Version2.4 2021-05-21T11:33:31Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 10-Jul-2020 #N HF/3-21G OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1c2cc(ccc2[nH]n1)c3cc(cnc3)OC[C@H](Cc4cccc(c4)I)[NH3+] C14961659 RHF 3-21G (6D,7F) Cc1c2cc(ccc2[nH]n1)c3cc(cnc3)OC[C@H](Cc4cccc(c4)I)[NH3+] C01[X(C22H22I1N4O1)] 144 C1 320 Ic1cccc(c1)C[C@@H](COc1cncc(c1)c1ccc2c(c1)c(C)n[nH]2)[NH3+] Ic1cccc(c1)C[C@@H](COc1cncc(c1)c1ccc2c(c1)c(C)n[nH]2)[NH3+] Cc1n[nH]c2ccc(cc12)c3cncc(OC[C@@H]([NH3+])Cc4cccc(I)c4)c3 InChIKey=FSLZSZADDNCEFZ-IBGZPJMESA-O InChI=1S/C22H21IN4O/c1-14-21-10-16(5-6-22(21)27-26-14)17-9-20(12-25-11-17)28-13-19(24)8-15-3-2-4-18(23)7-15/h2-7,9-12,19H,8,13,24H2,1H3,(H,26,27)/p+1/t19-/m0/s1 InChI=1/C22H21IN4O/c1-14-21-10-16(5-6-22(21)27-26-14)17-9-20(12-25-11-17)28-13-19(24)8-15-3-2-4-18(23)7-15/h2-7,9-12,19H,8,13,24H2,1H3,(H,26,27)/p+1/t19-/m0/s1/fC22H22IN4O/h24,27H/q+1 Cc1c2cc(ccc2[nH]n1)c3cc(cnc3)OC[C@H](Cc4cccc(c4)I)[NH3+] C01[X(C22H22I1N4O1)] 144 C01 320 Ic1cccc(c1)C[C@@H](COc1cncc(c1)c1ccc2c(c1)c(C)n[nH]2)[NH3+] [NH3][C@@H](C[C]1[CH][CH][CH][C]([CH]1)I)CO[C]1[CH][N][CH][C]([CH]1)[C]1[CH][CH][C]2[C]([CH]1)[C]([N]N2)C C[C]1[N]N[C]2[CH][CH][C]([CH][C]12)[C]3[CH][N][CH][C]([CH]3)OC[C@@H]([NH3])C[C]4[CH][CH][CH][C](I)[CH]4 InChIKey=YFLIQICQXSMPOS-IBGZPJMESA-N InChI=1S/C22H22IN4O/c1-14-21-10-16(5-6-22(21)27-26-14)17-9-20(12-25-11-17)28-13-19(24)8-15-3-2-4-18(23)7-15/h2-7,9-12,19H,8,13H2,1,24H3,(H,26,27)/t19-/m0/s1 InChI=1/C22H22IN4O/c1-14-21-10-16(5-6-22(21)27-26-14)17-9-20(12-25-11-17)28-13-19(24)8-15-3-2-4-18(23)7-15/h2-7,9-12,19H,8,13H2,1,24H3,(H,26,27)/t19-/m0/s1/f/h27H 2898.3208281889 -8019.8498802 1-A 30749.4057 121 199 320 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| ********** -180.16919 -168.40898 -168.40770 -168.40758 -37.92102 -32.81577 -32.81135 -32.81122 -24.26514 -24.26317 -24.26297 -24.25848 -24.25848 -20.64097 -15.78515 -15.61475 -15.59759 -15.58954 -11.42143 -11.40631 -11.37163 -11.34915 -11.34675 -11.33393 -11.32206 -11.31685 -11.31404 -11.30845 -11.30804 -11.30730 -11.30326 -11.30161 -11.29972 -11.28051 -11.27141 -11.27033 -11.26859 -11.26122 -11.25128 -11.22616 -7.34333 -5.47746 -5.46563 -5.46519 -2.51969 -2.51466 -2.51442 -2.50120 -2.50120 -1.55719 -1.47976 -1.44239 -1.38099 -1.30895 -1.25242 -1.24955 -1.21012 -1.19968 -1.17846 -1.15887 -1.14845 -1.10868 -1.09215 -1.09010 -1.03722 -1.02255 -0.98785 -0.98145 -0.97397 -0.95466 -0.94829 -0.93751 -0.92540 -0.90419 -0.89905 -0.85736 -0.85182 -0.83409 -0.82962 -0.81494 -0.80999 -0.80220 -0.79382 -0.77612 -0.76090 -0.75448 -0.74139 -0.73005 -0.72405 -0.70691 -0.69939 -0.69668 -0.69089 -0.68850 -0.68282 -0.68053 -0.67968 -0.66628 -0.65338 -0.64480 -0.63321 -0.62840 -0.62656 -0.62139 -0.61491 -0.60087 -0.57061 -0.56722 -0.55991 -0.50986 -0.50685 -0.50043 -0.48502 -0.47273 -0.47073 -0.45979 -0.45039 -0.43069 -0.39841 -0.37338 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.00519 