Version2.4 2021-04-30T09:12:53Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 28-Oct-2018 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCN[C@H](C[NH+](CCCOC)CCOC)C(=O)N C45423086 RHF 6-31G(d) (6D,7F) CCCN[C@H](C[NH+](CCCOC)CCOC)C(=O)N C01[X(C13H30N3O3)] 141 C1 345 CCCN[C@@H](C(=O)N)C[NH+](CCCOC)CCOC CCCN[C@@H](C(=O)N)C[NH+](CCCOC)CCOC CCCN[C@H](C[NH+](CCCOC)CCOC)C(N)=O InChIKey=NATWWJSMHKBILH-GFCCVEGCSA-O InChI=1S/C13H29N3O3/c1-4-6-15-12(13(14)17)11-16(8-10-19-3)7-5-9-18-2/h12,15H,4-11H2,1-3H3,(H2,14,17)/p+1/t12-/m1/s1 InChI=1/C13H29N3O3/c1-4-6-15-12(13(14)17)11-16(8-10-19-3)7-5-9-18-2/h12,15H,4-11H2,1-3H3,(H2,14,17)/p+1/t12-/m1/s1/fC13H30N3O3/h16H,14H2/q+1 CCCN[C@H](C[NH+](CCCOC)CCOC)C(=O)N C01[X(C13H30N3O3)] 141 C01 345 CCCN[C@@H](C(=O)N)C[NH+](CCCOC)CCOC CCCN[C@@H](C(=O)N)C[NH](CCCOC)CCOC CCCN[C@H](C[NH](CCCOC)CCOC)C(N)=O InChIKey=PFTATECLAIQXSH-GFCCVEGCSA-N InChI=1S/C13H30N3O3/c1-4-6-15-12(13(14)17)11-16(8-10-19-3)7-5-9-18-2/h12,15-16H,4-11H2,1-3H3,(H2,14,17)/t12-/m1/s1 InChI=1/C13H30N3O3/c1-4-6-15-12(13(14)17)11-16(8-10-19-3)7-5-9-18-2/h12,15-16H,4-11H2,1-3H3,(H2,14,17)/t12-/m1/s1/f/h14H2 1619.2499648218 -897.4723209 1-A 7344.2354 76 269 345 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.69762 -20.65880 -20.64749 -15.82440 -15.70652 -15.68715 -11.47366 -11.42877 -11.42831 -11.42781 -11.42026 -11.41514 -11.38912 -11.38232 -11.36426 -11.35851 -11.35396 -11.32011 -11.30040 -1.52346 -1.51824 -1.48505 -1.46985 -1.35601 -1.33726 -1.21337 -1.20063 -1.16137 -1.12954 -1.08160 -1.05874 -1.03583 -1.00723 -1.00052 -0.98474 -0.95126 -0.92337 -0.91657 -0.87007 -0.86153 -0.84167 -0.83400 -0.81130 -0.79912 -0.79430 -0.77994 -0.76707 -0.76174 -0.75740 -0.74617 -0.74548 -0.73142 -0.72582 -0.71358 -0.71049 -0.70539 -0.67818 -0.67515 -0.67026 -0.66436 -0.65898 -0.65214 -0.65038 -0.64010 -0.61828 -0.61579 -0.61081 -0.59317 -0.58095 -0.57682 -0.57531 -0.55690 -0.55511 -0.53184 -0.51922 -0.50358 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.06420 0.07567 0.08478 0.09789 0.10609 0.12467 0.12937 0.13383 0.13835 0.14650 0.15174 0.15635 0.16065 0.16900 0.17591 0.18368 0.19190 0.19734 0.19797 0.20593 0.21120 0.21353 0.21666 0.23029 0.23194 0.23323 0.23917 0.24334 0.24488 0.24991 0.25662 0.25839 0.26232 0.26534 0.26651 0.28042 0.28204 0.28598 0.29457 0.31157 0.31694 0.32743 0.34190 0.34778 0.36018 0.36280 0.38483 0.41449 0.50214 0.55806 0.56518 0.57580 0.58483 0.58699 0.60507 0.63232 0.64619 0.64790 0.65467 0.66011 0.66665 0.67358 0.67614 0.68534 0.68942 0.69304 0.70557 0.72143 0.72967 0.73574 0.74862 0.76152 0.77689 0.78893 0.79910 0.81076 0.81363 0.81692 0.83020 0.84750 0.86151 0.86459 0.86944 0.88012 0.90769 0.90865 0.92668 0.93472 0.94258 0.95361 0.95637 0.96155 0.97309 0.98196 0.99497 1.00368 1.01266 1.01773 1.03086 1.03374 1.04046 1.04248 1.04962 1.05856 1.06615 