Version2.2 2021-02-18T15:15:46Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 15-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1cccc(c1)CN2CCC[C@](C2=O)(C[NH2+]C3C4CC5CC(C4)CC3C5)O C11839237 RHF 6-31G(d) (6D,7F) COc1cccc(c1)CN2CCC[C@](C2=O)(C[NH2+]C3C4CC5CC(C4)CC3C5)O C01[X(C24H35N2O3)] 186 C1 505 COc1cccc(c1)CN1CCC[C@@](C1=O)(O)C[NH2+]C1C2CC3CC1CC(C2)C3 COc1cccc(c1)CN1CCC[C@@](C1=O)(O)C[NH2+]C1C2CC3CC1CC(C2)C3 COc1cccc(CN2CCC[C@@](O)(C[NH2+]C3C4CC5CC(C4)CC3C5)C2=O)c1 InChIKey=HCTMHOIROZSZSR-INLXCBAXSA-O InChI=1S/C24H34N2O3/c1-29-21-5-2-4-16(13-21)14-26-7-3-6-24(28,23(26)27)15-25-22-19-9-17-8-18(11-19)12-20(22)10-17/h2,4-5,13,17-20,22,25,28H,3,6-12,14-15H2,1H3/p+1/t17?,18?,19?,20?,22?,24-/m1/s1 InChI=1/C24H34N2O3/c1-29-21-5-2-4-16(13-21)14-26-7-3-6-24(28,23(26)27)15-25-22-19-9-17-8-18(11-19)12-20(22)10-17/h2,4-5,13,17-20,22,25,28H,3,6-12,14-15H2,1H3/p+1/t17?,18?,19?,20?,22?,24-/m1/s1/fC24H35N2O3/h25H/q+1 COc1cccc(c1)CN2CCC[C@](C2=O)(C[NH2+]C3C4CC5CC(C4)CC3C5)O C01[X(C24H35N2O3)] 186 C01 505 COc1cccc(c1)CN1CCC[C@@](C1=O)(O)C[NH2+]C1C2CC3CC1CC(C2)C3 CO[C]1[CH][CH][CH][C]([CH]1)C[N]1[C](=O)[C@](CCC1)(O)C[NH2][C@@H]1[C@@H]2C[C@@H]3C[C@H]1C[C@H](C2)C3 CO[C]1[CH][CH][CH][C]([CH]1)CN2CCC[C@@](O)(C[NH2]C3C4CC5CC(C4)CC3C5)C2=O InChIKey=CJKIWKAPTUDUAY-QPMWQOQNSA-N InChI=1S/C24H35N2O3/c1-29-21-5-2-4-16(13-21)14-26-7-3-6-24(28,23(26)27)15-25-22-19-9-17-8-18(11-19)12-20(22)10-17/h2,4-5,13,17-20,22,28H,3,6-12,14-15,25H2,1H3/t17-,18+,19-,20+,22-,24-/m1/s1 InChI=1/C24H35N2O3/c1-29-21-5-2-4-16(13-21)14-26-7-3-6-24(28,23(26)27)15-25-22-19-9-17-8-18(11-19)12-20(22)10-17/h2,4-5,13,17-20,22,28H,3,6-12,14-15,25H2,1H3/t17-,18+,19-,20+,22-,24-/m1/s1 2843.1494558652 -1262.5460655 1-A 20462.7880 108 397 505 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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 12.4034 17.6005 20.7269 34.3131 46.7722 52.8653 81.0146 86.5186 107.5467 120.0836 154.7546 182.5315 194.8642 219.9821 236.2107 254.7109 280.4540 293.8518 299.4488 317.8496 341.7128 349.2748 354.5476 381.3030 400.3644 410.2740 425.4183 433.8795 442.8855 473.2165 481.8242 485.2102 493.0641 500.5027 519.7779 546.4243 574.4128 590.8668 595.6301 613.9084 628.6659 679.1490 692.7170 717.2589 720.1517 732.0725 768.9012 779.7720 804.0731 817.3687 841.3904 852.1083 858.5947 878.2968 895.7346 916.8432 946.3946 965.6161 968.9772 972.1865 973.6089 978.4102 983.1331 993.0760 1000.4904 1006.1363 1012.4781 1016.7923 1037.4919 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3261.7441 3263.2153 3273.5680 3281.4106 3286.8380 3300.0505 3303.1658 3339.6661 3344.5007 3368.2552 3369.5545 3375.3475 3389.5938 3411.4898 3642.3536 3752.8307 4029.3397 5.1084 4.0665 4.4183 5.2021 4.1055 3.9651 3.3249 4.8760 4.0683 3.0409 4.6087 4.8385 4.4706 2.9433 1.9723 2.5485 3.0198 3.2323 1.7396 3.1019 2.3776 3.5607 2.7423 2.7710 3.0794 2.3014 2.3035 3.4269 3.5408 2.8450 3.1090 1.8577 3.3381 2.6126 3.4281 3.9035 2.6925 1.2671 3.7451 3.6596 4.6263 3.9473 3.4750 3.3500 3.5365 3.4143 3.0775 2.8794 4.3354 3.9775 2.4802 5.3049 2.5825 2.9171 1.5319 1.5982 2.2145 2.0265 1.7507 1.6386 1.6409 2.7896 2.0373 2.2142 1.9725 1.7708 1.6519 2.0829 2.0448 2.1821 2.5952 2.7027 2.3366 4.1088 2.7251 1.3279 1.8736 1.8882 2.3794 2.7369 1.9821 1.5770 1.6883 3.1046 1.7081 1.6959 1.5995 2.5728 1.0715 1.1336 2.2483 1.4654 1.3812 1.7143 2.2701 1.2666 1.6549 1.2409 1.3841 1.2035 1.7488 1.3933 1.0408 1.5126 1.4835 1.6064 1.5760 1.2594 1.6457 3.7972 1.5455 1.4281 1.6872 1.3405 1.3517 1.5035 1.8172 1.6857 1.5124 1.3158 1.5143 1.3893 1.4207 1.4808 1.4672 1.5645 1.4325 1.6729 1.5489 1.3131 1.3742 2.1120 1.1347 1.2151 1.3829 1.0970 1.1068 1.1009 1.0479 1.0960 1.0861 1.1001 1.0653 1.4407 2.2143 1.0902 1.7080 5.3561 5.6153 1.0732 9.8384 1.0755 1.0748 1.0679 1.0802 1.0725 1.0669 1.0637 1.0342 1.0697 1.0859 1.0693 