0.00901 0.01599 0.01654 0.03689 0.04259 0.05231 0.09444 0.10387 0.11339 0.13661 0.14122 0.14688 0.15446 0.16826 0.17555 0.17904 0.20197 0.20316 0.20688 0.21516 0.21719 0.22413 0.23031 0.23408 0.24034 0.24984 0.25163 0.25837 0.26776 0.27633 0.27654 0.27976 0.28918 0.29318 0.31122 0.32532 0.33572 0.34347 0.34812 0.35644 0.37174 0.38550 0.38794 0.39439 0.39777 0.41021 0.41823 0.42440 0.44336 0.45919 0.46578 0.49580 0.49758 0.50319 0.50446 0.52134 0.53857 0.58038 0.58950 0.63112 0.64525 0.66480 0.68069 0.71245 0.72680 0.73252 0.75620 0.76383 0.77057 0.79182 0.80505 0.82855 0.83575 0.84205 0.84493 0.85492 0.85848 0.86496 0.87237 0.87859 0.89040 0.90133 0.90486 0.90886 0.91677 0.92155 0.92811 0.93302 0.93995 0.94761 0.95459 0.96185 0.96451 0.97149 0.97492 0.97534 0.97999 0.99553 0.99919 1.00260 1.02361 1.02525 1.02705 1.04090 1.04590 1.06269 1.06909 1.07197 1.08922 1.09099 1.09339 1.10770 1.12830 1.13836 1.14103 1.14638 1.16684 1.17241 1.17475 1.17927 1.18881 1.19619 1.20619 1.22080 1.23225 1.24692 1.25621 1.25819 1.26532 1.27799 1.28331 1.28530 1.30877 1.31851 1.32722 1.32995 1.35299 1.36111 1.37458 1.37999 1.38437 1.39186 1.39847 1.41433 1.44238 1.45239 1.45671 1.46424 1.46483 1.46922 1.48355 1.49985 1.52365 1.53113 1.53951 1.55455 1.56516 1.57237 1.59238 1.62056 1.63426 1.64329 1.65727 1.66865 1.67927 1.69935 1.72672 1.73619 1.74402 1.79407 1.82308 1.86555 1.88095 1.89835 1.91987 1.98552 1.99061 2.04630 2.05361 2.08035 2.08171 2.10728 2.12774 2.17876 2.23689 2.24050 2.25696 2.40188 2.48074 2.61094 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435.4080 457.7206 494.5380 503.3347 513.6683 524.5839 546.6961 574.6263 597.2712 609.4118 628.1616 662.8936 677.7337 689.1410 709.6662 720.1654 754.6758 758.2720 774.4277 812.1126 820.3202 827.6069 829.8877 857.7188 915.2654 925.8783 945.9345 958.2391 986.9263 999.8977 1017.2947 1037.8396 1059.2848 1061.7048 1089.0119 1093.0450 1098.0146 1105.2986 1106.5393 1116.4451 1120.6723 1140.1439 1143.4048 1152.4162 1159.1486 1162.3647 1168.2527 1185.0282 1189.5658 1197.7335 1203.5168 1203.8635 1204.3382 1225.3467 1269.7486 1276.7069 1281.2127 1283.6499 1322.1395 1328.2040 1332.7398 1347.4712 1366.1838 1389.1040 1414.7044 1420.4038 1427.2337 1435.5853 1473.6043 1484.5946 1494.4153 1513.6826 1540.5418 1542.2491 1547.3606 1568.5063 1581.7550 1583.5620 1587.8519 1607.3302 1622.7050 1641.1325 1644.0557 1648.2925 1653.5441 1658.2700 1686.2554 1708.5674 1725.6396 1741.7088 1742.9803 1758.6636 1761.2099 1786.8431 1814.5231 1847.5015 3202.6881 3218.8506 3230.8666 3250.2020 3262.3465 3289.4503 3298.1823 3317.6636 3346.7073 3358.6881 3362.4059 3365.1719 3380.1544 3387.0040 3390.2869 3394.6155 3400.9697 3401.6113 3465.4810 3603.4734 3646.0917 3875.0132 9.3353 5.5398 5.6385 5.6592 4.3169 4.7492 4.4407 5.1611 5.0548 1.9278 1.5035 4.2744 4.2204 3.6527 3.6530 4.2165 4.4707 2.8516 1.4079 6.2696 4.5828 4.0958 3.8567 