Version2.4 2021-04-30T05:36:57Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 29-Oct-2018 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC[C@@H]1CCCC[C@@H]1Oc2c(c(cc(n2)C)C)C[NH3+] C40509637 RHF 6-31G(d) (6D,7F) CC[C@@H]1CCCC[C@@H]1Oc2c(c(cc(n2)C)C)C[NH3+] C01[X(C16H27N2O1)] 132 C1 339 CC[C@@H]1CCCC[C@@H]1Oc1nc(C)cc(c1C[NH3+])C CC[C@@H]1CCCC[C@@H]1Oc1nc(C)cc(c1C[NH3+])C CC[C@@H]1CCCC[C@@H]1Oc2nc(C)cc(C)c2C[NH3+] InChIKey=PTVFYLWVTFPLDN-HIFRSBDPSA-O InChI=1S/C16H26N2O/c1-4-13-7-5-6-8-15(13)19-16-14(10-17)11(2)9-12(3)18-16/h9,13,15H,4-8,10,17H2,1-3H3/p+1/t13-,15+/m1/s1 InChI=1/C16H26N2O/c1-4-13-7-5-6-8-15(13)19-16-14(10-17)11(2)9-12(3)18-16/h9,13,15H,4-8,10,17H2,1-3H3/p+1/t13-,15+/m1/s1/fC16H27N2O/h17H/q+1 CC[C@@H]1CCCC[C@@H]1Oc2c(c(cc(n2)C)C)C[NH3+] C01[X(C16H27N2O1)] 132 C01 339 CC[C@@H]1CCCC[C@@H]1Oc1nc(C)cc(c1C[NH3+])C CC[C@@H]1CCCC[C@@H]1O[C]1[N][C]([CH][C]([C]1C[NH3])C)C CC[C@@H]1CCCC[C@@H]1O[C]2[N][C](C)[CH][C](C)[C]2C[NH3] InChIKey=VHZCVHUFJKRCJN-HIFRSBDPSA-N InChI=1S/C16H27N2O/c1-4-13-7-5-6-8-15(13)19-16-14(10-17)11(2)9-12(3)18-16/h9,13,15H,4-8,10H2,1-3,17H3/t13-,15+/m1/s1 InChI=1/C16H27N2O/c1-4-13-7-5-6-8-15(13)19-16-14(10-17)11(2)9-12(3)18-16/h9,13,15H,4-8,10H2,1-3,17H3/t13-,15+/m1/s1 1569.5038500321 -805.2029388 1-A 5772.1599 72 267 339 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.72349 -15.85704 -15.67090 -11.46645 -11.45599 -11.40274 -11.39646 -11.39245 -11.37001 -11.35115 -11.33722 -11.32913 -11.32306 -11.32277 -11.31960 -11.31796 -11.31576 -11.31555 -11.29668 -1.55725 -1.48185 -1.38459 -1.25283 -1.23353 -1.18411 -1.15467 -1.13443 -1.11850 -1.08666 -1.07704 -1.04379 -0.97845 -0.96781 -0.96020 -0.94395 -0.93073 -0.91552 -0.89552 -0.86677 -0.83499 -0.81608 -0.80868 -0.77885 -0.76839 -0.75196 -0.73913 -0.71686 -0.71335 -0.70857 -0.69923 -0.69635 -0.68484 -0.67976 -0.67583 -0.66606 -0.66277 -0.64544 -0.64021 -0.63153 -0.62879 -0.62597 -0.60351 -0.59359 -0.59226 -0.57612 -0.56901 -0.56395 -0.53572 -0.52949 -0.52635 -0.49606 -0.44242 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -0.01709 0.02008 0.04071 0.08323 0.09397 0.09866 0.12869 0.13551 0.15127 0.15838 0.16515 0.17181 0.17662 0.18338 0.18660 0.19371 0.20568 0.20849 0.21160 0.21193 0.22560 0.22784 0.23343 0.23817 0.24527 0.24739 0.25564 0.25820 0.26282 0.26820 0.28007 0.29154 0.29586 0.30451 0.30816 0.31505 0.32117 0.33598 0.33973 0.36238 0.36958 0.37611 0.38015 0.39076 0.40837 0.43603 0.43924 0.45497 0.53457 0.55968 0.56845 0.57909 0.59089 0.60750 0.61113 0.61837 0.62454 0.63032 0.63734 0.63860 0.65104 0.65929 0.67015 0.67226 0.68560 0.69312 0.70039 