Version2.2 2021-02-10T06:21:34Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 07-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc(c(c1)CC(=O)N)NC(=O)C(=O)NCc2ccccc2C[NH+]3CCCC3 C49392638 RHF 6-31G(d) (6D,7F) c1ccc(c(c1)CC(=O)N)NC(=O)C(=O)NCc2ccccc2C[NH+]3CCCC3 C01[X(C22H27N4O3)] 162 C1 489 NC(=O)Cc1ccccc1NC(=O)C(=O)NCc1ccccc1C[NH+]1CCCC1 NC(=O)Cc1ccccc1NC(=O)C(=O)NCc1ccccc1C[NH+]1CCCC1 NC(=O)Cc1ccccc1NC(=O)C(=O)NCc2ccccc2C[NH+]3CCCC3 InChIKey=WCWVTIFRRVLOLF-UHFFFAOYSA-O InChI=1S/C22H26N4O3/c23-20(27)13-16-7-3-4-10-19(16)25-22(29)21(28)24-14-17-8-1-2-9-18(17)15-26-11-5-6-12-26/h1-4,7-10H,5-6,11-15H2,(H2,23,27)(H,24,28)(H,25,29)/p+1 InChI=1/C22H26N4O3/c23-20(27)13-16-7-3-4-10-19(16)25-22(29)21(28)24-14-17-8-1-2-9-18(17)15-26-11-5-6-12-26/h1-4,7-10H,5-6,11-15H2,(H2,23,27)(H,24,28)(H,25,29)/p+1/fC22H27N4O3/h24-26H,23H2/q+1 c1ccc(c(c1)CC(=O)N)NC(=O)C(=O)NCc2ccccc2C[NH+]3CCCC3 C01[X(C22H27N4O3)] 162 C01 489 NC(=O)Cc1ccccc1NC(=O)C(=O)NCc1ccccc1C[NH+]1CCCC1 O=[C]([NH2])C[C]1[CH][CH][CH][CH][C]1[NH][C](=O)C(=O)NC[C]1[CH][CH][CH][CH][C]1C[NH]1CCCC1 NC(=O)C[C]1[CH][CH][CH][CH][C]1NC(=O)C(=O)NC[C]2[CH][CH][CH][CH][C]2C[NH]3CCCC3 InChIKey=WEESOTSWQNBZGL-UHFFFAOYSA-N InChI=1S/C22H27N4O3/c23-20(27)13-16-7-3-4-10-19(16)25-22(29)21(28)24-14-17-8-1-2-9-18(17)15-26-11-5-6-12-26/h1-4,7-10,26H,5-6,11-15H2,(H2,23,27)(H,24,28)(H,25,29) InChI=1/C22H27N4O3/c23-20(27)13-16-7-3-4-10-19(16)25-22(29)21(28)24-14-17-8-1-2-9-18(17)15-26-11-5-6-12-26/h1-4,7-10,26H,5-6,11-15H2,(H2,23,27)(H,24,28)(H,25,29)/f/h24-25H,23H2 2783.6417049368 -1291.098305 1-A 14268.5431 105 384 489 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.65745 -20.65711 -20.61221 -15.81044 -15.70960 -15.69985 -15.67070 -11.47396 -11.47121 -11.44161 -11.42231 -11.41291 -11.41213 -11.38408 -11.36908 -11.36814 -11.36351 -11.35622 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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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.00742 0.01193 0.02864 0.05542 0.06577 0.07587 0.09858 0.11735 0.12243 0.12885 0.13166 0.13526 0.14539 0.15465 0.15571 0.16703 0.17083 0.17454 0.17946 0.18381 0.19479 0.19747 0.20558 0.20977 0.21705 0.22268 0.22511 0.22808 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2.37509 2.37671 2.38476 2.40902 2.42236 2.43242 2.43749 2.44798 2.47050 2.47851 2.48759 2.48907 2.50871 2.51948 2.52462 2.53172 2.53830 2.54598 2.56475 2.56736 2.56807 2.57375 2.58543 2.59918 2.61381 2.64162 2.64613 2.67313 2.67792 2.69254 2.70917 2.73137 2.74316 2.74955 2.75055 2.78959 2.81826 2.82530 2.83045 2.84026 2.84686 2.87133 2.87958 2.88356 2.89230 2.90876 2.91535 2.91833 2.94295 2.95200 2.96260 2.97612 2.99477 3.01107 3.02161 3.03695 3.04356 3.05327 3.06417 3.06486 3.07501 3.08808 3.11197 3.14530 3.19073 3.21830 3.24556 3.28846 3.31683 3.33718 3.36597 3.39905 3.41145 3.47294 3.60944 3.70918 3.75897 4.15380 4.32296 4.34293 4.38755 4.42191 4.43257 4.44626 4.45688 4.48302 4.49263 4.49492 4.50061 4.53733 4.55924 4.62033 4.63835 4.65320 4.68393 4.70733 4.71777 4.74809 4.76126 4.78878 4.83896 4.89985 4.90730 4.97241 5.06752 5.14112 11.30787 5.4213 3.0578 -2.6596 6.7687 |XX|YY|ZZ|XY|XZ|YZ| -56.7502 -128.8853 -166.5350 20.6352 10.8263 16.6346 |XX|YY|ZZ|XY|XZ|YZ| 60.6400 -11.4951 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3.0354 2.1963 2.3260 