4.5634 4.2798 2.6241 3.8597 2.5754 2.5720 2.9936 3.2450 3.9253 4.1964 4.8428 5.2443 4.4444 1.2295 6.0179 6.5406 3.5874 4.4964 4.6323 6.7860 6.8483 4.5381 3.7708 2.3940 1.9296 3.5177 5.7243 4.0113 2.0614 1.6006 4.4347 1.9776 1.7486 4.4851 2.2241 1.4764 2.4313 1.5492 1.6066 1.6055 1.4917 1.7487 4.6931 4.1248 3.5472 1.4831 2.7823 1.6337 2.7370 2.8374 1.9372 2.0911 4.7671 1.9524 1.6707 2.6471 2.2688 2.1461 1.9929 1.7219 1.6878 3.1910 2.5497 3.4947 1.2276 1.3076 3.3547 1.6834 2.8752 1.3898 1.2794 1.5673 2.1290 1.2896 1.4194 1.2755 1.7076 1.3032 2.6036 1.2601 2.1532 2.4245 2.2330 3.4934 1.1350 1.1816 1.2014 1.8114 1.0409 1.0950 3.6673 4.4615 4.3121 4.7857 4.4657 4.9909 5.6406 1.0614 1.0521 1.0371 1.0595 1.0592 1.1006 1.1039 1.1050 1.0974 1.0912 1.0902 1.0887 1.0917 1.0920 1.0920 1.0952 1.0906 1.0922 1.0952 1.0957 1.0490 1.0701 1.0932 1.0828 0.0002 0.0004 0.0018 0.0033 0.0036 0.0099 0.0138 0.0182 0.0333 0.0198 0.0173 0.0684 0.0771 0.0715 0.0958 0.1178 0.1412 0.1059 0.0655 0.2950 0.2429 0.2259 0.2370 0.3282 0.3608 0.2604 0.4311 0.3179 0.3706 0.4468 0.5045 0.6364 0.7389 0.9421 1.1022 0.9725 0.2858 1.5581 1.7701 1.0038 1.3342 1.4155 2.2771 2.3200 1.6036 1.4653 0.9492 0.7787 1.4274 2.4812 1.9799 1.0412 0.8438 2.3992 1.1349 1.0300 2.7347 1.4115 0.9761 1.6147 1.0825 1.1309 1.1405 1.0737 1.2615 3.4465 3.0522 2.7168 1.1424 2.1771 1.2933 2.1788 2.2816 1.6028 1.7434 4.0293 1.6662 1.4266 2.2621 2.0071 2.0386 1.9138 1.6653 1.6386 3.2864 2.6501 3.6572 1.3133 1.4379 3.8139 1.9851 3.4178 1.6679 1.5536 2.0053 2.7647 1.6968 1.9161 1.7835 2.3930 1.8384 3.7740 1.8576 3.1814 3.6016 3.3990 5.4197 1.8011 1.8816 1.9231 2.9180 1.6865 1.8345 6.3076 7.8277 7.7070 8.5661 8.1378 9.1212 10.6109 2.0590 2.1159 6.2678 6.4680 6.5142 6.8503 6.9222 7.0445 7.0332 7.0765 7.1943 7.2359 7.2718 7.2857 7.3507 7.4021 7.3854 7.4154 7.4638 7.4701 7.4226 8.1867 8.5623 9.5795 1.3800 1.8016 0.1328 1.4764 6.3622 2.4867 3.6884 0.7611 1.4263 5.8696 4.8467 3.2310 3.6836 5.1471 7.1943 2.2016 4.0901 9.0040 18.5128 8.2034 16.5304 5.0049 19.1015 1.4888 4.2449 0.3066 1.3551 3.9406 12.2180 18.2585 9.5350 5.0293 2.1642 3.7081 6.3587 0.2912 143.2047 22.5899 12.8014 21.7161 1.6499 11.1337 8.3561 10.1682 0.8649 0.6197 42.9568 23.0828 26.7384 34.2161 34.8077 1.7743 18.7253 27.9038 61.2022 2.6495 24.5146 102.2886 19.4626 8.1240 11.4038 19.7605 8.7524 7.1226 6.3083 22.5627 33.3879 5.2629 3.9391 33.9729 7.1169 22.1284 46.6346 22.7556 26.9721 1.8050 1.1623 2.0164 2.9537 1.2592 1.1486 37.5449 81.5164 54.4429 8.0945 230.5746 180.4696 0.2787 19.1584 24.8906 3.3993 63.7396 21.5210 7.7583 51.0450 10.5647 4.7366 12.0032 8.9913 26.4523 10.2020 31.2914 10.5623 16.9449 93.3258 18.9881 49.5585 77.2800 26.8819 158.7544 17.6047 12.8939 19.0788 14.7925 30.1864 38.8333 5.7144 31.5587 90.5865 43.8756 46.4574 88.9341 12.4028 5.1387 11.0671 14.6516 0.8825 3.4327 4.7955 2.1231 5.7884 6.6205 3.8549 3.8804 1.8806 6.2396 22.9677 1.9547 1.3044 