Version2.2 2021-02-12T14:42:26Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 17-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc2cc(ccc2c1)[C@@H](CNC(=O)NC[C@@H](c3ccco3)[NH+]4CCCC4)O C67455243 RHF 6-31G(d) (6D,7F) c1ccc2cc(ccc2c1)[C@@H](CNC(=O)NC[C@@H](c3ccco3)[NH+]4CCCC4)O C01[X(C23H28N3O3)] 165 C1 491 O=C(NC[C@H]([NH+]1CCCC1)c1ccco1)NC[C@H](c1ccc2c(c1)cccc2)O O=C(NC[C@H]([NH+]1CCCC1)c1ccco1)NC[C@H](c1ccc2c(c1)cccc2)O O[C@H](CNC(=O)NC[C@H]([NH+]1CCCC1)c2occc2)c3ccc4ccccc4c3 InChIKey=XAEXVZXPZNAYRP-LEWJYISDSA-O InChI=1S/C23H27N3O3/c27-21(19-10-9-17-6-1-2-7-18(17)14-19)16-25-23(28)24-15-20(22-8-5-13-29-22)26-11-3-4-12-26/h1-2,5-10,13-14,20-21,27H,3-4,11-12,15-16H2,(H2,24,25,28)/p+1/t20-,21+/m0/s1 InChI=1/C23H27N3O3/c27-21(19-10-9-17-6-1-2-7-18(17)14-19)16-25-23(28)24-15-20(22-8-5-13-29-22)26-11-3-4-12-26/h1-2,5-10,13-14,20-21,27H,3-4,11-12,15-16H2,(H2,24,25,28)/p+1/t20-,21+/m0/s1/fC23H28N3O3/h24-26H/q+1 c1ccc2cc(ccc2c1)[C@@H](CNC(=O)NC[C@@H](c3ccco3)[NH+]4CCCC4)O C01[X(C23H28N3O3)] 165 C01 491 O=C(NC[C@H]([NH+]1CCCC1)c1ccco1)NC[C@H](c1ccc2c(c1)cccc2)O O=[C]([NH]C[C@H]([C]1[CH]=[CH][C]2[C]([CH]=1)[CH]=[CH][CH]=[CH]2)O)NC[C@@H](C1=[CH][CH]=CO1)[NH]1CCCC1 O[C@H](CNC(=O)NC[C@H]([NH]1CCCC1)c2occc2)C3=C[C]4C=CC=C[C]4C=C3 InChIKey=OAIYEGGOWTYGNI-LEWJYISDSA-N InChI=1S/C23H28N3O3/c27-21(19-10-9-17-6-1-2-7-18(17)14-19)16-25-23(28)24-15-20(22-8-5-13-29-22)26-11-3-4-12-26/h1-2,5-10,13-14,20-21,26-27H,3-4,11-12,15-16H2,(H2,24,25,28)/t20-,21+/m0/s1 InChI=1/C23H28N3O3/c27-21(19-10-9-17-6-1-2-7-18(17)14-19)16-25-23(28)24-15-20(22-8-5-13-29-22)26-11-3-4-12-26/h1-2,5-10,13-14,20-21,26-27H,3-4,11-12,15-16H2,(H2,24,25,28)/t20-,21+/m0/s1/f/h24-25H 2587.8368119487 -1275.0350091 1-A 21856.8628 105 386 491 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.75381 -20.64523 -20.61972 -15.82792 -15.69509 -15.67273 -11.47609 -11.43353 -11.42173 -11.41545 -11.41175 -11.40189 -11.40110 -11.36777 -11.36544 -11.36409 -11.35321 -11.34083 -11.33961 -11.30278 -11.29923 -11.29821 -11.29745 -11.29408 -11.29239 -11.28787 -11.28682 -11.28597 -11.28503 -1.59467 -1.50582 -1.47073 -1.45521 -1.35448 -1.31971 -1.24171 -1.23795 -1.20817 -1.17831 -1.17343 -1.15801 -1.12165 -1.10753 -1.09319 -1.05872 -1.04329 -1.01634 -1.00695 -0.95918 -0.94416 -0.93561 -0.90851 -0.90381 -0.89909 -0.88446 -0.87790 -0.87291 -0.86458 -0.85683 -0.81780 -0.79744 -0.79183 -0.78078 -0.76384 -0.76060 -0.75957 -0.75496 -0.74439 -0.74101 -0.73661 -0.72105 -0.71493 -0.70335 -0.69695 -0.68806 -0.68608 -0.68306 -0.67963 -0.66960 -0.66312 -0.66261 -0.65550 -0.64954 -0.64286 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1579.0781 1591.1055 1607.6171 1639.0501 1639.5114 1642.8795 1647.0842 1650.7794 1655.6500 1663.9038 1676.6984 1680.0410 1703.6749 1735.5865 1781.4893 1811.9774 1826.1153 1849.0040 1904.6467 3207.8907 3233.4560 3238.0884 3254.5758 3264.9218 3287.2968 3290.6794 3306.6426 3312.8711 3314.0922 3335.9813 3346.8515 3351.8426 3357.7516 3360.9658 3361.3581 3365.0105 3368.6004 3378.5218 3387.0543 3392.3054 3443.3790 3458.2558 3491.8882 3709.4070 3862.8160 3877.3679 4099.1309 4.7581 5.4578 4.8812 5.5213 2.8057 4.5316 4.5864 3.9408 4.4807 4.3649 5.2820 3.7737 4.5959 4.9921 5.2518 4.3727 3.6965 3.2553 4.4233 1.8770 3.9584 