Version2.4 2021-05-26T11:22:50Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 25-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCN1[C@H](C(=C(C1=O)[O-])C(=O)c2ccc(c(c2)C)OCC(C)C)c3cccc(c3)Br C40094132 RHF 6-31G(d) (6D,7F) CCCCN1[C@H](C(=C(C1=O)[O-])C(=O)c2ccc(c(c2)C)OCC(C)C)c3cccc(c3)Br C01[X(C26H29Br1N1O4)] 177 C1 553 CCCCN1[C@@H](c2cccc(c2)Br)C(=C(C1=O)[O-])C(=O)c1ccc(c(c1)C)OCC(C)C CCCCN1[C@@H](c2cccc(c2)Br)C(=C(C1=O)[O-])C(=O)c1ccc(c(c1)C)OCC(C)C CCCCN1[C@@H](c2cccc(Br)c2)C(=C([O-])C1=O)C(=O)c3ccc(OCC(C)C)c(C)c3 InChIKey=DIYJDLOFIKTSBD-QHCPKHFHSA-M InChI=1S/C26H30BrNO4/c1-5-6-12-28-23(18-8-7-9-20(27)14-18)22(25(30)26(28)31)24(29)19-10-11-21(17(4)13-19)32-15-16(2)3/h7-11,13-14,16,23,30H,5-6,12,15H2,1-4H3/p-1/t23-/m0/s1 InChI=1/C26H30BrNO4/c1-5-6-12-28-23(18-8-7-9-20(27)14-18)22(25(30)26(28)31)24(29)19-10-11-21(17(4)13-19)32-15-16(2)3/h7-11,13-14,16,23,30H,5-6,12,15H2,1-4H3/p-1/t23-/m0/s1/fC26H29BrNO4/h30h/q-1 CCCCN1[C@H](C(=C(C1=O)[O-])C(=O)c2ccc(c(c2)C)OCC(C)C)c3cccc(c3)Br C01[X(C26H29Br1N1O4)] 177 C01 553 CCCCN1[C@@H](c2cccc(c2)Br)C(=C(C1=O)[O-])C(=O)c1ccc(c(c1)C)OCC(C)C CCCCN1[C@@H]([C]2[CH][CH][CH][C]([CH]2)Br)[C]([C](=O)C1=O)[C](=O)[C]1[CH][CH][C]([C]([CH]1)C)OCC(C)C CCCCN1[C@@H]([C]2[CH][CH][CH][C](Br)[CH]2)[C](C(=O)[C]3[CH][CH][C](OCC(C)C)[C](C)[CH]3)C(=O)C1=O InChIKey=APZXICZWIRDVLP-QHCPKHFHSA-N InChI=1S/C26H29BrNO4/c1-5-6-12-28-23(18-8-7-9-20(27)14-18)22(25(30)26(28)31)24(29)19-10-11-21(17(4)13-19)32-15-16(2)3/h7-11,13-14,16,23H,5-6,12,15H2,1-4H3/t23-/m0/s1 InChI=1/C26H29BrNO4/c1-5-6-12-28-23(18-8-7-9-20(27)14-18)22(25(30)26(28)31)24(29)19-10-11-21(17(4)13-19)32-15-16(2)3/h7-11,13-14,16,23H,5-6,12,15H2,1-4H3/t23-/m0/s1 3691.7102128462 -3925.3002758 1-A 20787.3207 130 423 553 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5.8450 6.1594 5.0037 6.7206 5.5680 7.0281 3.1641 1.6073 1.6128 4.2474 2.7782 2.5745 3.5183 2.0326 4.0721 1.9456 2.8153 4.0722 1.8541 5.3110 2.5567 2.8811 1.2132 1.3264 1.3614 1.3861 1.4868 1.5138 1.3831 1.7937 2.9568 1.4569 5.4196 1.7439 1.3743 2.8947 2.3037 3.1133 1.5113 2.4446 3.7831 1.9155 2.2560 2.9912 2.4951 1.7686 2.4321 2.5929 2.6049 1.8007 1.7909 2.4631 1.4760 2.1998 2.7915 2.7516 2.5431 2.0581 1.6661 1.6529 1.3018 1.3682 1.2981 1.0889 1.3256 1.5329 1.5753 1.3304 1.4517 2.6644 1.3346 1.8446 1.2875 1.5133 1.3425 1.8616 1.3788 2.9052 2.5988 1.0466 1.1184 1.0733 1.1008 1.0707 1.1127 2.2223 1.0464 1.0774 1.0535 1.0912 1.0639 1.4093 1.6401 5.3270 7.0216 5.6860 10.2474 6.3372 12.7735 11.9893 1.0820 1.0596 1.0547 1.0602 1.0393 1.0529 1.0457 1.0811 1.0378 1.0948 1.0708 1.1045 1.1022 1.0948 1.1024 