1.9469 281.0566 195.8445 115.6889 187.3119 4.7970 4.9758 2.3654 3.0709 2.7800 4.0055 0.8848 3.4367 1.4253 0.9043 0.7715 2.2433 1.4946 6.9645 1.0609 1.6265 3.3101 2.1819 0.4144 6.3855 7.8872 2.8011 1.3786 2.8524 0.7137 0.7679 0.3836 0.9138 0.5586 2.5639 3.1985 0.2702 0.7646 1.3886 6.1405 2.0098 1.0398 2.6239 1.9259 0.6443 2.2005 1.2904 12.6936 4.9377 2.7582 2.8985 3.6055 0.7147 17.9107 4.5613 2.3868 6.8521 4.2497 13.1066 1.2887 3.7764 1.4495 13.3077 7.0554 11.4969 6.0752 5.6500 6.1727 0.9954 3.0519 27.5833 20.2152 23.8748 3.9943 3.2786 5.9257 31.1224 26.7454 0.8759 5.8599 14.8979 3.0415 0.4273 7.6008 4.0971 2.1991 9.4583 13.2205 22.9423 5.9909 35.0096 22.4459 4.3686 11.5260 37.8530 18.9003 47.6551 10.5051 9.9301 12.9331 74.9246 0.9756 1.3951 11.8421 51.8082 1.2119 8.9731 10.4645 2.7473 10.7017 1.1835 3.4492 5.2023 24.5908 15.3432 3.4062 29.5949 19.6187 47.5685 58.9444 8.9402 23.3081 24.7742 145.0816 68.3400 9.9720 6.4302 112.1943 43.4746 82.3878 58.9535 46.1948 39.2001 104.9784 16.2842 57.5822 49.0217 28.4116 30.3468 104.0030 125.5083 79.6785 29.5900 114.5115 123.3801 88.4144 27.0036 30.0093 171.2363 0.7485 0.7464 0.7359 0.7477 0.6699 0.7189 0.6960 0.7499 0.6680 0.3840 0.6272 0.2479 0.7498 0.5350 0.7238 0.7479 0.7376 0.3462 0.4196 0.4564 0.6126 0.6213 0.3069 0.7453 0.2596 0.3223 0.7484 0.4236 0.6665 0.4889 0.6444 0.7438 0.7115 0.2877 0.2968 0.2797 0.7443 0.4248 0.4534 0.3880 0.5430 0.7314 0.1516 0.3792 0.7499 0.6593 0.1211 0.7454 0.0652 0.4107 0.7424 0.4869 0.5395 0.1421 0.7026 0.2696 0.3706 0.7447 0.1658 0.1717 0.2481 0.5031 0.1085 0.2059 0.4254 0.1378 0.1748 0.1913 0.6288 0.4478 0.3628 0.2561 0.2645 0.7470 0.7322 0.7477 0.7271 0.5769 0.7460 0.7240 0.6195 0.4470 0.5068 0.3783 0.7249 0.4665 0.3640 0.7312 0.7007 0.1695 0.1128 0.2041 0.6189 0.7485 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0.8562 0.3838 0.3616 0.7304 0.7428 0.8522 0.6959 0.7419 0.6856 0.7479 0.3628 0.6373 0.8410 0.7432 0.6292 0.8506 0.5859 0.6145 0.8567 0.7680 0.4590 0.5151 0.8523 0.8350 0.6192 0.6560 0.6058 0.7344 0.8405 0.0356 0.1428 0.1255 0.8570 0.8409 0.8488 0.7312 0.2491 0.6553 0.8090 0.4056 0.4877 0.5357 0.3716 0.6210 0.5239 0.2379 0.3187 0.2631 0.4315 0.8275 0.4166 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 6 6 6 6 6 6 6 6 7 1 7 6 6 6 6 7 6 8 6 6 1 6 6 6 6 6 6 6 53 7 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 14.00307 1.00783 14.00307 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 126.90040 14.00307 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 8340.3668 54433.0893 59631.3103 0.99950 -0.03050 -0.00772 0.03042 0.99949 -0.01018 0.00802 0.00994 0.99992 1 0.01038 0.00159 0.00145 0.21639 0.03316 0.03026 9.52 15.54 33.51 45.50 53.79 85.65 104.56 111.37 152.07 189.75 201.25 237.08 253.38 262.29 303.55 313.36 333.10 361.19 404.33 406.56 431.51 440.21 464.63 502.72 544.27 590.45 626.46 658.56 711.53 724.19 739.05 754.76 786.57 826.76 859.34 