0.70403 0.73624 0.74828 0.75663 0.76017 0.78131 0.79151 0.80551 0.81385 0.83249 0.83505 0.84169 0.84894 0.85679 0.86642 0.87201 0.87829 0.88932 0.89312 0.89988 0.91332 0.92969 0.93797 0.94222 0.95135 0.95287 0.98429 0.99019 0.99677 1.01058 1.01757 1.02451 1.03027 1.03599 1.04140 1.05786 1.06274 1.06624 1.07690 1.07798 1.07911 1.08593 1.09013 1.09516 1.10463 1.11015 1.11667 1.12120 1.12642 1.14172 1.14474 1.15021 1.16006 1.16315 1.17214 1.18175 1.18949 1.19506 1.22019 1.23763 1.24079 1.25698 1.26919 1.27179 1.31409 1.33242 1.34158 1.36748 1.37732 1.38868 1.42423 1.45395 1.46271 1.47115 1.49133 1.51403 1.52824 1.53714 1.55337 1.57205 1.61217 1.61943 1.64821 1.66107 1.67429 1.69003 1.71704 1.72771 1.73855 1.78431 1.80433 1.83217 1.84984 1.85554 1.87246 1.89658 1.90560 1.93348 1.96453 1.97248 1.98075 1.99263 2.00851 2.01495 2.03010 2.04970 2.05472 2.06988 2.07684 2.10006 2.10843 2.11996 2.12315 2.13075 2.14759 2.16097 2.16595 2.16992 2.18342 2.19654 2.20951 2.22536 2.22699 2.25024 2.26265 2.28560 2.30212 2.31354 2.36681 2.37837 2.39680 2.40758 2.41171 2.42227 2.44276 2.46569 2.47526 2.48240 2.48364 2.52666 2.53489 2.54106 2.54892 2.55092 2.56039 2.56467 2.57642 2.58730 2.59019 2.61661 2.62613 2.63678 2.65076 2.65587 2.66530 2.67959 2.70100 2.72552 2.74338 2.78403 2.81381 2.83839 2.86352 2.87997 2.89862 2.93002 2.94672 2.97976 2.99179 2.99775 3.02403 3.05362 3.06830 3.08433 3.12231 3.13034 3.19157 3.30079 3.31603 3.57147 3.76494 4.07997 4.38195 4.39532 4.45646 4.49444 4.52954 4.54897 4.57563 4.62471 4.65474 4.68047 4.74995 4.78289 4.79730 4.89116 4.90395 4.97775 5.03289 5.04503 11.57372 3.2935 -7.4928 -3.8653 9.0515 |XX|YY|ZZ|XY|XZ|YZ| -84.4403 -81.9433 -105.3872 -5.5246 -0.0281 12.0496 |XX|YY|ZZ|XY|XZ|YZ| 6.1500 8.6469 -14.7969 -5.5246 -0.0281 12.0496 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808.8968 822.7810 858.0234 875.9489 885.8953 911.3520 919.6352 948.8649 953.2170 957.8618 991.4777 997.0351 1010.1819 1057.8479 1078.3723 1086.8156 1104.0847 1109.3035 1124.1185 1127.7592 1160.1448 1163.7722 1172.7647 1175.9100 1184.4911 1191.7901 1220.3090 1229.5920 1262.0809 1284.6968 1286.4843 1297.5248 1339.2279 1369.8320 1375.8315 1399.3347 1415.1414 1446.1868 1463.1879 1473.6997 1481.7691 1490.8673 1503.6624 1515.7762 1528.6742 1532.7613 1536.3814 1544.3249 1553.5408 1562.4419 1568.3973 1572.2934 1574.9638 1619.2991 1620.4163 1631.0557 1631.2210 1634.4809 1635.5923 1636.7229 1639.2789 1645.9272 1647.0400 1650.7677 1652.1167 1653.8498 1657.3832 1769.5025 1806.5897 1812.9689 1846.8469 3143.7726 3153.5564 3186.0662 3195.1873 3206.2737 