5.5515 4.9749 3.2726 2.7932 1.4232 1.9940 1.6192 3.1100 3.1217 3.0710 3.2502 2.5928 3.3613 6.4245 2.9076 1.9884 1.8963 3.0915 3.0284 2.8522 6.4006 3.5615 2.9879 3.2045 3.8319 4.0357 4.5541 3.6806 1.4277 2.9735 8.6468 1.2534 1.5567 2.4637 1.4810 2.1696 3.4332 6.3637 1.4822 1.3750 2.4459 2.4524 2.4183 3.3880 1.5414 1.4446 3.3037 1.9826 2.1796 2.7208 1.3305 2.8152 2.6003 1.5781 1.3374 1.3537 2.6915 2.6165 2.0609 3.4652 2.5822 2.2667 2.4691 1.7024 2.8263 2.0029 1.7485 1.1971 2.4055 1.4639 1.5688 1.3321 1.2435 1.3955 1.4983 1.4313 1.7795 1.8724 1.8105 1.9140 1.2650 1.2884 1.2571 1.7637 1.3562 1.2031 3.8865 1.5106 1.4232 1.3633 2.2795 1.3618 1.4501 1.2232 2.0712 1.4967 1.3536 1.5671 1.2311 2.1245 1.0922 2.1357 1.0940 1.1007 1.1114 1.0956 1.4894 1.1047 2.9922 4.3649 2.3679 6.4965 5.0068 6.2948 5.9027 7.1976 1.0858 1.0712 1.0707 1.0655 1.0607 1.0651 1.0680 1.0955 1.1039 1.1055 1.0978 1.0916 1.0898 1.0878 1.0897 1.1102 1.0895 1.1114 1.0959 1.0960 1.0984 1.0976 1.0970 1.1073 1.0782 1.0785 1.0792 1.0670 0.0004 0.0008 0.0012 0.0037 0.0039 0.0077 0.0104 0.0119 0.0183 0.0257 0.0351 0.0332 0.0575 0.0777 0.1006 0.1043 0.0905 0.1183 0.1794 0.0830 0.1993 0.3021 0.3242 0.2460 0.2247 0.1255 0.1886 0.1582 0.3232 0.3711 0.3847 0.5320 0.4413 0.5904 1.1830 0.5608 0.4167 0.4239 0.7228 0.7430 0.7170 1.7616 1.0101 0.9550 1.0663 1.3736 1.5054 1.8869 1.5437 0.6029 1.2785 3.8228 0.5679 0.7270 1.2392 0.7564 1.1156 1.7911 3.5119 0.8297 0.7723 1.4024 1.4239 1.4285 2.0834 0.9509 0.9087 2.0852 1.2617 1.4515 1.8977 0.9368 2.0021 1.8589 1.1366 0.9737 1.0162 2.0363 2.0036 1.6029 2.7893 2.1142 1.9052 2.0978 1.4834 2.5190 1.8367 1.6833 1.1617 2.3551 1.4451 1.5907 1.3700 1.3020 1.4686 1.5935 1.5805 1.9757 2.1089 2.0458 2.1884 1.4716 1.5222 1.5175 2.1826 1.7261 1.5458 5.0280 1.9892 1.8822 1.8051 3.0629 1.8624 2.0288 1.7159 2.9220 2.1363 1.9627 2.3023 1.8362 3.2350 1.7288 3.3824 1.7397 1.7593 1.7845 1.7694 2.4295 1.8297 4.9759 7.4645 4.2024 12.1477 9.6854 12.3677 11.8898 15.3839 6.5834 6.5989 6.6143 6.6493 6.6617 6.7815 6.8138 7.0571 7.1382 7.1537 7.1981 7.2039 7.2141 7.2257 7.2524 7.3904 7.2684 7.4305 7.3700 7.4079 7.4473 7.6674 7.7301 7.9549 8.7411 9.4816 9.5589 10.5636 0.2912 0.0477 0.9789 1.1468 0.1253 1.9902 2.6156 0.8034 1.2613 7.4170 10.5751 7.9013 2.4931 2.0021 0.9672 7.3920 1.5104 1.1191 8.9558 1.7573 0.0238 4.6288 9.9276 10.7262 28.1991 80.2788 109.0873 31.6552 11.0607 5.2416 12.0856 4.4671 19.6138 10.2871 0.6343 35.9442 102.8142 60.6915 12.4450 14.2860 10.6778 3.4157 7.3316 4.4674 7.3056 6.0551 23.5963 3.5463 7.1423 38.1086 2.3253 41.6524 55.1440 7.9715 2.4489 27.5695 17.9549 7.9568 8.3464 18.6847 6.5369 9.1039 1.8752 6.0983 33.4362 15.0589 0.9024 5.4294 5.7497 12.8904 67.3596 2.3734 21.6871 1.0797 8.2024 0.9548 0.3436 12.6494 30.4468 10.5103 76.9531 5.2746 0.2293 25.8370 20.1149 46.8677 14.1649 26.0377 0.6052 30.1240 1.6987 2.4732 4.9750 52.4005 2.0771 14.9630 82.9203 74.4119 8.2139 53.1100 6.4260 28.2007 1.3433 152.1058 37.3651 1.5756 5.4654 0.7440 0.6033 5.2132 1.0189 8.5459 2.9209 14.6424 18.3041 10.0580 14.0090 107.1644 16.9112 65.6964 5.0728 6.8586 3.4285 11.1103 3.1661 20.9090 0.2291 38.8605 9.3563 16.0209 22.8935 974.4857 0.4180 8.6221 3.5156 0.6047 440.5402 25.5324 17.3275 45.6859 13.9270 19.6959 