1.06770 1.07470 1.07519 1.08060 1.08369 1.08489 1.09174 1.09710 1.10523 1.11369 1.11708 1.12560 1.13219 1.13475 1.13639 1.14693 1.15653 1.16049 1.18082 1.18391 1.19459 1.21012 1.21832 1.24190 1.25289 1.27078 1.28108 1.28556 1.31017 1.33430 1.34755 1.36419 1.37575 1.39872 1.42670 1.44217 1.47917 1.48989 1.52022 1.54725 1.55385 1.56466 1.58784 1.60204 1.61400 1.62013 1.64479 1.66149 1.67462 1.68108 1.69823 1.71681 1.73093 1.73523 1.77164 1.79714 1.80735 1.83712 1.86697 1.88182 1.88237 1.91185 1.93267 1.93805 1.95535 1.96492 1.99488 2.01680 2.01853 2.04865 2.05735 2.06912 2.08585 2.10161 2.11922 2.12719 2.13554 2.14202 2.15701 2.16358 2.17022 2.18125 2.18810 2.19826 2.21379 2.23891 2.24111 2.26466 2.29055 2.29951 2.31672 2.32588 2.33291 2.33862 2.34881 2.35601 2.37195 2.37738 2.39133 2.39379 2.40959 2.44347 2.45212 2.46612 2.47082 2.48423 2.50415 2.51445 2.52241 2.53048 2.54566 2.55923 2.57262 2.60082 2.61581 2.62975 2.65648 2.67858 2.68259 2.69455 2.70768 2.75517 2.76639 2.77819 2.79482 2.80828 2.81741 2.86778 2.87894 2.88388 2.89988 2.90838 2.93967 2.95527 3.00098 3.01990 3.05914 3.08477 3.14026 3.14851 3.16317 3.21411 3.25726 3.27546 3.37238 4.13152 4.23730 4.30113 4.31269 4.34821 4.49784 4.51132 4.54020 4.57603 4.58377 4.59195 4.64092 4.65719 4.66623 4.71529 4.76203 4.81976 4.83721 5.00034 15.44996 1.1214 1.7965 -4.5751 5.0415 |XX|YY|ZZ|XY|XZ|YZ| -98.3667 -87.3747 -92.4632 8.3144 -3.1425 9.0761 |XX|YY|ZZ|XY|XZ|YZ| -5.6318 5.3602 0.2716 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453.9359 472.9149 484.6804 566.1160 617.9457 632.1013 655.5382 696.7443 817.0515 818.8700 846.0509 872.6324 894.0149 933.3487 957.2416 977.4987 985.9748 993.5548 1039.4326 1054.5628 1074.3579 1103.5717 1111.0733 1119.9822 1133.0184 1142.6983 1159.9231 1160.2036 1200.1517 1211.9879 1239.5370 1255.2325 1260.3309 1277.9644 1279.3624 1288.2612 1296.0820 1306.0854 1309.8132 1341.4854 1359.4367 1367.8122 1377.0561 1388.3139 1397.9248 1406.8547 1421.2585 1440.3581 1447.0183 1457.6384 1459.1833 1467.7730 1486.3477 1524.6361 1531.9789 1554.6990 1563.7939 1569.0669 1574.5574 1577.2594 1589.3257 1594.5624 1634.7628 1636.2280 1637.2301 1641.4002 1643.4773 1643.7473 1645.1165 1645.5061 1646.7997 1650.8355 1654.0242 1654.4014 1658.2108 1664.2860 1667.5673 1676.4953 1686.3183 1687.0984 1803.6547 1967.1629 3158.2011 3174.2534 3186.8229 3194.5267 3200.0420 3202.4330 3208.1950 3212.7848 3225.7423 3237.6377 3244.0910 3244.6208 3248.5708 3256.9958 3268.7799 3272.4758 3275.2791 3279.1881 3283.7819 3285.9514 3290.2841 3332.0818 3332.7681 3342.7350 3357.5432 3360.3307 3564.3247 3731.9890 3823.7264 3956.7450 4.1850 4.1470 4.0670 5.4747 3.9478 1.8307 3.6144 1.6041 3.2698 2.4164 2.5014 2.3984 2.8781 3.2130 3.0162 2.9319 1.5197 3.2558 1.3434 1.1684 2.4106 2.8165 3.0487 2.4196 2.5528 1.2473 3.5099 3.0702 3.0612 