3211.1237 3212.7023 3219.8205 3223.1117 3224.4408 3247.1776 3254.7163 3265.1860 3268.3076 3275.1261 3277.4185 3282.0161 3288.3511 3293.3894 3313.2706 3318.3339 3330.5197 3366.6325 3401.7321 3597.1161 3706.4257 3750.9307 3.7201 3.6642 2.1729 2.3516 1.3440 2.1213 1.9980 2.5364 1.7226 2.1826 2.6393 2.7572 1.4838 2.3244 3.0613 2.7230 1.4185 2.6239 2.8733 1.7189 2.2927 2.7950 4.1037 2.7689 2.6015 2.6867 3.3098 4.0104 3.1150 3.3339 4.0024 3.1327 3.3978 3.4126 2.4082 2.1548 1.7928 3.9169 2.1421 2.2681 1.4518 2.7551 2.0888 1.3703 1.4876 1.9879 2.7248 3.8510 2.0634 1.9474 1.7055 1.5843 1.8320 1.6653 1.7246 1.5684 1.6246 1.5785 1.6450 1.9409 1.6808 2.1532 2.0150 1.6470 3.0981 3.3757 1.4855 1.6721 1.3407 1.1802 1.2155 1.1912 1.4875 1.2726 2.0099 1.5516 1.5719 1.4398 1.4701 1.9449 1.5640 1.3910 1.6623 1.3760 1.3525 1.3754 1.6821 1.0479 1.3163 1.0969 1.0908 1.0644 1.1167 1.0998 1.0980 1.0616 1.1187 1.8518 1.1273 1.1176 1.2304 6.4194 5.6429 1.0995 1.0537 1.0751 1.0754 1.0798 1.0647 1.0640 1.0386 1.0410 1.0703 1.1008 1.0370 1.1020 1.0898 1.0918 1.1022 1.1026 1.0983 1.1000 1.1022 1.0642 1.1045 1.0998 1.0884 1.1077 1.0936 1.0405 1.0861 1.0957 0.0018 0.0035 0.0060 0.0091 0.0066 0.0111 0.0185 0.0252 0.0204 0.0272 0.0528 0.0797 0.0507 0.0804 0.1168 0.1206 0.0684 0.1534 0.1819 0.1205 0.1745 0.2263 0.4416 0.3111 0.3359 0.4574 0.5715 0.7839 0.6243 0.7067 0.9512 0.8419 0.9970 1.1410 0.9284 0.8594 0.7776 1.7707 0.9905 1.1099 0.7234 1.4615 1.1182 0.7408 0.8616 1.1643 1.6382 2.5390 1.4137 1.3552 1.2249 1.1486 1.3640 1.2479 1.3676 1.2515 1.3165 1.2860 1.3598 1.6242 1.4747 1.9180 1.8910 1.6015 3.0210 3.3485 1.5697 1.8486 1.4952 1.3616 1.4342 1.4678 1.8764 1.6284 2.6000 2.0320 2.0939 1.9491 2.0241 2.6921 2.1751 1.9546 2.3638 1.9791 1.9602 2.0033 2.4584 1.6188 2.0364 1.7193 1.7101 1.6754 1.7601 1.7358 1.7385 1.6945 1.7880 2.9732 1.8129 1.8010 1.9914 11.8426 10.8511 2.1292 2.1175 6.2601 6.3011 6.4579 6.4043 6.4443 6.3096 6.3308 6.5378 6.7376 6.3525 6.8462 6.8020 6.8582 6.9369 6.9684 6.9509 6.9810 7.0224 6.8007 7.1437 7.1353 7.1132 7.3972 7.4561 7.9325 8.7910 9.0824 3.0691 0.9231 2.2838 7.5903 0.2660 6.0532 9.3032 5.5925 0.0887 5.9233 2.7729 1.2440 0.1408 4.2150 14.0945 0.4914 1.4721 0.5093 2.1210 0.4302 4.2211 0.4752 10.8812 0.3741 1.6160 1.7491 4.8424 1.5602 1.7736 3.8766 0.8885 5.8395 2.8680 11.8380 3.3972 10.1725 3.3552 20.0275 9.8719 5.8177 9.9584 39.5162 10.5715 10.4368 2.0731 1.1054 18.7290 29.3863 16.3407 50.1049 42.2028 4.4469 4.6327 7.9159 25.5469 5.6724 5.5612 1.7306 24.1140 1.2012 1.8780 71.0010 27.9992 11.7997 35.9075 100.8065 23.6613 1.5119 6.6853 0.5642 2.5437 