5.7114 6.9113 6.2554 11.8620 19.6643 6.5664 11.5854 0.1386 5.6816 5.5477 5.3848 1.1045 12.6820 30.8720 20.7720 27.2123 1.5897 0.6893 0.0211 46.9572 43.7694 82.0826 77.2748 5.0514 1.5668 2.7982 3.6773 1.1772 6.2591 0.7954 2.7161 3.0815 0.7320 1.0861 0.1823 1.5308 1.2614 0.2475 0.2581 0.1007 0.8835 2.0633 0.0442 2.3093 1.1958 2.2821 2.4765 0.8608 3.3432 0.6274 1.1392 1.7531 3.2993 2.9312 1.7048 0.3080 1.6920 7.4544 2.1888 1.0500 2.2239 1.3087 2.3731 1.3337 0.0587 1.3917 0.2238 2.0814 0.6847 1.3673 24.9694 5.6061 2.8003 4.6851 0.6691 1.5605 2.0046 10.4691 0.9859 5.3672 1.2948 5.3839 2.3821 2.0147 9.3512 0.8750 2.1555 5.8578 1.7371 2.2681 4.4653 1.6448 13.5957 0.6772 0.7595 8.0252 12.2229 2.5632 0.5479 0.8516 9.4890 3.5192 14.9663 4.4368 6.0306 3.6617 8.3912 2.3036 8.1010 1.5357 4.6711 10.4104 1.1414 10.0608 0.8451 1.4952 3.1932 14.2004 4.6026 4.8813 1.2708 3.5263 1.4894 0.2775 15.4214 4.0099 13.1677 13.3786 0.6466 5.5763 187.0789 38.8469 16.3360 2.3621 93.3507 2.4710 13.4155 3.7621 10.6947 13.1291 1.5882 24.2224 8.5936 17.5332 16.0694 54.9403 8.6181 16.1042 11.3803 2.2279 8.2152 8.1002 0.3275 107.0717 5.5145 42.6001 4.3903 37.6223 29.6935 10.4312 66.1376 95.8683 33.3715 64.4941 57.4861 28.3909 74.1406 148.6548 42.9851 83.1849 23.0308 31.6065 25.6523 26.1278 3.6090 40.2198 161.9427 56.6566 96.7763 85.3563 333.4142 57.4201 80.4898 126.8205 21.0474 15.3360 75.1389 89.9284 0.7500 0.7464 0.7446 0.7248 0.7494 0.7500 0.7457 0.7499 0.7458 0.7470 0.7498 0.5797 0.5179 0.4523 0.7177 0.6172 0.5335 0.2103 0.1789 0.6588 0.6159 0.5657 0.2639 0.4266 0.2030 0.6929 0.3527 0.6458 0.6133 0.7205 0.2674 0.1217 0.7299 0.4264 0.5015 0.2040 0.5509 0.7440 0.6717 0.6887 0.7005 0.7291 0.5265 0.6695 0.6651 0.4549 0.2751 0.0881 0.3857 0.7398 0.7444 0.7055 0.7131 0.2884 0.0852 0.2306 0.1849 0.2331 0.7480 0.7158 0.2242 0.1020 0.7499 0.7334 0.1830 0.7144 0.6623 0.2725 0.7412 0.1922 0.7457 0.6296 0.0747 0.2140 0.7088 0.3702 0.5445 0.1903 0.4228 0.5547 0.6582 0.6750 0.5660 0.4201 0.6791 0.3881 0.7132 0.5849 0.7383 0.4235 0.5374 0.6095 0.6498 0.6843 0.6195 0.5935 0.6773 0.7156 0.3646 0.6919 0.6693 0.4294 0.2979 0.6142 0.2274 0.3839 0.7500 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14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 1.00783 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 5136.7987 35968.7327 38704.6137 0.99999 0.00520 -0.00070 -0.00520 0.99998 0.00386 0.00072 -0.00385 0.99999 1 0.01686 0.00241 0.00224 0.35134 0.05018 0.04663 17.45 22.27 29.16 48.75 69.57 77.48 89.32 102.93 119.80 143.77 152.82 175.70 209.70 233.92 259.46 289.44 293.28 357.35 377.48 394.28 420.62 437.26 478.47 513.94 531.70 556.69 576.48 585.95 604.25 646.31 663.40 758.31 773.34 785.59 804.35 823.22 858.12 886.21 906.36 928.42 939.83 983.35 998.24 1059.71 1081.26 1122.23 1144.79 1206.55 1213.92 1218.10 1229.08 1246.33 1261.72 1280.92 1329.40 1339.58 1344.12 1353.89 1392.47 1402.41 1404.75 1419.34 1428.29 1440.63 1469.88 1472.22 1486.64 1489.15 1495.30 1529.63 1565.44 1572.84 1580.73 1584.85 1590.80 1599.36 1624.02 1630.37 1640.27 1653.09 1681.74 1696.07 1718.48 1727.77 1749.71 1769.60 1794.99 1839.13 1846.49 1854.71 1862.37 1887.46 1900.92 1918.01 1922.94 1933.09 1969.71 1975.08 1989.27 1992.49 2004.29 