876.81 903.78 953.76 975.11 991.52 1021.05 1036.16 1085.81 1090.98 1114.23 1168.45 1180.26 1190.74 1194.02 1234.07 1316.86 1332.13 1360.99 1378.69 1419.97 1438.63 1463.66 1493.22 1524.07 1527.56 1566.85 1572.65 1579.80 1590.28 1592.06 1606.32 1612.40 1640.41 1645.10 1658.07 1667.76 1672.38 1680.86 1704.99 1711.52 1723.27 1731.59 1732.09 1732.77 1763.00 1826.88 1836.90 1843.38 1846.89 1902.26 1910.99 1917.52 1938.71 1965.63 1998.61 2035.44 2043.64 2053.47 2065.49 2120.19 2136.00 2150.13 2177.85 2216.50 2218.95 2226.31 2256.73 2275.79 2278.39 2284.56 2312.59 2334.71 2361.22 2365.43 2371.53 2379.08 2385.88 2426.15 2458.25 2482.81 2505.93 2507.76 2530.32 2533.99 2570.87 2610.69 2658.14 4607.95 4631.21 4648.50 4676.32 4693.79 4732.79 4745.35 4773.38 4815.17 4832.40 4837.75 4841.73 4863.29 4873.14 4877.87 4884.09 4893.24 4894.16 4986.05 5184.59 5245.91 5575.28 0.439287 0.462472 0.463416 0.379801 -8019.410593 -8019.387408 -8019.386464 -8019.470080 2.804494D-04 MUNgauss RevisionA2.1 retrievium 21-May-2021 DUDE Cc1c2cc(ccc2[nH]n1)c3cc(cnc3)OC[C@H](Cc4cccc(c4)I)[NH3+] C14961659 RHF 3-21G (6D,10F) C1 485.079761 |X|Y|Z| 59.470795 32.073594 161.814147 67.580690 25 6 7 8 21 3 1 |36.858105| |12.736223|36.858105| |7.247879|13.204511|36.858105| |5.746753|7.303766|13.723222|36.858105| |4.077073|5.021596|7.993449|13.823632|36.858105| |3.559608|4.580494|6.925252|7.895878|13.497366|36.858105| |3.813369|5.299128|7.835824|6.749941|7.830494|13.914364|36.858105| |5.126933|8.441483|13.623756|7.871366|6.884289|8.051722|13.648941|36.858105| |5.278892|8.808648|8.635052|5.405984|4.652195|5.169902|7.564410|14.059246|53.358707| |4.264813|6.174614|5.985536|4.268724|3.893348|4.469048|6.455545|8.925911|26.119324|0.500000| |7.770996|14.696323|8.460419|5.266307|4.157235|4.166546|5.230801|8.406054|18.584997|0.256054|53.358707| |3.330503|3.747053|5.078638|7.667610|12.842519|7.606351|5.045160|4.482130|4.649680|0.083033|4.325647|36.858105| |2.795067|3.105043|3.983342|5.278454|7.613586|6.174968|4.325068|3.734682|4.029864|0.073975|3.719765|13.762613|36.858105| |2.417232|2.593589|3.157039|3.995659|5.067013|4.322066|3.311654|2.955914|3.332435|0.062130|3.140214|7.982277|13.792460|36.858105| |2.384872|2.496373|2.976585|3.776040|4.509592|3.738910|2.958923|2.724796|3.119002|0.058065|2.997394|6.948586|7.989376|13.849714|36.858105| |2.678232|2.781791|3.341381|4.385531|5.099951|3.984441|3.152053|2.966231|3.369408|0.061967|3.275403|7.990343|6.940479|8.094508|14.329105|53.358707| |3.199826|3.414115|4.324634|6.199532|7.594948|5.232062|3.946411|3.717336|4.061419|0.073150|3.919415|13.653953|8.025075|7.053366|8.286782|19.596377|36.858105| |2.111422|2.257652|2.675825|3.212753|3.908893|3.593434|2.886303|2.572488|2.972055|0.056322|2.793151|5.228287|8.032274|13.641660|7.820819|7.112404|4.649685|73.516695| |1.893357|1.981159|2.280867|2.682254|3.096021|2.843971|2.379842|2.177975|2.577648|0.049160|2.461553|3.941782