15.3279 8.7636 10.8245 174.6503 3.3959 32.1397 36.8569 12.7017 46.3951 17.0796 64.7927 2.0643 14.6637 16.4651 21.5358 107.2082 7.6532 12.0841 18.3012 19.5016 6.5999 82.8057 16.5362 5.4224 20.5409 35.0161 31.7340 9.9886 16.3963 102.2552 292.9392 320.9593 19.3610 22.7429 18.1150 119.4904 2.9308 67.9934 35.6769 19.4256 15.0078 10.5914 37.2090 9.4120 56.6874 52.5798 49.1658 16.1759 41.3863 39.0524 49.5711 8.4007 7.2380 16.7948 9.6610 11.2184 3.8103 3.3046 124.0628 211.0693 89.5002 1.9080 2.0448 0.1000 0.2336 0.0742 0.0768 0.0842 0.4212 0.3170 0.5370 0.1432 1.2860 0.2470 0.7322 1.3179 0.6667 0.5888 0.0687 0.2971 0.4863 2.1824 1.9163 3.7874 1.1474 0.9091 1.1780 2.3014 2.8269 16.6353 2.4652 1.5775 1.6261 0.3278 1.0304 1.6126 9.3349 7.8192 2.6050 6.4392 0.5993 1.3026 6.5132 1.6709 0.4776 0.3034 2.3555 3.6240 3.1654 7.5097 2.4618 2.2561 8.5807 13.5789 2.7288 3.5603 1.1001 0.2994 1.4626 5.3733 3.4703 2.3562 4.6916 1.6759 4.7131 4.8593 6.4339 5.2411 1.9627 1.5823 24.0804 11.1934 10.6128 8.3129 2.4254 3.5518 3.2809 3.4864 5.4190 2.8737 4.3365 1.1181 4.9266 3.3657 11.0751 9.0962 7.7525 6.6464 17.6103 6.6692 9.9448 20.7030 14.0880 23.4112 13.4675 3.8959 14.4069 6.8471 0.7971 4.0541 3.4519 3.8909 12.6715 34.7266 11.6709 5.2664 18.1669 136.9396 50.9981 38.0863 69.9567 96.1919 127.0479 89.7361 51.6201 162.8738 93.7620 127.6148 107.7364 72.0371 69.0999 74.4881 64.5104 79.8950 93.4821 65.3933 60.2596 47.3662 51.2901 97.2777 66.3439 54.5571 57.3253 0.7499 0.7500 0.7477 0.7396 0.7388 0.7065 0.3421 0.7452 0.6247 0.6672 0.4268 0.7025 0.2708 0.1893 0.6940 0.4083 0.1514 0.6118 0.7467 0.3183 0.2630 0.2659 0.3751 0.6863 0.2880 0.7353 0.7419 0.5721 0.0656 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0.5080 0.6177 0.8554 0.2484 0.1428 0.8124 0.6356 0.5933 0.1136 0.8248 0.7967 0.8175 0.8213 0.6323 0.7374 0.6376 0.7133 0.8297 0.1952 0.8340 0.7176 0.7805 0.4929 0.8435 0.8556 0.4656 0.8560 0.5535 0.6586 0.8335 0.8570 0.8514 0.5613 0.8567 0.2266 0.8467 0.8425 0.8412 0.8571 0.6292 0.6534 0.8447 0.7627 0.7401 0.7351 0.5897 0.2326 0.8571 0.8533 0.8418 0.8499 0.8359 0.8517 0.8528 0.8514 0.8540 0.8435 0.6362 0.8375 0.8180 0.8538 0.8422 0.7422 0.8275 0.7711 0.4977 0.4590 0.5423 0.2870 0.3675 0.0477 0.0528 0.5115 0.7317 0.0499 0.6552 0.4848 0.2682 0.8403 0.7781 0.6466 0.7979 0.8571 0.1495 0.8553 0.7863 0.2684 0.7794 0.4560 0.0902 0.5505 0.7975 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 6 6 6 1 6 6 6 6 6 1 8 6 6 6 6 6 7 6 6 6 7 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 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 1.00783 