1.0887 1.1020 1.0893 1.0724 1.0950 1.0932 1.0942 1.0977 1.0960 1.0885 1.1079 1.1050 1.0614 1.0962 1.1025 1.0978 1.0890 1.1117 1.0924 1.0952 1.0938 1.0636 1.0857 1.0663 0.0005 0.0007 0.0011 0.0036 0.0053 0.0065 0.0129 0.0215 0.0277 0.0258 0.0650 0.0950 0.1000 0.0839 0.0648 0.0974 0.1399 0.1644 0.0919 0.1846 0.1636 0.2559 0.2031 0.2374 0.2908 0.2282 0.2456 0.3801 0.4092 0.3754 0.4253 0.2577 0.4781 0.3856 0.5457 0.6867 0.5234 0.2606 0.7828 0.8126 1.0773 1.0727 0.9825 1.0154 1.0806 1.0781 1.0720 1.0315 1.6515 1.5656 1.0345 2.2694 1.1217 1.3258 0.7242 0.7915 1.1686 1.1133 0.9685 0.9125 0.9164 1.5734 1.1602 1.2866 1.1633 1.0562 0.9977 1.2687 1.2968 1.4368 1.7486 1.8433 1.6067 2.8367 1.9618 0.9708 1.4015 1.4249 1.8121 2.1025 1.5330 1.2825 1.3940 2.5848 1.4664 1.4768 1.3976 2.2854 0.9602 1.0295 2.0485 1.3501 1.2782 1.6555 2.2237 1.2484 1.6355 1.2623 1.4261 1.2517 1.8706 1.5022 1.1302 1.6679 1.7148 1.9123 1.9052 1.5353 2.0271 4.6911 1.9412 1.7994 2.1522 1.7408 1.7595 1.9653 2.3894 2.2221 1.9995 1.7657 2.0593 1.9137 1.9644 2.0506 2.0411 2.1862 2.0132 2.3539 2.2044 1.9543 2.0555 3.2521 1.7761 1.9118 2.1811 1.7313 1.7529 1.7456 1.6826 1.7606 1.7488 1.7779 1.7277 2.3440 3.6353 1.7971 2.8659 10.0963 10.9185 2.1300 20.5635 6.3374 6.3792 6.4425 6.5175 6.5049 6.4827 6.4695 6.2989 6.5224 6.6851 6.6011 6.7437 6.8530 6.7767 6.6845 6.8260 6.8180 6.8318 6.8808 6.8760 6.8723 7.0288 7.0335 6.8101 7.0469 7.2449 7.2351 7.2794 7.4364 7.3326 7.4139 7.5003 8.3133 9.0090 10.2004 0.0234 0.3330 0.1990 0.9657 2.4221 1.7042 7.3334 4.0204 1.8967 0.7768 2.1457 1.3480 0.2243 0.9718 0.3773 9.4024 1.3930 4.6682 1.3306 3.7526 2.3051 11.2857 4.4134 4.7390 6.5102 19.8274 5.4799 18.2849 0.1682 0.5946 3.4456 2.3278 0.9950 0.6030 4.1293 39.6277 31.6796 115.5367 24.0812 4.9459 19.5968 1.8530 0.3987 7.1815 5.2838 7.0748 1.0104 17.5237 5.4157 10.8438 2.9336 37.9160 1.2008 0.6150 41.1739 1.3894 1.2721 2.2411 2.0854 0.4368 0.0866 12.1967 1.3183 2.4363 18.9479 16.8634 1.9039 14.1800 4.3816 8.0055 40.3365 7.1319 18.3886 16.1733 26.4622 1.9576 9.7197 1.0132 7.8251 2.1776 14.0734 9.2899 9.5951 90.8487 2.9555 6.4527 6.6789 5.6137 1.5862 7.1418 20.4995 25.3233 25.8709 3.8116 88.8997 4.1761 23.4787 7.2021 22.6367 18.9393 86.4360 23.3239 2.8783 69.6763 32.5621 96.0474 6.0735 24.8527 28.2382 300.5600 11.2117 42.8346 7.2453 0.0840 0.0529 11.1771 0.9174 0.7808 28.4533 5.9290 4.9704 63.6670 20.9485 0.7097 14.2488 16.4623 2.5527 5.3387 27.3738 57.7685 165.9081 143.5460 1.7126 15.5784 5.3024 2.3517 2.2137 4.7125 5.6646 8.4088 29.1367 18.7693 11.2476 49.6535 63.1720 2.0180 68.3134 89.3922 95.8833 39.5465 418.3626 29.6904 103.0071 42.9051 22.8008 40.3067 17.9395 29.5576 45.8952 36.9644 60.9715 10.3228 50.6756 4.5818 29.1143 15.1126 9.8512 36.0647 3.4702 74.1783 56.4289 22.2837 48.0619 21.8951 3.4072 11.7586 33.6016 1.5980 8.5113 2.1537 5.4963 10.1197 9.9394 82.2670 53.2474 114.3516 0.7098 0.5211 1.7788 1.1915 0.3475 1.7111 0.2319 0.3811 0.4496 1.1026 1.2964 0.2234 0.8739 3.3268 1.5362 0.2432 0.5781 1.0564 0.7095 0.0859 0.1578 1.2083 0.0594 0.4289 0.6301 0.1977 0.4646 0.8465 0.6423 1.0574 1.0997 0.2143 1.9447 0.9783 1.2677 4.2085 2.1821 2.2042 1.8741 1.0648 1.6315 0.7666 1.6129 4.0682 3.2614 1.0953 1.9231 3.2093 23.1671 20.6829 0.6207 3.1033 0.1020 1.3908 1.8721 2.8067 4.1536 0.9286 0.4120 0.0695 0.0751 2.4893 0.9797 3.6183 2.4880 3.9700 2.9833 1.9772 8.8219 9.6042 6.3962 9.2458 5.3830 21.3015 9.1290 0.5643 4.5247 3.0173 1.7228 5.3636 1.9437 2.1958 4.7042 6.0352 3.7100 2.9690 2.8914 4.2533 0.8818 1.0493 7.5281 9.9946 7.6873 2.5279 2.3289 4.9177 6.4330 10.9892 3.3684 10.9159 8.7764 10.2010 43.9169 3.5329 11.9170 0.9425 3.2461 6.5928 4.1724 12.3417 2.1444 0.4906 2.6348 0.1015 0.1679 2.7331 0.3950 0.4541 4.3332 2.5202 4.4469 6.2835 1.0028 1.3797 1.0256 1.5627 8.0290 2.2567 1.8216 4.4330 1.1329 2.7096 17.2684 