2021.76 2037.42 2059.45 2085.18 2114.66 2124.65 2132.00 2151.01 2155.56 2156.89 2172.79 2192.03 2217.16 2220.10 2226.36 2239.40 2257.08 2271.94 2289.25 2313.00 2358.23 2358.89 2363.74 2369.79 2375.10 2382.11 2393.99 2412.39 2417.20 2451.21 2497.12 2563.17 2607.03 2627.37 2660.30 2740.36 4615.44 4652.22 4658.89 4682.61 4697.49 4729.69 4734.55 4757.52 4766.48 4768.24 4799.73 4815.37 4822.55 4831.06 4835.68 4836.24 4841.50 4846.66 4860.94 4873.22 4880.77 4954.25 4975.66 5024.05 5337.01 5557.73 5578.67 5897.74 0.524915 0.549530 0.550474 0.465545 -1274.510094 -1274.485479 -1274.484535 -1274.569464 2.848533D-04 MUNgauss RevisionA2.1 retrievium 12-Feb-2021 DUDE c1ccc2cc(ccc2c1)[C@@H](CNC(=O)NC[C@@H](c3ccco3)[NH+]4CCCC4)O C67455243 RHF 6-31G(d) (6D,10F) C1 394.213067 |X|Y|Z| 48.167775 28.742382 136.785906 57.425779 27 6 7 8 23 3 1 |36.858105| |13.452412|36.858105| |7.914503|14.021670|36.858105| |6.813929|7.893977|13.419458|36.858105| |4.518420|5.121058|7.668955|13.409585|36.858105| |3.776038|3.936532|5.109617|7.852143|14.004920|36.858105| |3.942979|3.784499|4.516674|6.807682|7.931849|13.391200|36.858105| |5.118463|4.517561|5.106091|7.825826|6.857775|7.892701|14.042746|36.858105| |7.894155|6.813143|7.815961|13.532179|7.820589|6.774146|7.877757|13.404298|36.858105| |14.020431|7.913850|6.832998|7.817289|5.105437|4.502269|5.116935|7.661574|13.422309|36.858105| |2.918278|3.071744|3.823043|4.988370|7.621098|12.583728|7.492372|5.024821|4.403829|3.316002|36.858105| |2.804417|3.048628|3.856578|4.758788|7.362506|8.927852|5.574510|4.197638|3.965254|3.075329|17.529639|0.500000| |2.621111|2.727461|3.282233|4.082620|5.524675|7.568071|5.900421|4.281255|3.751065|2.952182|12.500875|0.248415|36.858105| |2.196918|2.288468|2.687119|3.173370|4.058621|5.038464|4.231478|3.287626|2.942923|2.421940|7.846424|0.197641|13.108508|53.358707| |1.981907|2.066190|2.383739|2.724128|3.330502|3.865724|3.379508|2.773295|2.540024|2.151408|5.187394|0.139237|7.780687|19.342369|36.858105| |2.001186|2.091472|2.401418|2.710306|3.247737|3.643271|3.215049|2.710005|2.522786|2.156952|4.524494|0.121807|6.765874|11.477920|15.707057|73.516695| |1.747538|1.814641|2.061058|2.312504|2.753863|3.133885|2.817745|2.367420|2.178850|1.882413|4.052291|0.111544|5.194434|11.260641|13.825916|15.095513|53.358707| |1.591364|1.655537|1.857681|2.039542|2.368599|2.605226|2.371522|2.053790|1.923563|1.693017|3.182851|0.089044|3.921210|7.187329|7.896271|12.665696|18.015896|36.858105| |1.531898|1.574798|1.744329|1.914949|2.177464|2.399816|2.252937|1.977235|1.839617|1.635718|2.824971|0.076671|3.514122|5.954713|6.125765|11.211733|10.624498|12.323342|36.858105| |1.637870|1.675936|1.859822|2.062500|2.349051|2.619578|2.477724|2.161527|1.993050|1.762067|3.073478|0.081619|3.984934|6.618770|6.973573|13.792533|10.287573|8.853568|17.688839|0.500000| |1.418328|1.445290|1.585883|1.740239|1.956144|2.166218|2.076188|1.833969|1.693954|1.518304|2.520623|0.067843|3.017173|5.021147|4.635519|7.899747|8.158345|7.553914|12.791572|0.250222|36.858105| |1.405483|1.417719|1.546345|1.707411|1.904250|2.131817|2.088708|1.848158|1.686225|1.515603|2.452746|0.064815|2.904049|4.712820|4.082933|6.845724|6.733334|5.276746|7.325106|0.189884|14.236384|36.858105| |1.280642|1.290904|1.398788