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 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 1.00783 1.00783 1.00783 1.00783 1.00783 3331.06572 7559.39549 8206.81310 0.99999 -0.00027 -0.00531 0.00027 1.00000 -0.00059 0.00531 0.00059 0.99999 1 0.02600 0.01146 0.01055 0.54179 0.23874 0.21991 41.51 57.61 98.13 116.55 131.53 135.76 180.21 186.98 204.14 209.07 265.15 318.69 346.65 348.72 366.14 394.46 411.62 453.20 471.66 496.20 517.14 533.36 614.90 628.28 673.51 773.37 778.89 828.70 839.17 863.02 913.77 971.72 1015.34 1083.85 1163.82 1183.80 1234.50 1260.30 1274.61 1311.23 1323.15 1365.20 1371.47 1378.15 1426.52 1434.51 1453.43 1522.01 1551.54 1563.69 1588.53 1596.04 1617.36 1622.59 1669.19 1674.41 1687.35 1691.87 1704.22 1714.72 1755.75 1769.11 1815.85 1848.39 1850.96 1866.85 1926.85 1970.88 1979.51 2013.33 2036.07 2080.74 2105.20 2120.33 2131.94 2145.03 2163.43 2180.86 2199.42 2205.30 2210.51 2221.94 2235.20 2248.01 2256.57 2262.18 2266.02 2329.81 2331.42 2346.73 2346.96 2351.65 2353.25 2354.88 2358.56 2368.12 2369.72 2375.09 2377.03 2379.52 2384.60 2545.92 2599.28 2608.46 2657.20 4523.19 4537.26 4584.04 4597.16 4613.11 4620.09 4622.36 4632.60 4637.34 4639.25 4671.96 4682.81 4697.87 4702.37 4712.18 4715.47 4722.09 4731.20 4738.45 4767.06 4774.34 4791.88 4843.83 4894.33 5175.45 5332.72 5396.75 0.447019 0.466023 0.466967 0.399459 -804.755920 -804.736916 -804.735972 -804.803479 2.264196D-04 MUNgauss RevisionA2.1 retrievium 30-Apr-2021 DUDE CC[C@@H]1CCCC[C@@H]1Oc2c(c(cc(n2)C)C)C[NH3+] C40509637 RHF 6-31G(d) (6D,10F) C1 263.212339 |X|Y|Z| 60.218113 35.389151 29.890627 39.937184 13 6 7 8 11 1 1 |36.858105| |12.451479|36.858105| |7.396839|12.397870|36.858105| |7.025682|8.930209|17.487673|0.500000| |5.954722|7.409871|12.397518|0.248357|36.858105| |4.157816|4.847231|7.476948|0.191817|12.437124|36.858105| |3.499440|4.308452|6.392937|0.160280|7.517677|12.454135|36.858105| |3.732603|4.871129|7.486214|0.193169|6.450879|7.537328|12.446550|36.858105| |4.873883|7.484156|12.436394|0.253230|7.514628|6.434730|7.490714|12.491296|36.858105| |4.655704|6.908558|8.849242|0.220325|5.496165|4.848162|5.489196|8.867105|17.678056|0.500000| |4.333290|6.564946|7.909451|0.159704|6.364658|5.308524|6.295749|7.818063|13.086724|0.258556|73.516695| |3.521270|4.906071|5.261989|0.119639|4.396945|3.945511|4.753862|5.926279|7.834358|0.209550|25.276803|36.858105| |3.120158|4.100149|4.109798|0.095086|3.723892|3.334035|3.843709|4.278658|5.174791|0.136825|14.595568|13.563189|36.858105| |2.606564|3.254645|3.228845|0.078256|2.940862|2.719604|3.119086|3.472593|3.953353|0.110197|9.448292|7.971