2.0225 1.9038 1.8062 1.2758 1.4679 2.3028 1.7905 1.3387 1.5320 1.4915 1.3633 1.5238 1.6415 1.1946 1.4579 1.4283 1.7545 1.3270 1.2765 1.6872 1.2850 1.3220 1.3403 1.4280 2.2056 1.4157 1.2571 2.1241 2.2781 1.1180 1.1089 1.1469 1.1256 1.0999 1.0915 2.2908 1.4249 1.5928 1.1146 1.8835 3.2090 5.5193 3.8071 1.3789 5.3785 4.0891 9.1908 7.3758 11.0546 1.0645 1.0637 1.0617 1.0661 1.0668 1.0624 1.0655 1.1002 1.1044 1.1052 1.1067 1.1089 1.1087 1.1044 1.0926 1.0893 1.0905 1.0914 1.0936 1.0970 1.0988 1.0948 1.0792 1.0819 1.0482 1.0785 1.1055 0.0005 0.0015 0.0031 0.0051 0.0070 0.0090 0.0062 0.0155 0.0112 0.0175 0.0234 0.0241 0.0395 0.0506 0.0733 0.0930 0.0653 0.1089 0.1846 0.2772 0.1888 0.3181 0.1521 0.2139 0.0802 0.3565 0.3111 0.2713 0.2877 0.3767 0.4970 0.8669 0.4914 0.5348 0.5994 0.4166 0.7737 0.7603 0.8299 0.2878 1.1006 0.8606 1.1358 0.4480 0.8572 2.5335 1.4059 1.3737 1.5827 1.3591 0.7334 0.6085 0.7525 0.6868 0.8802 0.6827 1.5769 3.5779 1.6493 1.3148 1.1966 1.8685 1.3725 1.0438 0.8748 1.0718 1.5715 1.7112 1.3355 1.2599 0.9881 1.0880 2.1372 1.6435 0.9987 1.0562 1.8112 1.8209 1.8013 3.3967 2.8576 1.6543 1.2056 2.6178 1.9393 2.0701 1.8035 1.8800 1.7964 1.2731 1.4879 2.3697 1.8811 1.4242 1.6383 1.6018 1.5034 1.6989 1.8515 1.3729 1.7497 1.7434 2.1776 1.6741 1.6244 2.1607 1.6614 1.7590 1.8281 1.9917 3.1649 2.0324 1.8566 3.2919 3.5416 1.7462 1.7357 1.8108 1.7961 1.7681 1.7564 3.7286 2.3307 2.6217 1.8408 3.2012 5.8695 10.2840 7.2306 2.6392 10.3702 7.9291 19.1960 16.2841 25.9865 6.5601 6.6301 6.6646 6.7143 6.7282 6.7195 6.7773 6.9984 7.0909 7.1351 7.2105 7.2626 7.3279 7.3330 7.2699 7.2709 7.3141 7.3399 7.3988 7.4544 7.4981 7.5321 8.3631 8.5964 9.0838 9.4031 10.2627 1.7896 0.6461 2.0584 4.5471 5.9550 2.0499 3.2339 5.8283 2.5735 1.1088 2.9165 0.6984 10.0697 7.6773 1.2823 3.6566 3.9449 4.6253 2.2097 19.8318 9.3245 18.9096 7.4238 34.1504 207.6123 13.4300 14.7254 1.8922 7.2491 9.5510 7.8996 18.8092 7.3056 5.9509 26.2430 2.6375 23.8151 38.1706 15.1890 109.6913 8.8352 28.5163 1.8995 33.2564 7.7189 19.0547 27.9741 3.0614 15.1010 0.7398 34.3937 18.5434 39.5423 27.4190 10.0189 67.9161 30.0727 3.6341 4.7776 18.2634 7.1352 21.1310 5.4391 3.4615 2.6553 6.4682 33.1526 21.1197 3.2789 9.2955 3.0669 7.0745 18.4136 3.0712 0.0371 0.1277 1.9503 1.7861 4.1597 6.8310 21.1797 0.7612 8.7965 2.6245 3.9362 6.3489 0.3881 5.2211 1.8995 19.2868 4.7605 86.2895 1.1191 1.0185 35.0166 12.0922 3.7919 71.0767 98.2180 13.1720 47.6415 14.4065 57.2146 6.6985 0.1938 32.1430 1.9513 6.8426 1.1789 2.2869 152.1479 48.7774 103.3936 7.2908 84.1035 8.0989 18.3749 27.7853 8.2510 10.0104 15.3837 37.8861 21.9708 13.2202 11.9970 837.1602 131.9938 3.7888 254.2769 94.2187 3.8992 35.7883 688.6779 355.0532 255.3138 12.9092 19.0772 8.5041 14.8530 11.7791 3.2696 23.5387 12.8873 8.5735 3.6167 10.0654 2.2095 15.8085 3.1676 17.8323 6.9166 2.0636 8.8590 10.7730 21.7408 10.6852 11.3308 381.5780 357.2912 102.9066 42.3425 70.3363 1.1093 2.7392 1.2191 0.7428 1.7291 3.5189 0.5624 0.7726 1.3598 2.6434 2.9253 2.3792 1.9399 3.5081 5.0963 1.0563 0.8338 0.7879 0.9813 0.6674 3.5247 1.3635 0.8692 2.2649 0.4638 3.7257 1.0794 2.0588 0.2117 1.6252 0.7846 0.6853 2.3531 0.8170 2.0182 1.5438 1.1785 1.7918 2.8321 2.8428 3.0820 1.1443 1.9064 2.9775 2.6842 1.4852 6.0227 2.9752 10.9600 0.2174 1.0122 3.3120 4.4119 1.5650 3.5005 9.4924 8.2204 3.4577 8.9176 8.0421 