|1.530979|1.692337|1.874474|1.841787|1.648435|1.514000|1.373468|2.132082|0.056958|2.434809|3.883408|3.235160|5.404972|5.306701|4.196962|5.147909|0.128370|8.583246|13.215886|36.858105| |1.237108|1.256293|1.363479|1.480054|1.639109|1.794150|1.737984|1.559916|1.449098|1.316588|2.047027|0.055608|2.321552|3.731154|3.158356|5.308705|5.317967|4.516095|5.351774|0.123412|8.762003|8.587493|14.244430|36.858105| |1.305919|1.335019|1.458641|1.583165|1.768461|1.931178|1.844268|1.645621|1.535490|1.387030|2.228502|0.060981|2.577617|4.228058|3.755000|6.379665|6.581871|6.278889|7.912797|0.160068|14.082497|8.614350|8.615833|14.097410|73.516695| |1.443920|1.489528|1.636784|1.767024|1.977872|2.126125|1.997238|1.789317|1.692600|1.524602|2.428570|0.066791|2.942345|4.683312|4.523517|8.987616|6.975809|7.588685|12.576942|0.254221|7.763936|5.265612|4.225044|4.630274|11.758373|53.358707| |1.367465|1.414666|1.551764|1.664085|1.859242|1.984871|1.858501|1.671105|1.589037|1.436831|2.267573|0.063103|2.678438|4.281091|4.017097|7.625826|6.432647|7.191731|9.305289|0.182661|7.138745|4.832157|4.177016|4.912341|13.044455|25.734572|0.500000| |1.527627|1.590154|1.754311|1.878648|2.102860|2.221418|2.057564|1.853916|1.778311|1.601321|2.510053|0.069797|3.063291|4.707968|4.542432|9.944016|6.304786|6.246040|7.446826|0.195536|4.952907|3.841438|3.184864|3.386306|7.776502|16.941085|0.254799|36.858105| |1.459996|1.509745|1.643214|1.744959|1.912211|2.001543|1.887866|1.732498|1.669709|1.524579|2.193365|0.060403|2.627803|3.856878|3.493039|7.492710|4.714489|4.235173|5.180421|0.145699|4.021277|3.355960|2.857669|2.981185|6.451630|10.624768|0.176312|12.420749|36.858105| |1.331535|1.366394|1.476109|1.568921|1.708758|1.800915|1.721666|1.584641|1.516997|1.393606|1.971887|0.054028|2.322641|3.446611|3.062267|6.191787|4.328120|3.919520|5.082869|0.135476|4.368724|3.659529|3.198390|3.388596|7.274892|10.900768|0.193441|7.860806|12.457588|36.858105| |1.364068|1.394122|1.513603|1.628914|1.791774|1.922032|1.843639|1.674975|1.581723|1.440929|2.141209|0.058153|2.556562|3.908298|3.555330|7.013641|5.239793|4.900901|7.494107|0.189924|6.579544|5.163368|4.265402|4.502116|10.227106|17.178482|0.259734|7.819727|8.008868|12.540474|36.858105| |2.595514|2.660083|3.167085|3.988716|5.312437|7.834491|6.528674|4.502920|3.781502|2.965496|13.502329|0.258415|8.149628|9.671833|4.740825|6.998613|5.469937|3.098324|2.760304|0.082343|2.553636|2.540639|2.232282|2.119748|4.030490|3.171342|0.060948|2.329892|2.039970|1.877736|2.070174|73.516695| |17.722668|8.827115|5.650540|4.921784|3.600489|3.124487|3.289106|4.143342|5.617452|9.008333|2.510316|0.067264|2.293801|2.667886|1.789541|3.219346|2.170969|1.465115|1.418753|0.042000|1.320984|1.312057|1.202029|1.161700|2.171609|1.831095|0.035475|1.420107|1.367444|1.253613|1.279440|4.046655|0.500000| |8.826767|17.722068|9.008541|5.617173|4.145440|3.285319|3.130478|3.599916|4.921330|5.650124|2.685023|0.075216|2.420929|2.826369|1.900963|3.433391|2.295563|1.555236|1.479554|0.043478|1.359596|1.329559|1.216945|1.189798|2.246887|1.920998|0.037393|1.510711|1.440848|1.305542|1.323536|4.183654|0.213964|0.500000| |5.623130|8.997988|17.706118|8.829579|7.036701|4.689466|3.933705|4.151598|5.591004|4.930329|3.749085|0.109978|3.230976|3.669791