794|13.687769|36.858105| |2.451038|3.029754|3.056611|0.076308|2.714631|2.568208|2.986843|3.465716|3.840329|0.112646|8.414231|7.092256|7.997143|13.692042|36.858105| |2.656418|3.351725|3.488570|0.088088|2.977982|2.844797|3.386774|4.210415|4.670685|0.144813|9.680989|8.417476|6.978562|7.930551|13.776438|36.858105| |3.167093|4.222129|4.589272|0.112445|3.740668|3.523077|4.308324|5.801803|6.936889|0.220038|14.804697|14.659882|7.962657|6.841278|8.019940|14.285023|53.358707| |2.367628|2.875039|3.009656|0.079390|2.576716|2.520408|2.965320|3.693208|3.876304|0.123681|7.217469|5.276445|4.502530|5.018291|7.544944|12.680096|10.774853|36.858105| |2.283618|2.733714|2.663676|0.065480|2.509953|2.330581|2.596549|2.769385|3.072966|0.084697|6.958870|5.005042|7.480552|12.604525|7.587109|5.034534|6.036531|3.783570|36.858105| |3.271605|4.203177|4.077763|0.092419|3.968054|3.421498|3.728416|3.822781|4.600465|0.115311|12.530622|7.625977|12.704511|7.466564|5.021924|4.510537|6.963799|3.329475|6.264887|36.858105| |3.186387|4.008117|4.236474|0.095471|4.557986|4.077067|4.512080|4.207492|4.702889|0.110410|12.328406|6.328497|7.709877|5.289970|4.040077|3.850132|6.113478|2.981575|4.607221|12.545599|53.358707| |3.141552|3.790808|3.913494|0.089329|4.423651|3.906508|4.062490|3.661740|4.048576|0.095930|9.659893|4.837768|5.660615|4.272596|3.371973|3.213104|4.987676|2.581297|3.977300|8.977378|25.675925|0.500000| |3.573678|4.672576|5.292376|0.114719|5.838576|5.152283|5.854066|5.320520|6.021961|0.131988|16.749347|7.174943|7.239513|4.858706|3.945997|3.994023|6.751031|3.108573|4.010173|9.229333|25.551313|0.321361|0.500000| |2.762072|3.389144|3.660169|0.085364|3.920358|3.745720|4.333215|3.997953|4.182172|0.100263|10.313608|5.750205|7.049243|5.337852|4.118915|3.851852|5.899378|3.003952|4.760691|9.037510|25.685825|0.323193|0.322927|0.500000| |17.549108|8.772532|6.752189|0.210389|5.328053|4.022114|3.385403|3.676035|4.603466|0.126324|6.872954|3.209463|2.801099|2.389791|2.299572|2.529649|4.080576|2.312425|2.092052|2.851371|3.815696|0.076146|0.087341|0.069057|0.500000| |17.567257|8.718420|6.594900|0.170930|6.449183|4.390176|3.512912|3.535444|4.376341|0.111173|7.125612|3.233926|2.934306|2.450081|2.276779|2.432055|3.908571|2.165396|2.180715|3.176110|4.365700|0.090267|0.099781|0.077062|0.301700|0.500000| |17.564390|8.809882|5.434465|0.142926|4.559457|3.393222|2.970632|3.175222|4.067704|0.111769|6.786750|3.259455|2.980158|2.538676|2.382134|2.540051|4.016539|2.272424|2.260271|3.141558|4.032006|0.081663|0.089502|0.071606|0.302202|0.302773|0.500000| |8.901880|17.520661|8.870227|0.209854|5.466424|4.063