6.0659 3.2861 6.1749 1.1917 1.5001 1.2661 4.1977 12.7423 3.6797 1.1343 0.6522 3.1404 3.8284 6.8821 0.5256 0.2417 22.2458 12.7940 9.3212 11.6033 8.5313 1.0777 0.9036 8.9895 0.7083 12.0968 11.1007 0.7076 0.2610 5.2907 4.9861 4.0830 14.3146 2.9343 3.0589 8.0800 6.3779 14.6275 15.4842 11.0468 3.5141 3.0194 8.6708 2.4768 2.5403 33.3304 3.1138 3.7855 1.4514 8.3918 1.4144 1.8556 16.8552 0.4445 1.3762 9.9228 18.4111 1.9802 4.8224 7.2269 7.9697 3.0498 5.2659 3.3640 9.4161 2.6259 7.5075 14.5155 51.8391 5.1643 34.8561 21.8198 31.4657 9.1532 25.3181 73.5452 72.2135 34.2052 107.7954 19.0678 3.4089 187.5432 77.5968 35.8125 61.6232 88.8883 25.4102 54.0541 37.3484 44.1765 57.0662 73.7287 88.1540 78.1200 173.6953 252.7422 121.2367 109.4405 74.6256 116.0069 22.4449 49.9381 0.7387 0.7390 0.7483 0.6507 0.7194 0.7233 0.6632 0.6291 0.6996 0.7434 0.6241 0.7428 0.6105 0.7363 0.7281 0.5349 0.3349 0.7474 0.1039 0.6465 0.4884 0.7056 0.7496 0.1059 0.5524 0.5021 0.6761 0.1156 0.6361 0.0770 0.2522 0.4415 0.6605 0.0685 0.4135 0.5118 0.5156 0.6071 0.7492 0.7496 0.7368 0.5358 0.7491 0.7470 0.7497 0.7251 0.1539 0.2350 0.1217 0.1500 0.5829 0.0442 0.1816 0.5194 0.2367 0.4049 0.1378 0.3665 0.1171 0.1166 0.0983 0.6869 0.0824 0.6745 0.7369 0.5055 0.3037 0.1459 0.1872 0.7342 0.4257 0.1683 0.4998 0.2186 0.3837 0.7113 0.1126 0.2632 0.2925 0.1491 0.5777 0.2608 0.7309 0.6782 0.5597 0.5377 0.4367 0.7268 0.7025 0.5759 0.5467 0.1263 0.1902 0.3340 0.3181 0.2827 0.6961 0.4942 0.2842 0.7393 0.6948 0.5516 0.2788 0.5388 0.6659 0.1813 0.5026 0.5212 0.3476 0.3758 0.3003 0.6512 0.7348 0.7192 0.2808 0.7448 0.6924 0.5710 0.7318 0.7270 0.6600 0.4940 0.7238 0.7409 0.7171 0.5890 0.5397 0.4606 0.4779 0.3814 0.7486 0.7483 0.2935 0.4727 0.2046 0.0991 0.0710 0.6129 0.1064 0.3541 0.6924 0.0546 0.4290 0.5914 0.3067 0.7261 0.7348 0.7117 0.3754 0.5688 0.4983 0.5313 0.7252 0.7394 0.2017 0.1399 0.1690 0.2499 0.1633 0.1657 0.1812 0.7500 0.8497 0.8499 0.8561 0.7884 0.8368 0.8395 0.7975 0.7723 0.8232 0.8528 0.7685 0.8524 0.7581 0.8481 0.8427 0.6970 0.5017 0.8555 0.1883 0.7853 0.6563 0.8274 0.8569 0.1915 0.7117 0.6685 0.8067 0.2073 0.7776 0.1429 0.4029 0.6125 0.7955 0.1283 0.5851 0.6771 0.6804 0.7555 0.8566 0.8569 0.8484 0.6978 0.8566 0.8552 0.8569 0.8406 0.2668 0.3806 0.2169 0.2609 0.7365 0.0847 0.3074 0.6837 0.3828 0.5764 0.2422 0.5365 0.2096 0.2088 0.1790 0.8144 0.1522 0.8056 0.8485 0.6716 0.4659 0.2546 0.3154 0.8467 0.5972 0.2881 0.6665 0.3587 0.5546 0.8313 0.2024 0.4168 0.4526 0.2595 0.7324 0.4137 0.8445 0.8083 0.7177 0.6994 0.6079 0.8418 0.8252 0.7309 0.7069 0.2243 0.3196 0.5008 0.4827 0.4407 0.8208 0.6615 0.4427 0.8501 0.8199 0.7110 0.4360 0.7003 0.7994 0.3070 0.6690 0.6852 0.5158 0.5463 0.4619 0.7887 0.8471 0.8367 0.4385 0.8537 0.8183 0.7270 0.8451 0.8419 0.7952 0.6613 0.8398 0.8511 0.8353 0.7414 0.7011 0.6307 0.6468 0.5522 0.8562 0.8561 0.4539 0.6420 0.3397 0.1804 0.1326 0.7600 0.1923 0.5230 0.8182 0.1035 0.6005 0.7432 0.4694 0.8413 0.8471 0.8315 0.5459 0.7251 0.6652 0.6939 0.8407 0.8502 0.3356 0.2455 0.2891 0.3999 0.2808 0.2843 0.3068 0.8571 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 6 6 6 6 6 6 6 6 8 7 7 6 8 6 8 7 6 6 6 6 6 6 6 6 7 1 6 6 6 6 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 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 14.00307 12.00000 15.99491 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 