10.8089 2.7031 24.4811 16.9854 18.1145 24.9578 3.5330 5.2413 0.6519 11.8130 4.0194 1.0826 4.0973 3.1133 19.4312 15.9197 6.8901 7.4718 30.0562 111.5671 23.1762 88.7089 98.3359 35.1437 42.2653 107.3880 97.5703 68.9331 61.8648 69.1203 24.3877 188.5328 63.8518 20.0177 69.2936 64.6550 159.1819 250.5424 72.0202 47.5944 74.4959 58.9899 90.3266 128.0225 39.3565 54.6546 19.3620 62.3383 74.6820 123.8448 33.7657 10.1548 30.1894 0.7430 0.7463 0.7424 0.7445 0.7102 0.6590 0.6522 0.6452 0.5191 0.6468 0.2394 0.4346 0.7476 0.7495 0.7320 0.3452 0.7096 0.2593 0.7475 0.3397 0.0687 0.1119 0.7227 0.7482 0.3942 0.7046 0.4795 0.5330 0.6142 0.3613 0.5405 0.7288 0.4768 0.3057 0.6055 0.2337 0.7089 0.6349 0.6391 0.7340 0.5797 0.7424 0.7328 0.1139 0.3545 0.4091 0.1127 0.2578 0.0123 0.0254 0.0589 0.0767 0.5673 0.6704 0.3826 0.3299 0.6578 0.6116 0.5703 0.7440 0.4556 0.4385 0.6043 0.4525 0.5131 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0.8390 0.8559 0.5655 0.8267 0.6482 0.6954 0.7610 0.5308 0.7018 0.8432 0.6458 0.4683 0.7543 0.3789 0.8296 0.7767 0.7798 0.8466 0.7339 0.8521 0.8458 0.2046 0.5234 0.5807 0.2026 0.4099 0.0244 0.0496 0.1112 0.1425 0.7239 0.8027 0.5534 0.4961 0.7936 0.7590 0.7264 0.8532 0.6260 0.6096 0.7534 0.6231 0.6782 0.6624 0.7688 0.8525 0.8299 0.7870 0.8270 0.3897 0.8036 0.1160 0.6518 0.8505 0.8571 0.6889 0.8535 0.7307 0.8220 0.7192 0.7768 0.5771 0.6168 0.8427 0.8547 0.6260 0.6552 0.8280 0.5866 0.5541 0.5632 0.5209 0.7572 0.8564 0.6354 0.8539 0.8240 0.8533 0.6370 0.8548 0.8515 0.8446 0.8563 0.7992 0.8444 0.8520 0.5899 0.2457 0.6936 0.8287 0.5373 0.8368 0.8137 0.6649 0.8151 0.8570 0.8246 0.8168 0.8095 0.5411 0.8379 0.8571 0.8308 0.7434 0.8491 0.7242 0.8019 0.7774 0.7879 0.7404 0.8386 0.7568 0.5532 0.8563 0.8499 0.8524 0.8565 0.6742 0.7739 0.8554 0.8072 0.8378 0.7807 0.5316 0.8121 0.7667 0.8562 0.6581 0.5551 0.5537 0.5389 0.4436 0.5288 0.2994 0.8559 0.5504 0.0460 0.2318 0.5102 0.5956 0.6757 0.6514 0.3431 0.2150 0.4604 0.4190 0.4867 0.7955 0.2992 0.3361 0.8500 0.6209 0.0217 0.5598 0.6669 0.5708 0.8094 0.8293 0.4953 0.3301 0.3333 0.1706 0.5265 0.3444 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 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 6 8 6 6 6 6 6 6 6 7 6 6 6 6 6 8 6 7 1 1 6 6 6 6 6 6 6 6 6 6 8 1 1 1 1 1 1 1 1 1 1 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 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 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 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 2887.3476 34650.7943 35176.4159 1.00000 0.00112 0.00196 -0.00109 0.99993 -0.01158 -0.00197 0.01158 0.99993 1 0.03000 0.00250 0.00246 0.62505 0.05208 0.05131 17.85 25.32 29.82 49.37 67.29 76.06 116.56 124.48 154.74 172.77 222.66 262.62 280.37 316.51 339.85 366.47 403.51 422.79 430.84 457.31 491.65 502.53 510.11 548.61 576.04 590.29 612.08 624.26 637.21 680.85 693.24 698.11 709.41 720.11 747.84 786.18 826.45 850.13 856.98 883.28 904.51 977.14 996.67 1031.98 1036.14 1053.29 1106.28 1121.92 1156.88 1176.01 1210.57 1225.99 1235.33 1263.67 1288.76 1319.13 1361.65 1389.31 1394.14 1398.76 1400.81 1407.71 1414.51 1428.81 1439.48 1447.61 1456.73 1462.94 1492.72 1521.00 1538.60 1548.00 1554.30 1557.45 1590.41 1602.68 1621.20 1628.32 1635.78 1642.89 1648.45 1690.33 1703.23 1710.35 1736.75 1749.17 1752.11 1766.67 1774.39 1786.26 1789.22 1799.18 1803.18 1842.00 1855.14 1860.92 1863.36 1890.51 1902.64 1911.63 1938.57 1946.30 1953.26 1968.35 2015.28 2045.11 2060.95 2069.55 2080.36 2083.41 2100.76 2104.05 2117.04 2136.03 2138.56 2143.02 2149.33 2152.09 2155.21 2171.38 2185.85 2199.91 2204.08 2205.79 2210.86 2215.78 2222.10 2223.49 2236.14 2286.74 2292.43 2325.96 2345.16 2351.10 2354.03 2354.72 2358.91 2360.23 2375.20 2375.72 2378.52 2382.90 2387.03 2390.89 2401.70 2406.55 2428.00 2573.50 2613.74 2640.68 2709.92 4550.15 