166|3.860573|4.644984|7.213408|0.219294|11.156077|5.142225|4.191924|3.411717|3.264484|3.691759|6.333973|3.189662|2.819521|4.040585|4.987639|0.094264|0.115547|0.088004|0.210502|0.172984|0.216498|0.500000| |8.859935|17.516935|8.819444|0.174412|6.876420|4.528822|4.126943|4.454152|6.587541|0.162978|12.617719|5.302149|4.704222|3.601602|3.209823|3.425385|5.796013|2.847736|3.047406|5.179952|6.505747|0.126821|0.152386|0.107484|0.172984|0.210759|0.212533|0.304301|0.500000| |5.331112|6.799433|8.814447|0.174233|17.443995|8.817625|6.718596|5.628230|6.692536|0.138196|12.376160|4.736636|4.204058|3.217712|2.866586|3.057806|5.182936|2.577621|2.765390|4.799424|7.976936|0.162355|0.217542|0.132451|0.125825|0.162357|0.120589|0.141753|0.206848|0.500000| |6.652731|6.814054|8.817422|0.214863|17.582497|8.853094|5.496249|4.845285|5.490061|0.123531|8.528099|3.591719|3.161546|2.574360|2.386226|2.582377|4.269009|2.278821|2.253388|3.418256|5.206422|0.107141|0.127623|0.092470|0.165800|0.228474|0.137467|0.138750|0.172827|0.305029|0.500000| |3.635401|4.032593|5.466411|0.140999|8.817451|17.545432|8.809810|5.489463|4.822980|0.106658|7.790463|3.420508|3.031153|2.510791|2.346789|2.537320|4.143522|2.257525|2.204903|3.204495|5.353943|0.108763|0.133452|0.101904|0.096804|0.110280|0.084724|0.094797|0.108997|0.214613|0.212794|0.500000| |4.069993|4.493422|6.740658|0.203770|8.869479|17.521133|8.874762|6.784342|5.672218|0.127519|7.861884|3.451888|2.911589|2.442172|2.357093|2.637833|4.381822|2.405176|2.105671|2.924713|4.539543|0.089037|0.112125|0.086374|0.115410|0.118046|0.091879|0.107492|0.111457|0.173630|0.216247|0.304123|0.500000| |3.292645|4.092163|5.584758|0.132218|6.718226|8.831884|17.455765|8.818258|6.666092|0.137906|12.186411|5.220071|4.386600|3.470318|3.216166|3.539545|6.067582|2.996990|2.888983|4.364932|7.830626|0.139897|0.218392|0.156665|0.086027|0.092558|0.079309|0.101872|0.115184|0.195806|0.138663|0.214765|0.173789|0.500000| |2.975518|3.497798|4.812209|0.129126|5.483155|8.811839|17.562882|8.846651|5.486080|0.123667|8.451788|3.933279|3.290750|2.785750|2.719064|3.067851|5.088137|2.777688|2.363505|3.166330|5.142578|0.096188|0.127924|0.104753|0.081568|0.083291|0.071478|0.089311|0.092961|0.138322|0.123397|0.210954|0.215516|0.304950|0.500000| |3.177398|4.064635|5.484518|0.142230|4.838488|5.482220|8.768428|17.584254|8.876894|0.213730|12.747777|6.387552|4.535144|3.791383|3.918802|4.944518|9.341242|4.347188|2.959279|3.823343|5.630331|0.097775|0.139970|0.113770|0.086665|0.083362|0.077616|0.112159|0.106900|0.126037|0.106721|0.122896|0.139204|0.213420|0.210894|0.500000| |3.659083|