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 6364.0020 20295.7517 24606.6280 0.99997 0.00670 0.00275 -0.00673 0.99990 0.01248 -0.00266 -0.01250 0.99992 1 0.01361 0.00427 0.00352 0.28359 0.08892 0.07334 19.10 30.64 45.60 56.86 63.46 82.71 90.43 104.99 110.53 117.33 138.93 151.69 176.57 204.87 239.19 261.21 280.18 294.30 342.73 374.80 390.92 427.20 438.75 457.68 465.76 502.70 581.83 620.36 656.68 660.39 670.90 692.03 727.70 751.13 796.19 803.47 845.53 876.94 892.46 915.51 930.22 939.23 973.91 980.27 1002.54 1050.09 1117.50 1147.93 1158.82 1184.08 1213.13 1222.45 1233.94 1255.69 1277.26 1301.60 1313.55 1326.82 1358.74 1363.46 1379.69 1389.16 1399.66 1426.22 1445.22 1454.14 1485.15 1496.07 1514.43 1545.72 1554.12 1566.69 1588.52 1593.50 1618.83 1643.79 1658.01 1661.20 1667.74 1686.96 1689.61 1710.01 1717.34 1740.72 1761.35 1768.30 1770.01 1862.65 1869.38 1872.44 1887.15 1901.45 1921.28 1933.33 1938.37 1942.53 1968.33 1979.17 1990.69 2009.49 2053.52 2070.86 2088.27 2105.36 2114.44 2121.23 2131.41 2162.17 2189.05 2213.69 2245.39 2245.90 2277.99 2333.49 2337.11 2342.58 2345.11 2355.25 2367.81 2376.52 2377.77 2391.40 2397.26 2404.84 2408.88 2443.64 2535.02 2558.64 2583.19 2593.23 2602.74 2610.16 2708.93 2785.13 2873.89 4653.30 4679.68 4696.35 4704.11 4707.37 4713.96 4727.26 4727.43 4749.69 4762.66 4784.61 4796.97 4818.89 4829.95 4834.99 4842.62 4854.37 4860.89 4875.48 4886.12 4896.39 4916.59 5217.87 5283.74 5517.98 5534.72 5711.15 0.511530 0.536810 0.537754 0.452286 -1290.586775 -1290.561495 -1290.560551 -1290.646019 2.866611D-04 MUNgauss RevisionA2.1 retrievium 10-Feb-2021 DUDE c1ccc(c(c1)CC(=O)N)NC(=O)C(=O)NCc2ccccc2C[NH+]3CCCC3 C49392638 RHF 6-31G(d) (6D,10F) C1 395.208316 |X|Y|Z| 55.535599 102.307433 26.786116 53.390354 23 6 7 20 3 |36.858105| |13.778674|36.858105| |7.959420|13.771619|36.858105| |6.873747|7.931256|13.752813|36.858105| |7.873363|6.820348|7.889649|13.649332|36.858105| |13.764372|7.967737|6.916703|7.976395|13.719941|36.858105| |5.015828|4.418974|4.982470|7.453437|12.545699|7.590329|36.858105| |4.056129|3.723770|4.216291|5.847077|7.519684|5.454958|12.505767|36.858105| |3.709431|3.625083|4.307964|5.929437|6.345036|4.612288|8.000834|15.784886|73.516695| |3.518999|3.144445|3.366688|4.256150|5.384481|4.585249|7.810760|14.222377|15.177893|53.358707| |4.539564|5.139113|7.810983|13.364698|7.834600|5.161067|6.557017|5.854448|12.056220|5.648890|53.358707| |3.736449|4.346493|6.274110|7.785251|5.325684|3.998998|4.738423|4.284878|8.636730|4.483694|19.642515|36.858105| |3.681099|4.438387|6.245883|6.537532|4.633005|3.742508|3.979601|3.494792|6.711891|3.822545|11.370507|15.659441|73.516695| |2.918667|3.255565|4.248194|5.036575|4.002149|3.143946|3.942779|3.876163|8.143239|4.194055|10.788457|12.418841|14.370684|36.858105| |2.739780|3.013853|3.837888|4.526605|3.729935|2.963701|3.764815|3.990199|8.900483|4.357238|9.231173|7.957491|10.037052|15.974657|73.516695| |2.559955|2.827316|3.525352|3.979984|3.322848|2.721086|3.312847|3.174245|6.326919|3.578941|7.385636|7.956666|12.642595|14.079376|14.958910|53.358707| |2.151596|2.335886|2.799781|3.095208|2.701816|2.278694|2.757806|2.728949|5.423463|3.186252|5.388181|5.031694|8.268898|7.735457|11.916829|17.856060|36.858105| |1.953195|2.126511|2.491022|2.655436|2.339362|2.030408|2.346465|2.282115|4.419