4566.51 4604.03 4604.23 4616.36 4620.55 4622.71 4625.96 4628.49 4650.73 4657.16 4665.03 4674.29 4675.32 4679.82 4679.89 4681.14 4683.79 4692.92 4695.04 4709.93 4721.22 4729.03 4748.04 4752.52 4805.03 4811.99 4846.17 4848.04 4856.37 4876.87 4908.37 5240.53 5399.49 5797.32 0.616276 0.640057 0.641002 0.559638 -1261.929789 -1261.906008 -1261.905064 -1261.986428 2.728962D-04 MUNgauss RevisionA2.1 retrievium 18-Feb-2021 DUDE COc1cccc(c1)CN2CCC[C@](C2=O)(C[NH2+]C3C4CC5CC(C4)CC3C5)O C11839237 RHF 6-31G(d) (6D,10F) C1 399.264768 |X|Y|Z| 33.683293 28.926077 135.983311 50.979617 25 6 7 23 2 |36.858105| |13.576204|73.516695| |8.012301|25.213248|36.858105| |6.712303|14.002657|13.770806|36.858105| |4.505950|9.254651|7.955322|13.683219|36.858105| |3.783359|8.209301|6.838283|7.888084|13.832723|36.858105| |3.978514|9.416814|7.890088|6.836111|7.957043|13.638996|36.858105| |5.258730|14.617550|13.636795|7.929406|6.920209|7.939795|13.813125|36.858105| |3.111797|7.022988|5.011351|4.428772|5.031966|7.542086|12.576086|7.594978|36.858105| |2.732813|5.940872|4.068021|3.757003|4.299592|6.011387|7.641207|5.473769|12.951583|53.358707| |2.779410|6.057100|3.965982|3.540277|3.791419|4.771035|6.030421|5.178565|7.644358|17.717382|36.858105| |2.460577|5.126168|3.285767|3.093355|3.347834|3.991614|4.443169|3.907006|5.030501|10.487876|12.541241|36.858105| |2.095202|4.278495|2.718514|2.614334|2.881512|3.442749|3.697208|3.186657|4.403419|9.067515|7.676802|12.517172|36.858105| |2.088094|4.257885|2.772244|2.732924|3.141776|3.901791|4.022264|3.265677|4.949692|10.409855|6.488885|7.626831|12.467992|36.858105| |2.380615|4.979957|3.361295|3.284626|3.896195|5.301108|5.648837|4.167909|7.882417|19.497480|7.707600|6.734495|7.358386|12.333956|36.858105| |2.289129|4.717917|3.200264|3.226514|3.953999|5.416084|5.293013|3.859039|6.902181|11.497772|5.295992|4.763679|5.193268|8.170024|15.723665|73.516695| |1.826176|3.675765|2.345483|2.310673|2.619449|3.169285|3.262720|2.724358|4.036006|7.310676|4.599063|4.949305|7.455982|12.378639|7.690557|12.153924|36.858105| |1.644145|3.251764|2.042539|2.032475|2.275511|2.647549|2.670946|2.304350|3.114737|5.354881|3.662774|4.215667|6.238775|7.729764|5.036768|8.296197|12.745732|53.358707| |1.672981|3.290990|2.078286|2.096821|2.369629|2.736898|2.696660|2.317956|3.057575|5.254386|3.603190|4.288870|6.125791|7.762280|4.981532|8.298674|9.430249|25.605248|0.500000| |1.619840|3.203037|1.991636|1.962391|2.163318|2.491791|2.554042|2.244388|2.964729|5.117932|3.699779|4.401942|6.764594|6.884894|4.536114|7.162084|9.222071|25.762711|0.328601|0.500000| |1.475147|2.886616|1.795703|1.794786|1.997094|2.284276|2.286602|1.999857|2.627923|4.249712|2.886058|3.165411|4.191281|4.949434|3.836464|6.776192|7.435413|17.106977|0.254954|0.254340|36.858105| |1.363616|2.637208|1.625800|1.635666|1.804731|2.017438|1.999275|1.778988|2.228123|3.543392|2.482289|2.779896|3.532556|3.884625|3.079349|5.406245|4.915623|10.376524|0.202248|0.194086|12.392206|36.858105| |1.321847|2.553932|1.557918|1.552082|1.686992|1.871413|1.882270|1.702377|2.092119|3.335385|2.423828|2.756387|3.494796|3.535111|2.797712|4.751572|4.244595|8.480950|0.160434|0.193665|7.512250|12.371129|36.858105| |1.270873|2.460686|1.490780|1.470390|1.584712|1.760700|1.796761|1.637228|2.019904|3.174103|2.308892|2.545292|3.179374|3.182318|2.613344|4.443945|3.912631|7.029013|0.123944|0.160974|6.426209|7.566853|12.394345|36.858105| |1.178001|2.266759|1.370040|1.358184|1.463691|1.614971|1.635450|1.493936|1.823168|2.796587|2.002407|2.157860|2.605043|2.686202|2.296448|4.010717|3.273522|5.530350|0.101123|0.116625|5.378635|6.462102|7.595977|12.394965|36.858105| |1.206804|2.323443|1.414893|1.412465|1.537808|1.705096|1.709589|1.544211|1.910113|2.914188|2.033949|2.167857|2.618941|2.828183|2.443089|4.378554|3.550632|5.962243|0.109400|0.116635|6.537304