4.523949|6.770518|0.206299|5.678226|6.791452|8.865856|17.527437|8.987083|0.219197|10.100414|4.645860|3.517924|2.978041|3.039563|3.695211|6.557089|3.437359|2.431804|3.178912|4.641982|0.085025|0.114505|0.090472|0.104672|0.095513|0.086137|0.122260|0.110140|0.130813|0.127271|0.139376|0.199777|0.173569|0.215726|0.304137|0.500000| |2.173295|2.609472|2.615301|0.066501|2.354849|2.250513|2.581680|2.939464|3.176057|0.093302|6.644141|5.069242|5.665419|8.897311|17.757444|8.938003|7.771399|6.960151|7.039664|4.068674|4.599192|0.080846|0.090747|0.096858|0.057110|0.056357|0.059208|0.077932|0.076195|0.068620|0.058439|0.057786|0.058043|0.076530|0.066558|0.091635|0.073383|0.500000| |2.285821|2.754830|2.985308|0.079824|2.589193|2.608233|3.142920|3.952286|3.887787|0.121894|6.982924|4.856891|4.053914|4.316979|5.894552|8.941726|9.650053|17.572678|3.345905|3.092736|3.933848|0.069679|0.084870|0.081961|0.062609|0.058574|0.060188|0.083340|0.074942|0.071180|0.063344|0.064798|0.069612|0.087264|0.083486|0.134814|0.103355|0.151536|0.500000| |2.485470|3.004192|3.091219|0.082936|2.578714|2.488790|2.859529|3.617320|3.914561|0.130888|6.969266|4.859583|4.061443|4.327119|5.906038|8.947909|9.624238|17.571186|3.357817|3.109376|3.773328|0.067581|0.081016|0.075990|0.068158|0.062218|0.066594|0.095147|0.081064|0.070627|0.063908|0.061461|0.066885|0.078596|0.074027|0.114047|0.096274|0.151893|0.302631|0.500000| |2.119324|2.517110|2.591728|0.068522|2.270331|2.222776|2.573647|3.076643|3.204863|0.099346|6.052214|4.319890|3.995246|4.727075|7.207102|8.849998|7.802135|17.610791|3.791811|3.042889|3.693589|0.066085|0.076889|0.076732|0.057408|0.054279|0.057145|0.076809|0.070011|0.063595|0.056516|0.056182|0.058999|0.072927|0.067741|0.098447|0.080127|0.219806|0.300202|0.300290|0.500000| |2.190831|2.597687|2.574270|0.063178|2.498498|2.348197|2.621477|2.711315|2.937554|0.079007|6.654831|4.556564|6.660061|8.809470|5.845211|4.281549|5.379239|3.319230|17.550041|6.336408|6.847007|0.121772|0.116497|0.152513|0.055700|0.059003|0.059803|0.072790|0.080708|0.077427|0.062331|0.062604|0.058448|0.082564|0.066676|0.080271|0.065790|0.151255|0.084577|0.081848|0.091741|0.500000| |2.061217|2.426724|2.376699|0.059502|2.232203|2.103142|2.344511|2.514866|2.735590|0.076622|5.931750|4.201711|5.559506|8.880364|7.354695|4.797836|5.440344|3.823243|17.626873|4.644013|5.034472|0.090732|0.092359|0.107452|0.053130|0.054577|0.056850|0.070152|0.073565|0.067132|0.056136|0.055370|0.053475|0.071395|0.060229|0.075344|0.062351|0.226770|0.093261|0.093257|0.111632|0.302849|0.500000| 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