244|2.718863|4.369400|4.012447|7.214732|5.178773|8.026355|10.636140|12.563286|36.858105| |1.773626|1.898710|2.175905|2.324180|2.106149|1.851798|2.146839|2.082128|3.959523|2.524395|3.716249|3.262569|5.862468|3.975325|6.350344|7.407048|7.630394|13.736910|36.858105| |1.623975|1.737434|1.958268|2.051328|1.871857|1.676274|1.888621|1.823303|3.429856|2.237059|3.187045|2.748085|5.063396|3.171883|5.130389|5.533994|5.025943|7.871094|13.736770|36.858105| |1.611049|1.742657|1.958937|2.010727|1.815639|1.639906|1.798204|1.732335|3.263288|2.123820|3.090578|2.679304|5.059731|3.018513|4.879210|5.146171|4.417822|6.810809|7.958725|13.797961|36.858105| |1.741779|1.913743|2.179530|2.213592|1.958199|1.759630|1.909919|1.841602|3.504990|2.234574|3.436504|3.051410|5.859265|3.456758|5.528140|5.944778|4.985524|7.910404|6.934046|7.979695|13.750646|36.858105| |1.933055|2.139433|2.496564|2.571897|2.233786|1.968311|2.179684|2.110223|4.077167|2.521441|4.133676|3.813133|7.227529|4.582858|7.148985|8.474181|7.432711|13.569267|7.932398|6.833329|7.868575|13.711378|36.858105| |2.088361|2.365480|2.805948|2.821672|2.380944|2.096114|2.264197|2.205039|4.319443|2.610920|4.558026|4.282458|8.250434|5.036398|7.939850|8.358173|6.255986|7.429947|4.992841|4.429990|5.035679|7.654524|12.577492|36.858105| |2.397167|2.790996|3.373298|3.283333|2.685009|2.365815|2.470240|2.343002|4.543784|2.740356|5.221943|5.123550|11.108605|5.294147|7.810572|8.307257|5.151715|5.545896|4.091939|3.699004|4.120171|5.648879|7.478109|12.659696|53.358707| |2.644550|3.086148|3.850157|3.843974|3.073128|2.644492|2.820494|2.636809|5.124772|3.030352|6.352863|6.815763|15.889498|6.847152|9.192812|11.062569|5.884560|5.825215|4.247038|3.678291|3.885547|5.001367|6.835246|9.215493|25.587153|0.500000| |2.528460|3.030482|3.669361|3.390359|2.721975|2.433512|2.434396|2.335289|4.559383|2.735934|5.218003|4.832924|10.183926|4.662517|7.350901|6.358999|3.986917|3.995244|3.142570|2.891223|3.177920|4.080799|4.909898|7.600403|17.259134|0.260561|36.858105| |2.734169|3.363427|3.958783|3.442576|2.770445|2.547384|2.408983|2.250713|4.283493|2.651278|4.941187|4.389045|9.897552|3.851427|6.007157|5.220071|3.231881|3.271473|2.716183|2.560622|2.806472|3.440812|3.860222|5.050218|10.727366|0.194018|12.388158|36.858105| |2.576383|3.068706|3.534725|3.193995|2.644818|2.436330|2.343804|2.146783|4.015441|2.541915|4.583471|4.141308|9.737119|3.674664|5.553675|5.339854|3.312878|3.521314|2.976522|2.861568|3.182811|3.890658|4.209628|5.046786|10.961255|0.203480|7.764850|12.335627|36.858105| |2.271349|2.625310|3.050144|2.907872|2.444262|2.211757|2.242282|2.088691|3.949299|2.479618|4.377964|4.066614|9.075426|3.958299|5.946886|6.219461|4.016516|4.610603|3.751366|3.634769|4.231831|5.645411|6.136916|7.455880|17.333943|0.259441|8.034413|7.836141|12.492866|36.858105| |17.731317|8.909966|5.651996|4.953517|5.623336|8.925678|4.102175|3.445507|5.591424|4.265438|4.919465|3.094576|5.491447|2.507625|4.221497|3.053481|1.921976|1.767119|1.620513|1.498181|1.490187|1.601542|1.756011|1.886209|2.921131|0.064806|2.264783|2.465072|2.339582|2.063912|0.500000| |8.912500|17.728435|8.936168|5.647866|4.925493|5.655144|3.537281|3.093950|5.430545|3.661191|5.675621|3.751527|7.043676|2.912400|4.820248|3.518610|2.170414|2.011683|1.800232|1.666448|1.689284|1.860444|2.055875|2.289536|3.696004|0.081592|3.014247