|7.572753|6.473849|7.581042|12.399384|36.858105| |1.250361|2.401812|1.472130|1.484616|1.630967|1.805334|1.783056|1.598782|1.971215|3.038147|2.111656|2.294351|2.787606|3.067868|2.592242|4.672767|3.793984|6.774804|0.132106|0.127454|7.689459|12.370081|7.586363|6.464299|7.587758|12.397328|36.858105| |1.284514|2.493771|1.525798|1.513965|1.654544|1.860694|1.883116|1.685873|2.149471|3.281193|2.247603|2.347035|2.871347|3.182771|2.781686|5.026196|4.242701|6.740017|0.116405|0.127499|7.702441|6.468607|5.370462|6.467347|7.594035|12.401013|7.604639|36.858105| |1.408635|2.761416|1.699567|1.675488|1.837082|2.096174|2.144644|1.902381|2.498172|3.950136|2.713576|2.875748|3.708668|4.127286|3.414743|5.980080|6.041097|10.241307|0.155969|0.194078|12.403136|7.551625|6.454806|7.560192|6.457563|7.559907|6.453978|12.361139|36.858105| |1.362685|2.665988|1.622356|1.586053|1.713490|1.933783|2.001761|1.809235|2.309952|3.666906|2.637224|2.850277|3.665979|3.715904|3.041646|5.126477|4.906593|8.416025|0.134428|0.193920|7.523722|6.464145|7.595823|12.390116|7.591619|6.467976|5.366508|7.581956|12.372931|36.858105| |2.039578|4.076343|2.663414|2.724666|3.197358|3.843188|3.677416|3.011901|4.110380|7.646748|4.968299|6.151315|8.020199|13.520638|8.024110|12.263160|8.031180|9.603755|0.247659|0.167965|4.775915|4.025170|3.543030|3.028322|2.601419|2.773013|3.152343|2.997014|3.713395|3.327435|73.516695| |17.657793|16.989941|5.886962|4.899152|3.615046|3.181313|3.412584|4.423276|2.798832|3.385073|2.567028|2.283208|1.957724|1.929967|2.171936|3.697919|1.705794|2.102513|0.043453|0.042507|1.392662|1.291530|1.259823|1.217732|1.129954|1.152243|1.187867|1.224691|1.339664|1.304287|3.329662|0.500000| |17.567477|16.428346|7.015000|6.708669|4.556536|3.720314|3.771598|4.743849|2.957670|3.647841|2.758494|2.506230|2.118467|2.099329|2.359606|4.015862|1.820996|2.250998|0.047095|0.045329|1.478736|1.375885|1.335442|1.275392|1.179856|1.206979|1.257663|1.277190|1.401798|1.359159|3.698966|0.299996|0.500000| |17.571733|16.434021|7.060609|6.720349|4.575442|3.742289|3.797895|4.781898|2.977731|3.515912|2.555658|2.271062|1.971557|1.997748|2.289028|3.988459|1.765513|2.163598|0.044949|0.043234|1.437618|1.328648|1.280245|1.231599|1.148547|1.182649|1.225681|1.259630|1.372571|1.319347|3.488756|0.299945|0.298721|0.500000| |7.416348|12.464004|8.877567|17.766213|8.925202|5.641764|4.936877|5.628025|3.545193|4.243685|2.995943|2.705071|2.320113|2.405841|2.800761|4.924261|2.066025|2.517748|0.053168|0.049756|1.650411|1.521346|1.447752|1.370695|1.272443|1.320938|1.389665|1.405234|1.542024|1.465663|4.323412|0.145283|0.223628|0.221967|0.500000| |3.905836|7.460829|5.664862|8.942605|17.716218|8.956542|5.651399|4.976439|4.096216|5.012418|3.265752|3.012827|2.665339|2.936542|3.519675|6.522556|2.486119|2.992681|0.064269|0.057734|1.950329|1.780259|1.653152|1.542872|1.434167|1.513995|1.617979|1.616924|1.778859|1.652325|5.494163|0.088916|0.112611|0.112958|0.217072|0.500000| |3.128079|6.513474|4.935043|5.621946|8.925809|17.728859|8.870706|5.646925|6.986974|8.333427|4.558111|3.978569|3.611507|4.358509|6.106465|12.235141|3.543808|3.976624|0.084668|0.074788|2.517035|2.200217|2.004261|1.871197|1.720232|1.838301|1.964294|2.014600|2.272102|2.058289|7.850078|0.074996|0.086232|0.086768|0.124197|0.215346|0.500000| |4.895739|13.606838|8.972481|5.666681|4.976984|5.627719|8.880339|17.716598|6.986655|7.044909|5.218462|3.821402|3.124862|3.110971|3.876010|6.260831|2.642817|3.047782|0.061774|0.061254|1.949933|1.733084|1.675602|1.628787|1.483040|1.521823|1.560068|1.666306|1.883613|1.809960|4.976671|0.122130|0.119879|0.120965|0.124302|0.107933|0.123693|0.500000| |3.104956|7.115232|4.780771|3.986023|4.202405|5.588608|8.884947|7.349896|17.585265|12.545310|7.239586|4.634729|4.054030|4.265315|5.998174|9.295905|3.644141|3.906506|0.076998|0.077394|2.455536|2.093