|2.411574|4.326882|2.845820|1.895321|1.760417|0.051778|1.590999|1.537562|1.393274|1.368138|2.614956|2.259992|0.043918|1.792380|1.669673|1.492681|1.524077|5.468380|0.124075|0.216512|0.500000| |3.939962|4.705502|7.065201|8.851936|17.684876|8.995980|5.625761|4.941641|5.598267|4.154267|7.051003|0.225686|5.270333|5.550801|3.399267|5.904626|3.838863|2.443902|2.205437|0.065372|1.962937|1.885315|1.680550|1.645266|3.178928|2.745421|0.052990|2.166154|1.951709|1.732522|1.806857|8.713241|0.089812|0.111530|0.214059|0.500000| |3.290096|3.130855|3.599602|4.918873|5.657138|8.813347|17.726496|9.018067|5.611736|4.144863|6.980728|0.141019|5.964204|6.058483|3.518291|5.827138|4.035247|2.461381|2.361071|0.072529|2.205017|2.253314|1.978228|1.843705|3.453440|2.804949|0.053121|2.086706|1.910712|1.760567|1.910116|12.712386|0.078955|0.074080|0.089690|0.124042|0.500000| |4.692223|3.933094|4.150282|5.596685|4.943418|5.615320|9.017202|17.708419|8.832948|7.034530|4.093020|0.096423|3.664462|3.991137|2.524047|4.393463|2.984795|1.919541|1.873976|0.056899|1.760032|1.793429|1.607783|1.511828|2.810879|2.314154|0.044121|1.746843|1.648453|1.522218|1.610526|6.916277|0.111222|0.089675|0.095787|0.107321|0.217089|0.500000| |8.996292|5.622721|4.930621|5.592534|4.151181|3.922349|4.691897|7.030085|8.833892|17.709872|3.001112|0.076461|2.725728|3.088590|2.029031|3.611063|2.438188|1.615714|1.576155|0.047211|1.475834|1.485257|1.349892|1.287475|2.396387|1.999071|0.038431|1.531237|1.466841|1.350976|1.399663|4.921307|0.216451|0.124062|0.107129|0.095845|0.111300|0.212863|0.500000| |2.699661|2.862417|3.481694|4.231396|5.687088|6.813136|5.209104|4.060937|3.754646|2.983496|8.862649|0.217447|17.660744|12.521372|7.303157|13.360498|6.552387|3.871450|3.487711|0.110243|2.908055|2.742627|2.304547|2.225932|4.445099|4.115650|0.075998|3.286094|2.823353|2.427199|2.615206|10.316673|0.065467|0.070887|0.096762|0.157536|0.137172|0.096042|0.075524|0.500000| |2.642205|2.671196|3.135100|3.945036|4.988462|7.009239|6.514928|4.651543|3.853573|3.045249|8.870886|0.174685|17.561544|12.363645|6.520394|10.668663|6.339556|3.617591|3.433303|0.111063|3.014849|2.989995|2.483437|2.318945|4.513665|3.906035|0.071804|2.941677|2.587801|2.314135|2.563866|12.821540|0.064529|0.065490|0.083443|0.124777|0.199346|0.113366|0.079662|0.301820|0.500000| |2.107765|2.179897|2.538047|2.994029|3.780080|4.746935|4.108987|3.183919|2.815779|2.330735|7.403423|0.186092|9.138131|26.026844|9.392211|10.821879|10.494883|4.887203|4.047473|0.120742|3.614536|3.477431|2.921449|2.787775|5.498583|4.305154|0.081890|3.076673|2.554221|2.342650|2.676789|14.817120|0.052458|0.055029|0.070439|0.104536|0.123770|0.079799|0.061115|0.180791|0.205728|0.500000| |1.714886|1.781204|2.023533|2.270122|2.711034|3.095507|2.778241|2.326716|2.138047|1.846967|4.063293|0.113519|4.845196|10.459372|9.288807|10.882826|26.061237|9.104736|5.917782|0.154714|5.217026|4.531418|3.781145|3.809801|8.031212|5.736996|0.112836|3.804637|2.962423|2.779403|3.309220|7.529456|0.043498|0.046016|0.057091|0.077320|0.081572|0.059904|0.048847|0.120546|0.119685|0.233408|0.500000| |1.484613|1.543743|1.722538|1.877167|2.162791|2.362042|2.162607|1.887864|1.774164|1.573005|2.859327|0.080806|3.356402|6.000060|5.797039|9.112768|12.601455|17