117035|0.064627|0.070086|0.057152|0.049218|0.057664|0.076558|0.104207|0.208324|0.170681|0.173605|0.208481|0.500000| |2.080494|2.798972|1.819378|1.816347|2.063157|2.266576|2.719447|5.079124|4.081998|5.168691|4.554748|7.024311|6.906696|8.883274|17.674035|12.445267|5.705613|51.509399|9.764496|14.890445|4.636289|3.600658|2.935480|2.852739|3.276331|4.283044|5.383808|53.563919|0.058435|0.062861|0.052222|0.046709|0.058114|0.078296|0.107406|0.171193|0.205650|0.214758|0.173584|0.302849|0.500000| |1.967442|2.529908|1.655356|1.601088|1.748404|1.940968|2.227997|4.271242|3.094260|3.559076|3.132401|5.475677|3.863596|4.998115|6.754861|12.233521|17.562464|45.429753|12.139710|8.125224|4.925948|4.462992|3.509371|3.129117|3.259068|3.975138|5.879637|47.522884|0.054912|0.060528|0.050689|0.043607|0.047760|0.059990|0.071557|0.110833|0.096939|0.119523|0.146478|0.210578|0.146555|0.500000| |1.860223|2.425367|1.606214|1.565447|1.702663|1.863589|2.102701|3.925419|2.957319|3.353706|2.963214|5.377615|3.476017|4.695885|5.618128|12.363187|17.625004|48.828363|11.224455|8.266923|6.864757|6.164909|4.757278|4.214723|4.384761|5.406159|7.582216|46.943725|0.051030|0.057269|0.048290|0.042365|0.046741|0.058638|0.065964|0.093863|0.087777|0.123593|0.140835|0.146168|0.127288|0.300157|0.500000| |2.239028|2.882016|1.869489|1.804375|1.982271|2.219955|2.563562|4.873854|3.568072|4.108063|3.820141|7.028899|4.573964|6.595875|7.191442|12.513048|17.631168|38.292917|8.485585|7.451281|4.729052|4.058118|3.393909|3.228188|3.516676|4.266483|6.111827|52.932336|0.061348|0.070423|0.057304|0.048962|0.053895|0.069737|0.079728|0.125683|0.107576|0.155443|0.229779|0.195492|0.143830|0.299303|0.303126|0.500000| |1.438573|1.908061|1.290912|1.275944|1.376770|1.468989|1.624862|2.984500|2.312521|2.586291|2.150220|3.795699|2.471126|3.005691|3.617884|6.641467|4.942815|47.417288|13.811815|8.520061|8.941018|17.763122|8.898133|5.679401|4.938413|5.634820|9.610846|39.263576|0.039736|0.043098|0.037743|0.034224|0.038310|0.046296|0.051982|0.066400|0.067092|0.084063|0.082027|0.094206|0.097089|0.131634|0.166641|0.109591|0.500000| |1.302155|1.739504|1.192963|1.183824|1.264385|1.331666|1.443833|2.613474|2.052436|2.243946|1.842322|3.324671|2.023288|2.400435|2.651723|4.516024|3.395157|27.733613|6.935056|5.840284|5.636991|8.850247|17.751255|8.963124|5.629592|4.938563|16.746159|36.946893|0.035615|0.038849|0.034506|0.031799|0.035233|0.041717|0.044600|0.053806|0.054830|0.069159|0.066816|0.068668|0.071293|0.087707|0.113468|0.083335|0.212122|0.500000| |1.500285|2.058626|1.414828|1.431831|1.553356|1.613309|1.751528|3.076600|2.577038|2.831304|2.351697|4.331931|2.500853|3.037078|3.050512|4.977587|3.320744|27.759197|5.689464|6.665367|5.634743|4.937834|5.632895|8.944380|17.751212|8.870478|16.761859|44.702884|0.040402|0.044927|0.039363|0.037187|0.043968|0.053795|0.054797|0.062801|0.068157|0.096586|0.082869|0.073511|0.083093|0.079161|0.102306|0.087523|0.107329|0.124497|0.500000| |1.720339|2.355793|1.587155|1.604641|1.777749|1.877351|2.107635|3.738037|3.159168|3.634847|3.122580|5.569673|3.545932|4.678487|4.887547|8.421280|4.708868|47.341688|8.048266|11.938949|8.901349|5.631286|4.938187|5.681847|8.940202|17.751246|9.627834|49.009134|0.046732|0.051887|0.044380|0.041242|0.050447|0.064896|0.070614|0.085980|0.097591|0.158736|0.119172|0.107804|0.135519|0.106768|0.135901|0.119448|0.124173|0.107325|0.213061|0.500000| 4236.677965 -16154.764438 4917.923644 -280.001862 -7280.164691 3038.556214 -4241.608477 2.001164 403800000000000B 44746638CB3636D7 43F5945577C2DF0A 41C7DA8EE8000001 BBED83C940000000 4342A54C31BC1AA3