864|1.997691|1.959851|1.769066|1.834017|1.865280|2.067605|2.395797|2.253490|6.232360|0.079310|0.080509|0.081675|0.090691|0.096451|0.140714|0.223958|0.500000| |2.807227|6.113796|4.271815|3.978319|4.664518|6.882270|8.876115|5.835870|17.677317|12.538497|5.656987|4.200837|3.979214|4.762681|7.694618|14.412925|4.147339|4.288435|0.085319|0.081496|2.718560|2.274172|2.098962|2.035596|1.859346|1.976867|2.035133|2.252062|2.592537|2.340368|7.124951|0.070462|0.073956|0.076517|0.090648|0.109905|0.198866|0.149036|0.302431|0.500000| |3.260821|7.354683|4.866166|4.146896|4.264145|5.225051|6.986654|6.551157|7.449637|12.577080|17.628177|8.882357|5.566112|4.929805|5.901639|8.019564|3.694668|4.177818|0.085251|0.085811|2.499237|2.198603|2.150611|2.048629|1.801441|1.828472|1.900254|1.997735|2.354912|2.295950|7.426750|0.082890|0.090020|0.081397|0.095717|0.098881|0.129202|0.184150|0.201354|0.147242|0.500000| |2.590202|5.614289|3.528750|3.094127|3.225242|3.932966|4.987152|4.561247|6.554607|12.399169|17.526581|8.835395|6.804918|5.547508|6.202164|8.104426|4.381572|4.787388|0.093090|0.100822|2.824549|2.420405|2.402511|2.344172|2.025779|2.035577|2.073877|2.267948|2.748789|2.721390|7.432605|0.067799|0.070487|0.066236|0.074032|0.078098|0.104694|0.136553|0.199329|0.142413|0.302621|0.500000| |2.569859|5.293130|3.456001|3.367798|3.721115|4.370837|4.576832|3.974472|4.770710|9.294415|8.865898|17.564851|8.867265|6.978053|6.356100|8.440914|4.500877|5.390000|0.117409|0.111571|3.019041|2.706180|2.640348|2.389261|2.053423|2.082667|2.243146|2.224748|2.673764|2.611273|11.975611|0.065345|0.073993|0.065948|0.081885|0.093974|0.121618|0.103536|0.117034|0.112101|0.217888|0.173657|0.500000| |2.392659|4.933420|3.056195|2.840931|2.969870|3.394805|3.789777|3.540561|4.143177|7.637706|8.914932|17.581086|8.834477|5.526424|4.907983|6.683038|4.079036|5.013721|0.103225|0.110450|2.858357|2.579448|2.634848|2.455658|2.074332|2.045953|2.146591|2.187212|2.651300|2.712078|8.440626|0.062564|0.068020|0.060727|0.070253|0.074717|0.092095|0.098903|0.111594|0.097386|0.210927|0.217786|0.302431|0.500000| |1.940541|3.888938|2.439903|2.382725|2.611872|3.020211|3.142687|2.770892|3.562467|6.686032|5.545152|8.819459|17.550418|8.878662|5.481671|7.630794|6.446507|8.927978|0.190467|0.213043|4.347998|3.861533|3.937520|3.428866|2.748750|2.720758|2.955435|2.892195|3.722130|3.792962|13.771757|0.050569|0.055005|0.050818|0.059739|0.068428|0.088203|0.075181|0.091815|0.091324|0.123960|0.140299|0.211795|0.212637|0.500000| |1.996873|4.084910|2.551501|2.410393|2.608031|3.094811|3.417611|3.013553|4.198231|8.204245|7.055762|8.895536|17.512091|8.838745|6.266442|8.237211|7.206753|8.128886|0.148712|0.190533|4.189478|3.471314|3.536277|3.370613|2.721725|2.690397|2.773079|3.003323|3.962164|4.058419|10.316110|0.052384|0.055520|0.052214|0.059658|0.066747|0.089013|0.084415|0.112850|0.106451|0.142274|0.205523|0.174039|0.212887|0.301162|0.500000| |1.793841|3.628393|2.287903|2.211793|2.459352|2.962420|3.155891|2.685111|4.015657|7.102911|4.604406|4.701478|6.842179|8.685171|6.661899|10.313023|17.650383|12.302976|0.182721|0.226499|6.508763|4.412124|4.041432|4.000594|3.321158|3.515914|3.544408|4.358432|6.420872|5.406851|10.182144|0.046902|0.049308|0.048062|0.054944|0.064153|0.089660|0.073960|0.105051|0.114322|0.101781|0.130077|0.113361|0.111295|0.159168|0.217379|0.500000| |1.805557|3.618664|2.324654|2.320086|2.670677|3.248981|3.262011|2.684605|4.007229|6.797296|4.039081|4.135418|5.481435|8.841726|7.356603|14.141412|17.671896|12.418541|0.216530|0.181301|7.157622|4.699719|3.832156|3.557481|3.138205|3.561277|3.837612|4.347008|5.752227|4.340978|12.691469|0.046668|0.049843|0.048978|0.057664|0.071135|0.103830|0.071507|0.098676|0.120352|0.093514|0.105837|0.108977|0.095754|0.135463|0.145065|0.300217|0.500000| |1.492243|2.916140|1.826580|1.842250|2.073672