.621172|8.812233|0.175657|7.333889|5.135592|4.415649|5.075294|12.891386|8.718820|0.192150|5.093970|3.685949|3.581024|4.430409|5.070986|0.038133|0.040471|0.048912|0.062128|0.062403|0.049261|0.041810|0.090852|0.086421|0.119892|0.234993|0.500000| |1.618590|1.700248|1.915210|2.081056|2.419534|2.605920|2.334445|2.037121|1.937101|1.707266|3.151650|0.090185|3.862119|6.773640|7.325744|13.342265|12.471319|17.614896|8.751465|0.199542|5.583095|4.162686|3.450559|3.732958|8.850188|10.098390|0.198647|7.429173|4.652524|4.040195|4.693571|5.269847|0.041354|0.044555|0.054809|0.070420|0.066101|0.052524|0.044964|0.110821|0.096763|0.123126|0.192608|0.302316|0.500000| |1.477707|1.480488|1.613574|1.797490|2.001372|2.267876|2.255523|1.988258|1.792480|1.606497|2.594465|0.067271|3.113446|4.956854|4.197814|7.068984|6.494473|4.709830|6.315866|0.188822|8.832955|17.793535|8.439071|5.850029|10.435403|6.304047|0.114147|3.613698|3.229669|3.425252|4.646905|4.796384|0.038265|0.038374|0.044244|0.054425|0.068446|0.053879|0.043913|0.080775|0.091682|0.101275|0.120326|0.121444|0.106275|0.500000| |1.235821|1.239172|1.335472|1.460970|1.602888|1.775492|1.764217|1.589009|1.455484|1.327248|1.996751|0.053112|2.244815|3.509731|2.835767|4.739670|4.504142|3.435572|4.037509|0.105035|5.849985|8.442509|17.811445|8.838250|10.440348|4.682652|0.094335|2.720694|2.501850|2.784145|3.548617|3.752538|0.032325|0.032461|0.036812|0.043986|0.052862|0.043370|0.036421|0.058759|0.064165|0.074026|0.090739|0.099627|0.080777|0.193177|0.500000| |1.163945|1.183516|1.280121|1.380397|1.521172|1.651139|1.597865|1.444069|1.349763|1.232871|1.870205|0.051199|2.085003|3.310473|2.753357|4.646186|4.554697|3.844079|4.286845|0.100595|6.027234|5.809650|8.618202|17.840117|16.454990|5.376357|0.120265|3.015341|2.697724|3.075154|3.869566|3.443311|0.030453|0.031257|0.035765|0.042555|0.046835|0.038918|0.033498|0.055782|0.057523|0.068937|0.092411|0.122440|0.091716|0.123021|0.195205|0.500000| |1.483812|1.556322|1.719257|1.823316|2.042964|2.131670|1.953808|1.765884|1.710154|1.543575|2.412515|0.068360|2.871104|4.428863|4.175100|8.737085|5.924282|5.955675|6.070868|0.150597|4.341382|3.388451|2.923043|3.191293|7.296350|12.241973|0.243233|17.648560|8.709766|6.337999|5.978044|3.978457|0.038351|0.041297|0.049232|0.059189|0.054633|0.046058|0.040844|0.085707|0.075138|0.081246|0.102450|0.143166|0.215003|0.087366|0.069895|0.080991|0.500000| |1.670743|1.743729|1.942925|2.100743|2.381998|2.533077|2.320794|2.067928|1.977133|1.760300|2.894812|0.080162|3.664429|5.638557|5.711559|14.057705|7.315784|6.788309|7.539636|0.225441|4.791840|3.824586|3.090769|3.189443|7.171378|12.182670|0.187173|17.676530|8.648452|5.784886|6.125032|4.680859|0.042842|0.045721|0.055112|0.068189|0.065203|0.053678|0.046526|0.111744|0.096800|0.098680|0.117767|0.142378|0.231392|0.103307|0.073903|0.078227|0.300957|0.500000| |1.428676|1.485339|1.611643|1.691645|1.841703|1.899726|1.783614|1.651157|1.609681|1.478920|2.060733|0.057324|2.423482|3.505633|3.097652|6.557819|4.148154|3.651359|4.140841|0.114767|3.337577|2.838797|2.487720|2.615181|5.546032|7.834591|0.144181|8.769186|17.616516|8.691569|5.707234|3.386816|0.037273|0.039627|0.045752|0.052579|0.049685|0.043572|0.039422|0.072991|0.065718|0.064714|0.073898|0.090