3.1322 2.7897 3.2058 2.9461 2.7088 2.5395 1.2584 3.3122 1.1243 1.0887 3.7514 2.2962 1.8696 1.6289 1.2841 1.6560 1.6532 1.8352 2.2731 2.2700 3.6114 3.0223 2.8704 2.7971 2.4697 2.4347 2.6309 2.5107 2.1809 1.9126 2.7699 2.0945 1.9904 1.6421 2.5381 2.8087 1.3198 1.5358 1.7579 1.4122 1.5739 1.5955 1.4923 1.2468 1.4167 1.2970 1.3649 1.2536 1.1158 1.2253 1.1193 1.1995 1.3331 1.3120 1.2790 1.4023 1.5667 1.3141 1.4128 1.4261 1.4137 1.3970 1.1421 1.0721 1.1822 1.0916 1.0540 1.0485 1.0478 1.0977 1.1019 1.0935 1.0785 1.0746 1.0900 1.2055 1.1250 1.2273 1.1012 1.0997 1.2426 8.8090 1.0548 1.0676 1.1074 1.0370 1.0648 1.0516 1.0388 1.0419 1.0937 1.0631 1.1035 1.1068 1.1068 1.0852 1.0671 1.1042 1.1072 1.0663 1.0907 1.1019 1.0785 1.1004 1.1049 1.1029 1.1049 1.1054 1.0774 1.0744 1.0487 1.1050 0.0006 0.0016 0.0023 0.0040 0.0040 0.0027 0.0071 0.0049 0.0164 0.0141 0.0170 0.0221 0.0284 0.0376 0.0399 0.0473 0.0428 0.0944 0.0451 0.0439 0.0946 0.1348 0.1728 0.1483 0.1683 0.0943 0.2764 0.2677 0.3479 0.3803 0.3676 0.4437 0.5563 0.6094 0.5978 0.3186 0.9473 0.4422 0.4301 1.5821 1.0302 0.8804 0.8361 0.6933 0.9322 0.9469 1.0674 1.4469 1.4874 2.4559 2.1687 2.0877 2.0672 1.8679 1.8731 2.0855 1.9912 1.8508 1.6553 2.5075 1.9444 1.8628 1.5801 2.4476 2.7464 1.3062 1.5436 1.7769 1.4973 1.7137 1.7587 1.6673 1.4158 1.6312 1.5124 1.6244 1.5324 1.3765 1.5338 1.4041 1.5226 1.7352 1.7969 1.7685 1.9970 2.2574 1.9061 2.0637 2.0902 2.1039 2.0929 1.7983 1.6912 1.8671 1.7328 1.6774 1.6691 1.6708 1.7511 1.7607 1.7558 1.7383 1.7329 1.7658 1.9673 1.8432 2.0324 1.8450 1.8442 2.3816 20.0844 6.1984 6.3380 6.6264 6.2354 6.4246 6.3543 6.2994 6.3366 6.7053 6.5657 6.8427 6.8651 6.8818 6.7827 6.7180 6.9670 6.9978 6.7553 6.9297 7.0100 6.8789 7.1981 7.2308 7.2608 7.3386 7.3542 8.0647 8.8164 9.0340 10.1924 0.3798 0.2015 1.0189 8.4358 1.8375 6.0134 0.9789 0.7971 0.9774 5.4013 7.0101 4.9327 1.4190 2.0448 3.1090 2.7936 11.4473 6.0133 4.3312 0.6859 2.8323 1.3453 21.9641 6.1930 12.4198 219.5380 8.4810 6.4022 13.7248 0.6576 11.3984 2.9542 4.4730 1.0269 12.8399 36.4352 7.9601 1.6806 1.3323 13.4725 52.0332 31.1854 7.3313 22.2361 3.6122 7.3165 13.2352 60.0504 12.4307 18.4364 41.2354 10.9450 48.2218 15.1779 2.4242 13.5587 8.3947 5.4177 6.0021 50.2459 34.2882 0.4243 29.4976 112.1035 163.1829 14.8676 3.8358 6.5557 44.2968 36.4776 70.9368 9.6181 16.0005 73.4500 20.0978 38.8181 1.1814 0.1993 8.3600 6.6400 11.4297 22.8012 82.7558 38.1443 11.9848 15.1216 5.7690 6.1657 62.2051 96.6700 50.5126 5.7364 1.1079 0.9622 6.3388 4.6644 17.5562 7.1788 1.0424 22.9261 2.8615 2.9164 13.7798 3.6655 46.3428 3.8164 34.1460 7.4947 2.0479 136.1124 362.8836 35.5942 39.1358 53.5659 63.3500 29.4797 19.8156 28.1108 47.2407 11.9629 9.2570 18.3087 35.2115 65.4194 17.3496 15.6871 78.6829 50.1250 6.9652 2.4097 32.0938 22.8853 28.5422 20.1627 19.2132 6.5166 4.2367 164.0676 