|2.381024|2.347427|2.030182|2.689194|4.270666|2.806495|3.006537|3.841720|4.817486|3.941536|7.353361|7.110971|12.556877|0.222596|0.181894|17.595371|8.810826|5.482316|4.838590|4.485599|5.835034|7.081577|7.084525|8.800640|5.483474|8.555774|0.038970|0.041486|0.040649|0.047025|0.056646|0.074081|0.054507|0.068893|0.078883|0.068129|0.075332|0.081091|0.074435|0.107569|0.104199|0.165259|0.226625|0.500000| |1.392983|2.684145|1.661617|1.688090|1.874548|2.084258|2.035091|1.805113|2.233729|3.560945|2.492990|2.836631|3.556876|3.955414|3.114712|5.493894|4.696875|9.660684|0.223204|0.175772|8.820127|17.508224|8.768130|5.491994|4.841309|5.505880|8.814503|4.854309|5.497914|4.844240|7.808716|0.036510|0.039255|0.037719|0.043718|0.051774|0.063505|0.048429|0.057678|0.063081|0.061782|0.066319|0.078553|0.072724|0.110200|0.093493|0.112121|0.126285|0.212537|0.500000| |1.250897|2.399086|1.456376|1.457243|1.577230|1.728850|1.727845|1.575385|1.891270|2.973642|2.173930|2.468228|3.018557|3.027303|2.459832|4.208157|3.472258|6.455935|0.129688|0.142775|5.494905|8.855826|17.562545|8.784966|6.934465|5.745963|6.965342|4.459616|4.840429|5.507379|5.531908|0.033177|0.035211|0.033692|0.038012|0.043185|0.051226|0.043014|0.050231|0.052602|0.054386|0.059635|0.066609|0.066284|0.094701|0.083782|0.091613|0.089179|0.123420|0.213077|0.500000| |1.393932|2.702628|1.649984|1.638226|1.777507|1.976173|1.997782|1.808292|2.221517|3.610600|2.679771|3.145024|4.093572|3.947244|3.013857|4.982159|4.560806|9.327503|0.179910|0.242201|6.707591|8.691498|17.473843|8.765840|5.500491|4.820079|5.478854|4.414078|5.641763|6.850786|7.007722|0.036880|0.039236|0.037298|0.042334|0.048157|0.058511|0.049486|0.058894|0.061072|0.065533|0.073599|0.083105|0.084156|0.134426|0.114478|0.119753|0.109144|0.138188|0.210309|0.305775|0.500000| |1.236640|2.389188|1.437075|1.411167|1.507561|1.663777|1.707530|1.573032|1.907493|2.984742|2.214913|2.450073|3.003063|2.896596|2.405145|4.044292|3.408162|5.837837|0.105851|0.137732|4.821761|5.506893|8.833813|17.562172|8.815513|5.509579|4.848763|4.850249|5.504656|8.833158|4.885584|0.033052|0.034506|0.033190|0.036650|0.040686|0.048644|0.043708|0.051861|0.052898|0.054957|0.062989|0.063615|0.066963|0.090612|0.089349|0.098044|0.085348|0.106539|0.123135|0.211977|0.213920|0.500000| |1.125167|2.152959|1.297115|1.290691|1.387174|1.517192|1.528003|1.403405|1.682368|2.567177|1.850666|2.006028|2.382248|2.434215|2.092664|3.657416|2.868281|4.812861|0.091435|0.101700|4.450556|5.709537|6.921545|8.804699|17.540202|8.794871|6.907437|5.508438|4.832344|5.509640|4.277671|0.030012|0.031399|0.030484|0.033756|0.037923|0.044770|0.038627|0.045303|0.047467|0.046674|0.051730|0.053548|0.053947|0.070585|0.068245|0.079547|0.076647|0.106722|0.127562|0.207906|0.141680|0.212921|0.500000| |1.142246|2.198037|1.322126|1.304027|1.397288|1.539685|1.570212|1.442990|1.754724|2.663541|1.911671|2.030207|2.417903|2.473154|2.158282|3.768566|2.990257|4.804580|0.087347|0.101716|4.453013|4.836173|5.510785|8.801719|17.539218|8.796336|5.506096|6.915568|5.710868|6.917730|4.188725|0.030539|0.031672|0.030949|0.033958|0.037914|0.045302|0.040020|0.047732|0.049764|0.047935|0.054287|0.053323|0.054522|0.069796|0.071172|0.086486|0.079898|0.106756|0.106534|0.141523|0.123008|0.212785|0.303471|0.500000| |1.140309|2.184997|1.325961|1.326626|1.440296|1.585680|1.584645|1.438711|1.756074|2.637031|1.837328|1.937821|2.288907|2.469167|2.187960|3.961198|3.015545|4.833345|0.091004|0.094362|4.902274|5.510785|4.854413|5.509498|8.817332|17.565288|8.841299|8.842991|5.505381|4.851124|4.334140|0.030293|0.031649|0.031145|0.034610|0.039533|0.047384|0.039383|0.046958|0.050669|0.046342|0.051076|0.052017|0.050990|0.065587|0.065074|0.083120|0.085472|0.130666|0.123480|0.128452|0.106428|0.123363|0.212562|0.212611|0.500000| |1.261622|2.420269|1.490074|1.512561|1.673668|1