|5.179854|7.711765|6.511762|6.110654|3.801945|23.516757|36.858105| |1.732404|1.818356|2.067158|2.361867|2.689380|2.558018|2.196914|2.008737|2.410612|0.046457|2.293137|3.219658|4.127040|5.200157|4.342048|4.554468|3.011458|14.529737|12.475058|36.858105| |1.799464|1.888771|2.143837|2.441919|2.757397|2.616970|2.260952|2.078938|2.497366|0.048054|2.379902|3.244139|4.175251|4.961907|4.035371|4.357684|2.964060|13.055026|8.895065|17.667499|0.500000| |1.538832|1.596775|1.781994|2.003815|2.226453|2.126220|1.868231|1.731756|2.112346|0.040961|2.026446|2.599008|3.135796|3.806744|3.474863|3.814331|2.509045|9.045469|7.367717|12.433604|0.243153|36.858105| |1.424790|1.483259|1.641844|1.812923|2.000452|1.949222|1.742748|1.615164|1.990302|0.038907|1.903453|2.264154|2.688719|3.085690|2.789391|3.181545|2.155247|7.028469|4.874225|7.565213|0.189147|12.530895|36.858105| |1.320942|1.379282|1.521844|1.665217|1.838453|1.815930|1.636148|1.510715|1.871427|0.036805|1.783143|2.058284|2.405648|2.720877|2.494158|2.891873|1.968662|6.010961|3.969243|5.436302|0.133347|7.536893|13.744537|36.858105| |1.238668|1.294232|1.417615|1.532253|1.678673|1.674796|1.529879|1.416716|1.770232|0.035017|1.685853|1.843388|2.123901|2.333457|2.140377|2.536076|1.754172|4.999649|3.144329|4.082821|0.107194|5.013269|7.935740|13.756684|36.858105| |1.239894|1.293464|1.409954|1.515733|1.647950|1.644021|1.512864|1.408857|1.768341|0.035015|1.688052|1.790639|2.056848|2.222503|2.024829|2.419657|1.691354|4.715648|2.915315|3.781137|0.105545|4.432961|6.858971|7.936429|13.780554|36.858105| |1.324070|1.377479|1.503102|1.623808|1.760676|1.740025|1.595141|1.491734|1.866813|0.036795|1.788335|1.920231|2.224137|2.406948|2.172348|2.580558|1.804413|5.157934|3.220865|4.317327|0.127450|5.020894|7.921176|6.878948|7.958777|13.759918|36.858105| |1.425612|1.480897|1.628465|1.783947|1.946818|1.898950|1.715909|1.602020|1.985911|0.038871|1.905117|2.165783|2.552722|2.837569|2.543765|2.956922|2.039488|6.287135|4.123842|6.025747|0.180146|7.563493|13.710323|7.950613|6.897930|7.953462|13.790322|36.858105| |1.293914|1.339685|1.443303|1.538296|1.639163|1.621653|1.512293|1.432596|1.814148|0.035874|1.748617|1.748213|1.985448|2.083629|1.889755|2.298841|1.635677|4.289780|2.578060|3.199961|0.098556|3.423647|4.349926|3.887693|4.356566|6.207702|8.940299|6.219227|6874.357145| |1.690077|1.803844|2.066031|2.331224|2.711848|2.682476|2.301650|2.055819|2.461127|0.047814|2.302741|3.183217|4.113266|4.890340|3.949288|4.258153|2.900483|13.370720|7.828768|12.353530|0.253031|7.558900|6.530356|5.604537|4.332016|3.879498|4.146938|5.214396|238.204938|53.358707| |1.832693|1.978315|2.303713|2.627892|3.141380|3.128624|2.622386|2.302030|2.715205|0.052521|2.516843|3.747810|5.105080|6.019758|4.489891|4.777247|3.304808|17.660344|7.897192|9.256813|0.220484|5.676477|4.891001|4.310755|3.546469|3.273847|3.504519|4.231743|215.075085|25.299854|0.500000| |1.598760|1.702510|1.940