11.7653 109.9064 73.7395 0.1589 0.3283 0.1599 1.3462 0.4141 0.0275 0.1979 0.0434 0.2322 0.1449 0.1120 0.0337 0.1051 0.2733 0.4850 0.2452 0.1278 1.6187 0.1001 0.1375 0.2342 0.6491 1.7264 1.1178 0.8877 0.4873 0.6889 3.2302 0.8441 0.3464 1.2817 0.5600 0.4214 0.8514 0.9071 1.6638 2.2969 0.4374 0.0910 0.5712 3.7489 3.0634 7.4281 1.0615 6.4721 4.1270 6.2312 1.7561 2.8653 8.9117 2.7701 6.8197 3.7424 9.3220 8.4348 1.7779 6.8741 11.0367 1.1330 3.6469 3.6966 5.7221 6.1753 7.4197 10.3278 2.7451 5.4552 2.1858 2.1825 0.8409 1.3548 2.0326 6.4287 1.6611 5.5543 2.5403 6.0193 19.5240 18.2676 4.7341 8.4519 1.0816 5.7119 2.5557 3.6163 3.5764 1.4639 2.5429 2.3987 2.6303 3.9104 3.9584 26.1319 16.0147 14.4898 10.4852 31.4950 20.9809 5.3760 5.1820 1.0937 9.2526 11.5723 1.7036 1.8922 3.8035 2.5110 9.0024 10.9404 3.1993 5.3886 36.0358 61.8194 49.3343 122.1926 62.1688 7.9132 116.9813 163.6691 72.7262 62.6143 33.5362 64.3204 52.4099 23.4104 32.8709 27.9642 57.3825 48.5350 64.2259 86.4305 108.0788 92.9648 28.7962 58.1067 51.2173 15.2986 27.7583 23.8118 106.3677 42.1763 0.7497 0.7463 0.7249 0.7500 0.7494 0.7084 0.7206 0.6095 0.6081 0.7492 0.7024 0.7346 0.4737 0.6906 0.6685 0.7145 0.7014 0.1851 0.3159 0.4387 0.3066 0.1284 0.2266 0.2294 0.1477 0.3101 0.1985 0.0860 0.5281 0.6155 0.6993 0.4085 0.6352 0.6669 0.3245 0.7477 0.6007 0.5318 0.4985 0.7273 0.3043 0.3531 0.2612 0.7418 0.1713 0.6979 0.2256 0.5163 0.4817 0.3765 0.7436 0.5181 0.4320 0.7167 0.6371 0.2376 0.1545 0.1566 0.6869 0.7144 0.4299 0.3193 0.6037 0.7239 0.4832 0.7500 0.7424 0.7043 0.7492 0.7500 0.3950 0.6985 0.7406 0.2976 0.6237 0.5309 0.7495 0.7499 0.7487 0.3708 0.4726 0.6750 0.6271 0.7108 0.7498 0.5274 0.5012 0.7080 0.4510 0.5987 0.5304 0.6859 0.7205 0.6882 0.6956 0.7387 0.7497 0.7498 0.7406 0.6811 0.5590 0.7267 0.7432 0.7474 0.6915 0.7387 0.7497 0.7370 0.7387 0.7286 0.4187 0.1084 0.2341 0.7463 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37.11 44.85 50.41 59.92 71.78 82.79 103.21 132.75 143.33 154.67 180.03 186.29 202.81 215.45 238.18 314.47 319.24 343.33 363.24 371.31 410.03 446.28 464.08 481.35 515.43 525.98 553.49 631.89 653.11 680.42 697.35 814.51 889.09 909.45 943.17 1002.46 1175.55 1178.17 1217.28 1255.52 1286.29 1342.88 1377.26 1406.40 1418.60 1429.50 1495.51 1517.28 1545.76 1587.79 1598.59 1611.40 1630.16 1644.09 1668.87 1669.27 1726.75 1743.78 1783.42 1806.00 1813.34 1838.71 1840.72 1853.52 1864.77 1879.17 1884.53 1930.10 1955.93 1967.98 1981.28 1997.47 2011.30 2024.15 2044.87 2072.35 2081.94 2097.22 2099.44 2111.80 2138.52 2193.61 2204.18 2236.87 2249.95 2257.54 2265.44 2269.32 2286.69 2294.22 2352.06 2354.17 2355.61 2361.61 2364.60 2364.99 2366.96 2367.52 2369.38 2375.18 2379.77 2380.31 2385.80 2394.54 2399.26 2412.10 2426.24 2427.36 2595.06 2830.31 4543.95 4567.04 4585.13 4596.21 4604.15 4607.59 4615.88 4622.48 4641.12 