|3.459727|3.110744|2.601463|0.214201|0.500000| |5.659002|8.927101|17.773141|8.953272|5.634780|4.979122|4.069180|3.624164|6.838551|4.012457|9.785162|6.714744|12.852258|4.529245|7.194581|5.129528|2.969514|2.666181|2.287266|2.062677|2.091429|2.369882|2.735105|3.176757|5.386430|0.125024|4.529574|4.996667|4.185246|3.509711|0.124232|0.215455|0.500000| |8.952560|5.666463|4.974461|5.662760|8.940865|17.714708|7.097411|5.251601|7.523252|6.548609|5.688873|3.361994|5.603135|2.767766|4.695745|3.321966|2.087279|1.870232|1.728835|1.572173|1.530689|1.625706|1.802588|1.895404|2.866071|0.064773|2.145730|2.232195|2.160043|1.985576|0.216280|0.124409|0.107964|0.500000| |4.814006|4.005298|4.199997|5.591693|8.924140|7.376606|17.601240|8.808673|10.403192|10.284097|6.584213|3.806371|5.973809|3.259399|5.542797|3.882159|2.434765|2.117228|1.970476|1.754699|1.670028|1.755820|1.973334|2.028695|2.998377|0.068934|2.167244|2.171234|2.137117|2.039692|0.114666|0.091094|0.096524|0.227939|0.500000| |4.252206|3.965398|4.634220|6.855625|8.855340|5.780843|17.553501|9.052309|12.674771|8.384516|9.533973|5.336144|7.819560|4.498965|7.371347|5.203325|3.124427|2.619743|2.400412|2.083494|1.960645|2.073997|2.387207|2.440334|3.612233|0.085529|2.544441|2.491593|2.470602|2.401099|0.098367|0.090315|0.109591|0.148717|0.303770|0.500000| |3.518235|3.046923|3.160076|3.895009|5.088402|4.640426|7.272989|9.263809|10.813515|26.119623|4.992328|2.982743|4.640285|2.760171|4.993796|3.282820|2.155399|1.868944|1.752298|1.565906|1.487680|1.556265|1.739376|1.789702|2.567073|0.057725|1.877850|1.842646|1.783333|1.730859|0.088873|0.072754|0.076428|0.144474|0.233153|0.159152|0.500000| |3.085690|2.822136|3.021349|3.692717|4.366759|3.817892|5.680255|9.455581|13.746416|26.023202|5.043437|3.018713|4.586762|2.911351|5.520188|3.389405|2.260193|1.927931|1.792268|1.590363|1.510353|1.588025|1.789113|1.855297|2.617764|0.058545|1.928861|1.851783|1.764383|1.733162|0.077500|0.068365|0.075206|0.109660|0.150461|0.134405|0.309605|0.500000| |4.044608|4.345540|5.947270|9.192527|7.077771|4.741905|6.930288|7.241430|17.507563|6.578531|25.721071|9.504390|10.769101|7.663067|13.629123|6.956688|3.934827|3.106576|2.666108|2.270454|2.178282|2.398899|2.882545|3.139695|4.666107|0.112555|3.420020|3.156835|2.924440|2.865656|0.091785|0.100116|0.152718|0.111308|0.138132|0.202135|0.113267|0.121211|0.500000| |2.633067|2.898874|3.583928|4.025642|3.392544|2.795803|3.361032|3.091686|5.954205|3.499017|7.144264|7.690326|13.863293|9.470786|10.920380|25.998153|9.034773|7.166250|5.432978|4.166957|3.862671|4.366113|5.894909|5.516702|8.129405|0.228634|4.447806|3.883119|4.211835|4.866377|0.064124|0.073547|0.105268|0.069670|0.081302|0.109544|0.066461|0.066763|0.131389|0.500000| |2.096293|2.283990|2.736618|3.000795|2.609800|2.209738|2.650810|2.699469|5.484545|3.166148|5.228733|4.723347|7.560596|7.407089|13.466954|12.627281|17.614855|8.807262|5.920616|4.301242|3.952970|4.554669|6.592643|6.318093|6.696678|0.148724|4.050451|3.176278|3.119256|3.722449|0.052109|0.059206|0.081258|0.056212|0.064815|0.081627|0.058973|0.063231|0.108892|0.179977|0.500000| |2.068785|2.202181|2.601563|2.929523|2.637905|2.223833|2.780752|2.772492|5.458959|3.270306|5.032775|4.436783|7.137115|6.433125|10.518778|12.356004|17.592307|8.902244|7.463606|4.836920|4.002885|4.189610|5.543365|4.639204|5.476197|0.126