781|2.179923|2.526648|2.510399|2.166117|1.935986|2.329010|0.045405|2.180541|2.959984|3.701822|4.435521|3.780010|4.111704|2.764296|11.191495|6.871142|8.938067|0.179626|7.141364|6.188134|5.948578|4.456818|3.770261|3.826456|4.647308|218.088435|25.528476|0.317886|0.500000| |1.618046|1.728965|1.963896|2.180830|2.506423|2.516669|2.201130|1.971292|2.382479|0.046582|2.225865|2.850107|3.589482|4.024771|3.310329|3.704663|2.578245|10.021803|5.731777|8.946591|0.227414|6.719727|7.088914|6.205113|5.005240|4.571790|4.888701|5.980433|270.840485|25.530174|0.312565|0.321294|0.500000| |17.563579|8.921758|6.446692|5.673186|4.051235|3.452101|3.581600|4.601054|6.177276|0.104227|8.216355|3.400680|2.796224|2.449539|2.472879|3.870044|3.409260|3.759013|1.905181|1.723478|0.049303|1.536012|1.412759|1.312092|1.225454|1.220173|1.299384|1.403652|98.306608|2.281379|0.050426|0.044304|0.044292|0.500000| |17.625866|8.991527|5.468080|4.387067|3.356628|3.055606|3.336394|4.379207|6.628327|0.114657|10.135441|2.810236|2.423221|2.128815|2.100652|3.167939|2.712356|3.362451|1.713586|1.584722|0.045704|1.420918|1.325719|1.234614|1.164352|1.168258|1.244114|1.330591|95.511769|2.110427|0.046395|0.040873|0.041478|0.300778|0.500000| |17.562779|8.919535|6.449025|5.681408|4.056618|3.454132|3.581667|4.600342|6.173096|0.104097|8.206129|3.405695|2.902055|2.517809|2.472435|3.742428|3.251485|3.920320|1.984921|1.817490|0.052881|1.611015|1.488409|1.369603|1.282464|1.289101|1.386172|1.497743|106.222010|2.386020|0.052698|0.045765|0.046645|0.300680|0.300712|0.500000| |6.069734|6.478256|8.894941|17.764430|8.929772|5.617690|4.891448|5.613721|5.964922|0.099396|6.254771|7.058864|4.958034|3.975775|3.924475|6.408454|6.579156|5.636043|2.710515|2.357338|0.067704|2.015819|1.807887|1.650849|1.513466|1.497912|1.611536|1.779868|119.283266|3.094025|0.070344|0.059116|0.058824|0.176350|0.125429|0.177259|0.500000| |2.968488|3.643243|4.983320|5.646723|8.883572|17.764654|9.026040|5.700065|5.635583|0.104699|4.638503|7.089737|6.597688|4.651057|3.889379|5.413680|4.959557|7.014165|3.045098|2.748989|0.077210|2.260238|2.074012|1.944673|1.787443|1.741254|1.831223|2.000282|131.254562|4.047701|0.098334|0.077589|0.077103|0.080777|0.072424|0.080735|0.124054|0.500000| |3.244775|4.319338|5.591680|4.893779|5.595207|8.953618|17.794777|8.833555|9.031113|0.179730|6.189562|4.112927|3.739030|2.970032|2.651736|3.769956|3.333524|4.747801|2.223943|2.088634|0.059528|1.789873|1.689764|1.601513|1.508854|1.492112|1.561930|1.664616|115.717963|3.028576|0.070093|0.058499|0.059712|0.084812|0.081607|0.084746|0.106579|0.216729|0.500000| |2.720115|3.078473|3.941046|4.928866|6.974951|6.504091|4.614450|3.856996|4.162166|0.077107|3.765117|8.897251|17.802284|8.961672|5.682389|6.797683|5.671444|13.173692|4.812683|4.175430|0.121581|3.130269|2.761237|2.468471|2.203065|2.155450|2.340677|2.665138|164.243077|5.905815|0.153753|0.105321|0.108134|0.073930|0.066139|0.078616|