4658.24 4667.52 4668.29 4673.97 4686.09 4703.05 4708.36 4712.40 4718.02 4724.63 4727.75 4733.98 4794.12 4795.11 4809.45 4830.76 4834.77 5128.27 5369.50 5501.49 5692.87 0.481203 0.504358 0.505302 0.424313 -896.991118 -896.967963 -896.967019 -897.048008 2.716384D-04 MUNgauss RevisionA2.1 retrievium 30-Apr-2021 DUDE CCCN[C@H](C[NH+](CCCOC)CCOC)C(=O)N C45423086 RHF 6-31G(d) (6D,10F) C1 276.228717 |X|Y|Z| 44.719242 38.208046 62.326109 47.399427 0 |36.858105| |12.467357|36.858105| |7.511545|12.496383|36.858105| |4.981115|7.748740|13.002969|53.358707| |3.811334|5.024448|7.729957|17.886742|36.858105| |3.793643|4.731009|7.374041|12.556498|17.584682|0.500000| |3.065302|3.923734|5.065332|10.698754|12.395998|0.244086|36.858105| |3.075056|3.963740|4.741195|9.458383|7.617807|0.184349|12.747922|53.358707| |3.561574|4.848809|5.660755|12.012644|7.663643|0.179977|9.474407|25.488585|0.500000| |2.921713|3.573307|4.259426|7.330835|6.018060|0.176862|7.629822|17.259864|0.257725|36.858105| |2.992500|3.592161|3.961365|6.267614|4.501878|0.131682|5.019584|10.334714|0.208503|12.495322|36.858105| |2.662907|3.013763|3.293975|4.851714|3.594847|0.109796|3.826008|6.712892|0.132195|7.548683|12.495466|36.858105| |2.599747|2.871308|2.980613|4.244564|3.010908|0.089737|3.129453|5.349592|0.110832|5.143541|8.147890|13.757630|73.516695| |2.296283|2.451955|2.537801|3.529857|2.545380|0.076375|2.611088|4.229631|0.086441|3.918525|5.227876|8.124138|24.179880|36.858105| |2.585300|3.223148|3.579136|6.539338|5.015023|0.122833|7.676530|17.280269|0.258538|7.653095|5.974326|4.208830|6.297752|2.857981|36.858105| |2.633021|3.329355|3.512465|6.380441|4.466159|0.105303|6.004183|10.422737|0.213267|5.052593|4.511626|3.351883|5.351382|2.478245|12.538533|36.858105| |3.044875|3.975785|3.961642|7.078071|4.418679|0.105582|5.250813|9.527863|0.241437|4.930517|4.882585|3.524729|5.820120|2.640507|8.186761|13.715675|73.516695| |2.962445|3.780857|3.534261|5.873579|3.608346|0.087120|3.987552|6.371243|0.153791|3.632481|3.680840|2.863596|4.905462|2.298091|5.228042|8.069378|24.051796|36.858105| |3.422378|4.237389|5.986818|10.482374|12.396368|0.243559|7.717256|6.827145|0.137607|4.155477|3.313713|2.806151|4.313131|2.121058|3.923444|3.724644|6.357394|3.125675|36.858105| |3.191225|3.958771|5.065244|8.897809|8.075760|0.163308|6.643925|6.212920|0.127067|3.632585|2.985101|2.516553|3.944767|1.945118|3.853821|3.901115|6.537824|3.318110|15.876182|73.516695| |3.170441|3.659248|5.034550|7.446937|7.744974|0.207989|5.475711|5.393918|0.107255|3.595430|2.933152|2.602838|4.014206|2.018589|3.199189|2.987333|5.132639|2.571726|14.213462|15.086542|53.358707| |17.578708|8.806078|5.481143|5.617469|3.230041|0.088263|2.717703|3.777862|0.089014|2.633615|2.752118|2.465940|4.378367|2.191017|2.406169|2.493512|5.180794|2.924666|2.937270|4.998652|3.698018|0.500000| |17.550