103|3.269384|2.765442|2.852149|3.342871|0.051544|0.056529|0.074865|0.057294|0.068731|0.088674|0.061537|0.064571|0.104790|0.205666|0.304698|0.500000| |1.752980|1.853330|2.115571|2.296506|2.114872|1.852377|2.200372|2.144490|4.061164|2.613467|3.676684|3.155876|5.521823|3.866156|6.279420|6.980903|7.144852|8.944961|17.721154|8.946247|5.664931|4.984000|5.642593|4.063340|4.742348|0.102753|2.784456|2.445409|2.645674|3.191909|0.044511|0.048478|0.060883|0.048386|0.056303|0.068936|0.050417|0.051593|0.074369|0.142137|0.154714|0.233883|0.500000| |1.519267|1.609773|1.794308|1.882873|1.742959|1.572182|1.772679|1.712282|3.193720|2.122176|2.888680|2.438778|4.462191|2.767769|4.535124|4.665648|4.112650|5.623994|8.920227|17.731889|8.919705|5.659380|4.932564|3.544533|4.184641|0.085512|2.490755|2.253579|2.508301|3.069443|0.039155|0.042918|0.052002|0.041279|0.046176|0.054218|0.041484|0.041967|0.057494|0.098237|0.099933|0.115467|0.216304|0.500000| |1.500290|1.617069|1.795092|1.827384|1.663534|1.519302|1.643961|1.582914|2.962290|1.956663|2.762711|2.353941|4.457133|2.590184|4.234040|4.261080|3.536926|4.921111|5.648901|8.910302|17.735030|8.917984|5.620257|4.119245|4.799722|0.091682|2.836651|2.571766|2.922113|3.762185|0.038821|0.043829|0.053079|0.039573|0.042740|0.049427|0.038258|0.038706|0.054122|0.089251|0.090129|0.091066|0.124348|0.214114|0.500000| |1.697497|1.876386|2.119107|2.113473|1.866155|1.695189|1.799070|1.734863|3.294756|2.113381|3.226989|2.831984|5.507520|3.109217|5.031085|5.093069|4.058353|5.629110|4.982951|5.675034|8.962308|17.703342|8.916467|7.161235|7.616139|0.129894|4.238077|3.616223|4.089381|6.011802|0.043572|0.051233|0.064537|0.043468|0.046097|0.053668|0.040977|0.041776|0.062305|0.103843|0.107119|0.096024|0.108041|0.124539|0.216585|0.500000| |2.145100|2.427316|2.917600|2.979871|2.496886|2.171097|2.388295|2.372422|4.744492|2.791252|4.955237|4.641765|8.374402|5.896713|9.798272|9.167524|7.011853|6.933853|4.650744|3.946476|4.207345|5.702004|8.795654|17.641195|12.473377|0.224901|7.136938|4.624565|4.302854|5.555837|0.053511|0.064676|0.091690|0.054412|0.058814|0.071299|0.052594|0.055437|0.096823|0.152884|0.224911|0.140201|0.110038|0.089958|0.097318|0.146195|0.500000| |1.931888|2.185611|2.539720|2.507700|2.142057|1.918790|2.029604|1.987262|3.870216|2.383559|3.930879|3.535691|6.799779|3.983393|6.558057|6.207119|4.735254|5.622158|4.233179|4.022756|4.817237|7.355316|8.911787|17.627961|12.485506|0.181504|7.142948|4.877737|4.758774|6.841454|0.048967|0.059609|0.079890|0.048458|0.051012|0.059978|0.045580|0.047298|0.075775|0.117040|0.136847|0.104546|0.097123|0.091453|0.114624|0.225047|0.303034|0.500000| |2.718791|3.286881|4.120855|3.839700|3.002336|2.635962|2.667754|2.598680|5.183953|3.005285|6.106513|5.665322|11.136756|5.473003|8.862069|6.827924|4.165577|3.890821|3.044634|2.730703|2.907677|3.623148|4.482058|6.651105|12.278547|0.235130|17.656034|8.602426|5.788523|5.799376|0.066778|0.089326|0.144387|0.063972|0.064957|0.076962|0.056654|0.058998|0.111532|0.126794|0.121459|0.094916|0.076486|0.065843|0.071815|0.101082|0.203025|0.165319|0.500000| |2.239831|2.635965|3.089848|2.877494|2.378990|2.156488|2.159743|2.102025|4.099485|2.501138|4.368670|3.866874|7.720504|3.903456|6.448942|5.394926|3.624339|3.741362|2.994455|2.817896|3.166214|4.108273|4.730726|7.401467|12.395372|0.183484|17.626346