0.123774|0.201278|0.112806|0.500000| |2.133291|2.203107|2.558945|3.133908|3.599762|3.099717|2.541529|2.363882|2.764737|0.051975|2.675293|5.000134|5.654234|8.875427|17.816078|12.664416|5.869528|12.450373|7.131045|4.539451|0.112623|3.780885|2.941406|2.629973|2.223696|2.079678|2.222686|2.626978|148.631556|5.413779|0.119979|0.108698|0.091731|0.061526|0.052872|0.061437|0.090970|0.089804|0.064383|0.124290|0.500000| |3.515063|3.694465|4.610302|6.540826|6.990257|4.902948|3.904188|3.836287|4.235949|0.075654|4.169746|8.887593|5.682682|5.054138|5.863177|12.675391|17.818695|6.556284|3.149822|2.579378|0.070763|2.207452|1.924962|1.774845|1.597561|1.544846|1.640053|1.832850|117.308362|3.398345|0.077633|0.066715|0.062623|0.107940|0.081932|0.097016|0.201665|0.124088|0.091140|0.124164|0.129382|0.500000| |1.788302|1.866957|2.137703|2.496805|2.872015|2.660744|2.240224|2.049530|2.438498|0.046686|2.329372|3.635472|4.535316|6.613638|6.396218|6.059713|3.651195|16.234507|17.606187|8.787058|0.173694|6.851734|4.572525|3.949788|3.093262|2.785682|2.978549|3.716593|184.509765|9.344948|0.185833|0.195255|0.141265|0.050393|0.045137|0.051605|0.070082|0.079598|0.058525|0.114674|0.217359|0.085213|0.500000| |1.950878|2.010946|2.294991|2.716749|3.054003|2.730815|2.304686|2.151730|2.557744|0.048528|2.475749|3.885311|4.886840|7.020841|6.565789|6.305737|3.856304|16.177404|17.628227|8.849750|0.217021|6.478398|4.395822|3.534087|2.867288|2.719940|3.057611|3.908659|197.361662|7.662939|0.156675|0.139487|0.126874|0.054668|0.048940|0.057383|0.078006|0.079123|0.059264|0.123463|0.205546|0.089305|0.299481|0.500000| |1.486445|1.541632|1.719482|1.933167|2.152038|2.059173|1.808298|1.673301|2.042690|0.039665|1.958698|2.523192|2.999008|3.685972|3.487545|3.829708|2.481257|8.488701|6.881811|8.835559|0.172871|17.562110|8.854045|7.261278|4.759594|3.976290|4.186255|5.599269|230.060167|9.195728|0.145452|0.205935|0.160309|0.041468|0.038164|0.042955|0.054021|0.061078|0.048235|0.081659|0.108565|0.060889|0.209741|0.163644|0.500000| |1.544666|1.586260|1.757404|1.979207|2.165840|2.038918|1.800210|1.689921|2.069344|0.040010|2.003724|2.524788|2.991782|3.617053|3.400951|3.777911|2.470680|8.162369|6.662352|8.941317|0.213596|17.568867|8.849738|5.779137|4.261737|3.977626|4.660968|6.919681|264.560844|7.524939|0.127198|0.143424|0.140381|0.042886|0.039637|0.045187|0.055973|0.059341|0.047622|0.081959|0.103902|0.060728|0.168644|0.188920|0.302752|0.500000| |1.304453|1.362452|1.505823|1.651618|1.830037|1.807724|1.623276|1.495039|1.849179|0.036365|1.760426|2.061843|2.396956|2.742931|2.554537|2.955777|1.993162|6.008616|3.995488|5.131622|0.119903|6.971795|8.907360|17.745176|8.941473|5.654615|4.957810|5.648365|248.856497|7.424322|0.118148|0.176910|0.155838|0.036166|0.033845|0.037409|0.045484|0.054012|0.044157|0.067438|0.075802|0.049950|0.116223|0.097297|0.221880|0.148217|0.500000| 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