747|8.767453|6.794335|6.233686|3.674265|0.101384|2.916284|3.845029|0.088733|2.670967|2.661553|2.396976|4.114902|2.074837|2.394164|2.439389|4.880708|2.686896|3.487390|5.806327|4.514204|0.302164|0.500000| |17.544954|8.768356|6.793903|6.249516|3.679349|0.106331|2.975317|4.118451|0.096011|2.992281|3.119312|2.850523|4.978285|2.492477|2.520974|2.500216|5.089796|2.724426|3.233229|5.229106|4.179570|0.302128|0.301357|0.500000| |8.859233|17.515052|8.888242|9.630075|4.693568|0.116616|3.794684|5.107012|0.126442|3.250186|3.211144|2.685369|4.558953|2.206801|3.170271|3.424605|7.284665|4.103575|4.211972|7.421716|4.836869|0.213175|0.210877|0.172882|0.500000| |8.826813|17.541756|8.910642|9.727972|4.715757|0.124523|3.936203|5.817362|0.151071|3.890463|4.131152|3.374923|5.825269|2.728579|3.489702|3.606726|8.058733|4.250185|3.793741|6.332501|4.439107|0.212340|0.172593|0.210076|0.303296|0.500000| |6.860192|8.865501|17.543371|12.503301|7.049709|0.222752|4.801460|6.353276|0.149794|4.585324|4.341835|3.716851|5.906099|2.827657|3.463103|3.251508|6.441731|3.171680|5.235572|7.607176|6.464840|0.140508|0.168178|0.203097|0.174007|0.213605|0.500000| |6.909446|8.851944|17.481291|12.201894|6.950989|0.185006|4.531790|5.433603|0.125011|3.612591|3.297692|2.843364|4.589935|2.255871|3.137071|3.101622|5.994674|3.094483|6.535465|9.734692|7.949816|0.141026|0.204917|0.169869|0.211720|0.174040|0.302214|0.500000| |4.688272|7.239416|9.379158|25.807372|9.496871|0.183649|7.025456|8.255025|0.209033|4.507824|3.937172|3.094405|4.924543|2.332929|4.668196|4.975336|9.812950|4.819069|7.520443|13.379790|6.985056|0.111865|0.122749|0.114727|0.217012|0.180913|0.181942|0.216930|0.500000| |2.690960|3.286936|4.160097|7.694492|8.697006|0.214810|17.606306|12.333000|0.183190|7.268150|4.635461|3.758844|5.366251|2.571641|6.627898|4.951024|7.517748|3.333699|6.710239|10.103844|7.338001|0.066727|0.071972|0.073750|0.087808|0.091251|0.114285|0.107413|0.141915|0.500000| |2.905838|3.717950|4.554663|9.394402|8.914178|0.174571|17.673072|12.388885|0.216456|5.617509|4.155966|3.240520|4.896909|2.329121|7.537737|6.910668|9.928254|4.358068|7.451873|13.726165|6.929052|0.072706|0.077592|0.076650|0.104619|0.102598|0.114459|0.116742|0.200326|0.301511|0.500000| |3.110276|3.757293|4.752537|7.875283|6.988835|0.238105|7.570249|12.379527|0.210833|17.648689|8.863277|6.868895|8.430301|3.780783|5.648979|4.174282|7.364681|3.217132|4.631526|6.811598|5.624382|0.076179|0.079675|0.089926|0.092758|0.110264|0.149836|0.112612|0.128069|0.208659|0.148427|0.500000| |2.510868|2.982917|3.484949|5.820826|4.943478|0.143848|6.578015|12.401237|0.182267|17.597717|8.733019|6.810352|8.344272|3.757617|7.422433|4.706868|7.634848|3.259878|3.726872|5.905207|4.507766|0.063658|0.064782|0.071273|0.076970|0.088674|0.102731|0.085407|0.104326|0.199732|0.142712|0.302733|0.500000| |2.734160|3