|8.709856|6.170681|6.823855|0.056530|0.073591|0.102754|0.053508|0.053965|0.062335|0.047784|0.049427|0.081944|0.103722|0.104899|0.083537|0.073324|0.067621|0.079583|0.123730|0.191430|0.231064|0.301200|0.500000| |3.212502|4.134941|4.984897|4.073687|3.175141|2.927377|2.669230|2.465367|4.677636|2.875394|5.640909|4.889714|11.221056|3.984121|6.203288|5.142179|3.096039|3.018714|2.532584|2.356713|2.517875|2.998206|3.397207|4.266328|8.436395|0.173082|8.767490|17.643420|8.753994|5.842253|0.079293|0.119398|0.187832|0.069912|0.066367|0.075777|0.055471|0.055403|0.097448|0.106620|0.084508|0.074736|0.064556|0.058243|0.064140|0.085362|0.114101|0.111289|0.222418|0.177507|0.500000| |2.506299|3.047493|3.438470|2.977551|2.461971|2.311562|2.154112|2.033689|3.853609|2.431113|4.184528|3.554166|7.559177|3.208562|5.178685|4.339753|2.796182|2.861788|2.430229|2.334628|2.583286|3.128350|3.379074|4.320267|8.038661|0.142369|8.822625|17.611000|8.697221|6.206083|0.063913|0.089248|0.117313|0.056878|0.054545|0.061223|0.047122|0.047470|0.076025|0.088882|0.077388|0.067512|0.061012|0.057676|0.067018|0.093698|0.110731|0.123276|0.185135|0.227296|0.302815|0.500000| |2.870257|3.433469|3.992614|3.606462|2.963898|2.717540|2.595719|2.320049|4.291268|2.723726|5.098208|4.651021|11.709541|3.897486|5.731902|5.637696|3.361140|3.482584|2.978131|2.818269|3.036309|3.585049|3.945596|4.480099|9.254772|0.201238|6.213756|8.773353|17.607778|8.864274|0.071669|0.095274|0.129603|0.066382|0.065658|0.076622|0.053277|0.051974|0.088124|0.128859|0.086048|0.081500|0.074733|0.069203|0.077039|0.100551|0.109815|0.112538|0.144409|0.135536|0.228052|0.177329|0.500000| |2.380490|2.796513|3.096157|2.784343|2.369184|2.230552|2.110357|1.935970|3.585599|2.324191|3.897635|3.377713|7.546158|3.042418|4.717920|4.404134|2.832951|3.051342|2.670215|2.638539|2.966822|3.529792|3.617767|4.147948|7.853326|0.145126|5.767443|8.650970|17.615864|8.807793|0.061119|0.080246|0.099310|0.055553|0.054208|0.061311|0.045622|0.044923|0.070200|0.096176|0.074525|0.069208|0.066322|0.065270|0.077805|0.105823|0.099156|0.113908|0.125574|0.142428|0.186613|0.222232|0.302282|0.500000| |2.041162|2.337411|2.660426|2.530883|2.163947|1.981716|2.000863|1.889023|3.573156|2.270064|3.771302|3.378021|7.139068|3.378822|5.282612|5.221520|3.582923|4.214505|3.525113|3.554991|4.344763|5.946664|5.826136|7.069142|12.407790|0.181949|7.049617|6.662734|8.749337|17.603934|0.052104|0.065023|0.084294|0.049869|0.050949|0.058995|0.044084|0.044402|0.070010|0.109892|0.094823|0.083953|0.082852|0.083813|0.110614|0.198636|0.144565|0.212157|0.141979|0.196434|0.137067|0.167640|0.173917|0.218120|0.500000| |2.201914|2.496517|2.878883|2.814371|2.408878|2.173399|2.246896|2.074427|3.886886|2.469060|4.250480|3.944896|8.711677|3.898123|5.769410|6.458434|4.220793|5.097769|4.270733|4.201218|4.895601|6.332109|6.599272|6.599861|12.236473|0.227004|5.744942|5.635180|8.629267|17.671108|0.055683|0.067945|0.089340|0.054620|0.057106|0.067762|0.048085|0.047777|0.077625|0.148238|0.103982|0.098885|0.099414|0.097516|0.119007|0.175382|0.138805|0.160951|0.128870|0.139628|0.130033|0.129586|0.218373|0.194672|0.300416|0.500000| 1289.429095 -8561.862031 3372.869883 -175.177198 -4074.740251 2783.641905 -1291.098346 2.001295 4062000000000008 442EE9ED0691CAA9 43B2C0DD6FF76176 42203F68F2C00001 B7C5C72F9A2489F9 43A1496D6C99EF91