.853691|1.812554|1.615047|1.997187|3.047018|2.080919|2.233659|2.679178|3.038051|2.625294|4.852174|3.747112|6.360256|0.127124|0.114437|7.015278|8.777246|5.501592|4.832469|5.501077|8.775655|17.529543|6.906648|5.691257|4.436634|5.633660|0.033194|0.035216|0.034511|0.039338|0.046382|0.056533|0.043526|0.052112|0.057907|0.052241|0.056342|0.061228|0.057485|0.077646|0.073173|0.095570|0.110241|0.213888|0.213204|0.142145|0.122410|0.106587|0.141206|0.123003|0.213124|0.500000| |1.189774|2.271577|1.385533|1.401002|1.531240|1.676412|1.650108|1.492143|1.800422|2.756897|1.939826|2.119481|2.526457|2.717653|2.316487|4.153259|3.211525|5.598422|0.113265|0.109064|5.560274|8.843756|6.949428|5.726281|6.913096|8.780502|17.559075|5.509969|4.836448|4.450854|5.043159|0.031458|0.033347|0.032394|0.036642|0.042373|0.050361|0.040439|0.047449|0.051288|0.048975|0.052839|0.058009|0.055695|0.075285|0.069416|0.083607|0.089264|0.143792|0.213858|0.210236|0.141753|0.128063|0.206886|0.141215|0.212180|0.303597|0.500000| |1.297706|2.517048|1.547355|1.544536|1.699961|1.915491|1.920935|1.707489|2.188675|3.299474|2.214339|2.283667|2.755520|3.152898|2.828407|5.263260|4.190695|6.332242|0.112691|0.114492|7.027684|5.702433|4.439296|4.834028|5.503229|8.775947|6.907077|17.528964|8.776936|5.500622|5.347970|0.034264|0.035788|0.035521|0.039810|0.046353|0.058137|0.046602|0.058009|0.064631|0.054936|0.061499|0.060739|0.058525|0.076131|0.078744|0.116503|0.126625|0.214081|0.127804|0.106083|0.105047|0.106611|0.123013|0.141312|0.213100|0.206278|0.141052|0.500000| |1.241373|2.409226|1.464497|1.443897|1.564978|1.754085|1.791821|1.618780|2.048470|3.085057|2.128817|2.191525|2.634907|2.856950|2.558319|4.597286|3.698710|5.563122|0.096978|0.109076|5.567130|4.844069|4.452901|5.727727|6.920391|8.784818|5.510443|17.558243|8.845351|6.941582|4.706295|0.033018|0.034164|0.033820|0.037280|0.042327|0.052277|0.044778|0.055452|0.059580|0.052824|0.060466|0.057295|0.057285|0.072974|0.077861|0.109683|0.104144|0.143828|0.106792|0.106190|0.105469|0.128082|0.141327|0.207266|0.212350|0.141076|0.123021|0.303662|0.500000| |1.476201|2.916134|1.800658|1.762380|1.934698|2.235583|2.316272|2.040419|2.764014|4.357169|2.930948|3.009566|3.868078|4.408985|3.779439|6.647999|6.773041|9.429071|0.143213|0.175014|8.797398|5.492319|4.835344|5.491428|4.847373|5.510491|4.848870|8.842010|17.549139|8.770384|6.689194|0.038973|0.040564|0.039980|0.044761|0.051624|0.067356|0.056369|0.074014|0.080666|0.069963|0.083481|0.076651|0.076221|0.103044|0.117551|0.223305|0.183116|0.211675|0.123179|0.106572|0.126127|0.123142|0.106605|0.127885|0.123638|0.127645|0.106708|0.213750|0.214870|0.500000| |1.311857|2.564227|1.549662|1.506323|1.614797|1.815182|1.893610|1.727602|2.186623|3.400805|2.452850|2.586676|3.212509|3.226142|2.757252|4.673899|4.116900|6.406093|0.106754|0.142974|5.499632|4.843730|5.507490|8.783132|6.924269|5.733258|4.453181|6.948408|8.855463|17.560964|5.098968|0.035038|0.036194|0.035318|0.038741|0.043151|0.053266|0.048379|0.060081|0.061696|0.059859|0.071401|0.065588|0.069087|0.090323|0.100200|0.130081|0.104038|0.123377|0.106674|0.123022|0.140376|0.212115|0.141429|0.207538|0.128206|0.105947|0.106070|0.141925|0.209478|0.213590|0.500000| |1.444301|2.842667|1.730731|1.680305|1.810251|2.053654|2.149338|1.944082|2.501088|4.064478|2.992081|3.294074|4.391716|4.217722|3.341414|5.441496|5.463572|9.248818|0.144410|0.243127|6.722276|5.653838|6.857640|8.767392|5.498878|4.818291|4.414463|5.475814|8.692151|17.462459|6.476315|0.038400|0.040056|0.038615|0.042947|0.048140|0.060350|0.054263|0.068054|0.069309|0.071242|0.086700|0.081922|0.087636|0.126994|0.140997|0.173359|0.125371|0.138297|0.126565|0.140429|0.203071|0.213913|0.123020|0.141570|0.106388|0.105049|0.105505|0.122391|0.141548|0.209771|0.305646|0.500000| 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