.269467|3.460303|5.513846|3.891954|0.108804|4.509579|9.364935|0.189933|8.775814|17.587422|8.957403|13.301562|4.919211|6.525237|4.977301|9.648981|4.022013|2.988638|4.941994|3.577425|0.071412|0.067749|0.077808|0.083587|0.105164|0.101237|0.081318|0.100922|0.115559|0.109570|0.173117|0.207179|0.500000| |3.549804|4.360223|4.690917|7.181792|4.725357|0.137720|4.841540|9.423273|0.222715|8.867722|17.559069|8.929270|13.257186|4.901048|5.239180|4.359074|9.058627|3.917080|3.424118|5.471386|4.094987|0.090065|0.085181|0.103628|0.104654|0.146388|0.145274|0.103930|0.122181|0.118507|0.112941|0.213836|0.172641|0.303397|0.500000| |2.784238|3.095825|3.476147|4.953116|3.742559|0.119798|3.790375|6.225400|0.123088|6.892297|8.804557|17.468325|16.563117|7.241870|3.736901|3.033838|5.646322|2.628387|2.921352|4.558486|3.773269|0.070512|0.070024|0.084453|0.075382|0.094319|0.113164|0.083936|0.086124|0.104753|0.087877|0.205783|0.169643|0.174086|0.212368|0.500000| |2.333514|2.622499|2.875721|4.293342|3.286641|0.099278|3.628447|6.218180|0.116710|6.859272|8.811170|17.473244|16.560595|7.261501|4.138173|3.226556|5.788652|2.662109|2.637486|4.240590|3.357121|0.060384|0.059306|0.068574|0.066247|0.079989|0.088222|0.070583|0.077639|0.102822|0.086361|0.168746|0.202670|0.213035|0.173845|0.301297|0.500000| |2.228543|2.349510|2.370975|3.262932|2.312002|0.068397|2.356654|3.786205|0.078663|3.346255|4.389097|5.872895|16.889081|17.647505|2.605121|2.324141|4.458534|2.229157|1.952679|3.217973|2.525937|0.059980|0.055756|0.067066|0.059082|0.073008|0.072496|0.058748|0.060664|0.063865|0.059342|0.089270|0.088667|0.119806|0.119443|0.147232|0.147426|0.500000| |2.358123|2.475564|2.591631|3.527595|2.563597|0.078426|2.566173|4.043166|0.082669|3.752037|4.735452|7.206354|16.443792|17.528152|2.664761|2.318666|4.376261|2.155410|2.145862|3.461875|2.820880|0.061964|0.059454|0.072254|0.061272|0.075497|0.081739|0.064435|0.064214|0.070601|0.063162|0.105387|0.099074|0.117657|0.127309|0.215095|0.175366|0.299742|0.500000| |2.065066|2.213305|2.312489|3.265804|2.402784|0.071734|2.516060|4.045936|0.080743|3.750490|4.743480|7.208273|16.444683|17.530162|2.803856|2.405053|4.448305|2.176919|2.026093|3.317820|2.633881|0.054755|0.052462|0.061529|0.056078|0.067551|0.070689|0.057772|0.060493|0.070047|0.062647|0.099267|0.104677|0.128062|0.117467|0.174734|0.215837|0.299746|0.299142|0.500000| |2.459385|3.000780|3.241630|5.588319|4.159099|0.107390|5.659694|12.391789|0.210041|7.609798|6.907691|4.786723|7.219949|3.203819|17.677280|8.947032|12.980349|4.869501|3.296516|5.685564|3.799280|0.064277|0.062701|0.067506|0.080875|0.092177|0.089319|0.078627|0.108841|0.144320|0.148143|0.149044|0.214397|0.241540|0.157170|0.111784|0.133207|0.080906|0.080806|0.088061|0.500000| |2.329247|2.833982|3.191765|5.678788|4.669258|0.115743|7.399090|12.313798|0.182416|6.530123|4.885