578|0.114117|0.075972|0.061374|0.067140|0.222811|0.187979|0.500000| |1.536758|1.581153|1.717822|1.832886|1.999077|2.098992|1.996315|1.837229|1.764976|1.611544|2.274802|0.061869|2.760630|3.953939|3.541711|7.793044|4.596576|3.914756|4.822957|0.146983|3.797126|3.299525|2.763224|2.792382|5.886651|8.603484|0.139870|8.822414|17.585903|8.823759|6.834739|3.733657|0.039953|0.041760|0.048171|0.056172|0.056147|0.048664|0.043156|0.083058|0.076806|0.072061|0.079953|0.093225|0.116613|0.091273|0.067999|0.069675|0.176066|0.223928|0.302739|0.500000| |1.259800|1.297057|1.399088|1.477364|1.606810|1.682562|1.602108|1.478731|1.423238|1.311794|1.842873|0.050965|2.134805|3.181667|2.794188|5.521580|4.020890|3.680602|4.494892|0.114554|3.998329|3.330173|3.032199|3.324683|7.115100|9.401968|0.194836|6.694810|8.767636|17.547862|8.842079|3.132912|0.033018|0.034575|0.039473|0.045513|0.045366|0.039435|0.035288|0.061789|0.058509|0.060662|0.073070|0.096981|0.106657|0.084898|0.073640|0.086263|0.172985|0.136761|0.216445|0.173719|0.500000| |1.295681|1.322185|1.417989|1.504208|1.621854|1.706490|1.649181|1.531092|1.465667|1.355939|1.843476|0.050195|2.154859|3.138465|2.721144|5.460914|3.785488|3.281089|4.166918|0.115490|3.777729|3.348549|2.972372|3.069833|6.278238|7.770990|0.140983|5.642736|8.684992|17.612701|8.804632|3.128626|0.034026|0.035132|0.039649|0.045390|0.046888|0.041121|0.036687|0.062406|0.060381|0.059566|0.068436|0.084030|0.092575|0.089130|0.073552|0.078058|0.131519|0.128405|0.195199|0.218129|0.302198|0.500000| |1.422604|1.444682|1.567018|1.699594|1.866431|2.021057|1.959887|1.777638|1.664076|1.513137|2.241612|0.059989|2.715181|4.101954|3.711896|7.396002|5.304541|4.654485|7.312813|0.216131|6.555722|5.635464|4.372037|4.280040|9.200981|12.348557|0.183690|6.636779|6.977390|8.800318|17.628130|3.856129|0.037028|0.037920|0.043526|0.051770|0.056812|0.047672|0.040976|0.076773|0.077226|0.077676|0.092266|0.113535|0.120829|0.150409|0.102374|0.100140|0.138563|0.164254|0.139822|0.195224|0.173342|0.215700|0.500000| |1.282453|1.307382|1.414153|1.519540|1.666014|1.788871|1.724921|1.570747|1.480942|1.354234|1.991727|0.054156|2.335158|3.587488|3.186823|6.029181|4.839629|4.474059|6.497318|0.156241|6.912963|5.532506|4.901224|5.396284|12.002782|12.212069|0.235613|5.704204|5.670646|8.617606|17.669922|3.476519|0.033512|0.034536|0.039521|0.046613|0.049855|0.042144|0.036661|0.065401|0.065117|0.069698|0.087511|0.119437|0.115371|0.130987|0.111627|0.128974|0.135038|0.130470|0.125258|0.137961|0.214143|0.196946|0.300596|0.500000| |2.666031|2.733134|3.249593|4.076877|5.320919|7.374244|6.297467|4.535304|3.864935|3.041064|9.775518|0.225795|5.979007|7.263151|3.883161|5.906524|4.653926|2.730238|2.442988|0.071930|2.287585|2.281181|2.041835|1.949024|3.671952|2.857008|0.055419|2.101761|1.859132|1.720833|1.880710|35.707106|0.064882|0.067100|0.087443|0.136067|0.183336|0.108865|0.078667|0.130992|0.151308|0.169588|0.101042|0.071079|0.073142|0.066773|0.054081|0.049975|0.056565|0.065143|0.048624|0.052974|0.045163|0.044988|0.054417|0.049664|0.500000| 1273.558075 -8133.772200 3171.487595 -174.145526 -3862.872057 2587.836998 -1275.035059 2.001160 40A3AFFFFFFFFFF4 44263DCEF4461CAA 43AAFC20B3E571A4 42774D4CAD2AE000 40811FFFFFFFFFFE 44498E5BC13AEEF8