828|3.762570|5.596061|2.626910|17.617525|8.766018|10.306904|4.232966|3.870462|6.805468|4.372432|0.060167|0.060937|0.063279|0.077830|0.083024|0.086241|0.080166|0.113551|0.204015|0.209792|0.143264|0.200856|0.142988|0.117868|0.094951|0.106947|0.066312|0.068686|0.072947|0.301101|0.500000| |2.319219|2.838413|2.934104|5.037386|3.579134|0.087272|4.604967|7.604855|0.151693|4.202294|3.913359|3.047769|4.974354|2.343441|8.965387|17.531650|16.461221|7.190981|3.113123|5.823561|3.516439|0.061885|0.060014|0.061486|0.081283|0.085201|0.076484|0.073309|0.108444|0.113208|0.144107|0.097538|0.114134|0.123821|0.103304|0.076004|0.083304|0.061632|0.060390|0.063970|0.220821|0.209363|0.500000| |2.641995|3.351909|3.593431|6.650300|4.752212|0.107574|6.373664|9.128391|0.185717|4.442062|3.828302|2.954949|4.710958|2.228124|8.754247|17.521702|16.531792|7.160502|4.184846|8.231954|4.435004|0.069105|0.069174|0.068741|0.098310|0.097309|0.089999|0.090354|0.152836|0.143360|0.235998|0.107801|0.115613|0.111578|0.104732|0.076475|0.079136|0.058128|0.058820|0.060082|0.173684|0.211921|0.301816|0.500000| |2.551180|3.122603|2.949864|4.765605|3.069510|0.075653|3.447089|5.476184|0.124647|3.254695|3.330484|2.665194|4.621730|2.193939|4.766915|7.168575|16.451810|17.565055|2.716894|5.124081|3.110778|0.070596|0.064935|0.066055|0.092798|0.096311|0.075187|0.073172|0.106038|0.083023|0.104373|0.079648|0.083761|0.103676|0.095599|0.067369|0.070103|0.059543|0.056696|0.058386|0.128785|0.111082|0.213071|0.172513|0.500000| |2.986983|3.828543|3.604350|6.030964|3.706410|0.087409|4.019588|5.938304|0.140496|3.341959|3.252568|2.585296|4.377927|2.085826|4.719828|7.189373|16.427106|17.549342|3.343924|6.560398|3.690820|0.081552|0.076764|0.074908|0.120599|0.114054|0.087406|0.089806|0.146043|0.092795|0.127572|0.084472|0.083933|0.095420|0.095886|0.067275|0.067175|0.056028|0.055069|0.055081|0.116533|0.111360|0.175010|0.212834|0.298989|0.500000| |3.265356|4.170107|3.668090|5.793607|3.427764|0.084541|3.597840|5.751616|0.142751|3.452056|3.655732|2.877681|5.056782|2.365017|4.397624|5.852458|16.854092|17.657432|2.950387|5.461736|3.357975|0.091534|0.080475|0.082824|0.125800|0.135632|0.091592|0.087970|0.129382|0.084188|0.105101|0.086400|0.084731|0.109810|0.112382|0.073664|0.072979|0.064474|0.061679|0.061356|0.118161|0.100033|0.146301|0.146421|0.299727|0.299360|0.500000| |3.223198|3.628230|5.067062|7.053216|7.203225|0.229876|5.065481|5.251684|0.104208|3.700260|3.032357|2.750248|4.209052|2.129797|3.065482|2.799500|4.873107|2.426184|9.257242|10.790090|26.099338|0.075988|0.093281|0.089189|0.094575|0.090434|0.142351|0.161189|0.127923|0.142241|0.124101|0.122830|0.094304|0.074128|0.086477|0.083254|0.072055|0.054033|0.061498|0.056539|0.075804|0.084974|0.067652|0.082586|0.060151|0.069806|0.065412|0.500000| 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