1.1018 1.1018 1.1021 1.1019 1.1025 1.1030 1.0980 1.0880 1.0890 1.0939 1.0916 1.0938 1.0955 1.0928 0.0005 0.0007 0.0011 0.0014 0.0020 0.0049 0.0043 0.0115 0.0130 0.0077 0.0072 0.0255 0.0380 0.0337 0.0327 0.0336 0.0203 0.0738 0.0399 0.1112 0.1066 0.1213 0.0879 0.0368 0.1424 0.0652 0.0621 0.0852 0.2201 0.0679 0.2971 0.2819 0.4614 0.4590 0.4137 0.4411 0.6770 0.2541 0.4309 0.3883 0.4801 0.3101 0.4416 0.5112 0.8359 0.8415 1.9441 1.0481 1.3292 1.4994 1.2824 1.8403 1.6961 2.1996 1.0698 0.5835 0.5957 1.6204 1.1130 1.0991 1.5044 0.8982 1.9148 0.9268 1.3668 2.0099 0.9556 2.8045 1.4258 1.6353 0.7352 0.8083 0.8341 0.8707 0.9423 0.9710 0.8953 1.1730 2.0167 1.0014 3.7391 1.2362 0.9845 2.1091 1.7443 2.4594 1.2262 2.0005 3.1366 1.6272 1.9883 2.6515 2.2289 1.6202 2.2569 2.4599 2.5902 1.7971 1.8023 2.4878 1.5023 2.2680 2.9743 2.9706 2.8443 2.3876 1.9575 1.9442 1.5395 1.6505 1.5768 1.3511 1.6723 1.9826 2.0817 1.7869 1.9786 3.6778 1.9056 2.6411 1.8524 2.1955 1.9485 2.7120 2.0403 4.3709 3.9411 1.6372 1.7607 1.6910 1.7359 1.6921 1.7613 3.5285 1.6663 1.7178 1.6877 1.7634 1.7254 2.3182 2.7470 9.8759 13.0852 10.7784 19.7606 12.3304 28.4318 27.2287 6.4256 6.3118 6.2919 6.3554 6.2342 6.3304 6.3028 6.5264 6.2702 6.6395 6.5583 6.7652 6.8340 6.7919 6.8526 6.8581 6.8807 6.8958 6.9030 6.9867 7.0181 7.0432 7.2071 7.2904 7.3404 7.3649 7.4235 7.4488 7.4947 0.1641 0.2971 0.3232 0.1671 1.1410 0.0731 0.2855 2.7865 4.1191 0.0963 0.0400 0.5396 0.8547 0.2345 0.6768 2.6650 0.8587 1.7581 2.1086 2.2715 0.1301 1.1087 2.6548 0.2775 1.1221 1.1646 0.5321 1.6442 0.2754 0.1482 2.6084 1.7146 3.9657 2.7735 3.1167 3.0876 2.8408 0.3682 0.4726 7.3323 2.4271 0.2338 0.3319 6.8145 8.2781 1.2923 26.3908 8.8671 4.3849 13.6325 15.9892 19.6967 21.1343 47.8420 18.1815 9.6140 1.7982 7.9244 47.4433 61.7201 3.6254 17.2865 11.3987 12.7924 8.2476 32.6703 7.9375 8.7224 2.0245 4.9456 1.1451 0.2874 3.4375 0.6834 7.1693 8.7098 0.8639 5.2327 19.9196 0.8142 7.1511 16.5339 1.7831 10.0518 0.4767 15.4760 2.2222 13.7237 22.7178 9.6794 20.7230 7.9580 39.7666 39.6175 6.2371 89.6128 19.1759 7.5619 23.7470 26.7339 1.5522 83.6733 18.0615 75.2323 141.5013 275.4471 141.4371 13.9981 3.8611 22.2209 31.0986 3.5826 12.0619 88.2355 19.0308 2.2009 83.3280 643.4416 3.5994 88.9669 5.5692 14.6783 2.0877 21.6058 62.3521 355.2249 145.5561 3.3283 16.9426 2.9093 13.0349 2.8216 8.2828 26.6737 2.8139 0.4605 3.7333 2.2595 12.9786 64.8935 29.0798 26.5533 19.6642 23.5889 252.3002 228.2589 694.2330 616.7910 42.2203 37.8039 15.2901 27.6141 33.2260 46.9915 48.0554 17.5244 54.7984 24.9918 18.0073 51.4730 17.1935 17.4946 75.4249 31.0544 109.7619 87.6892 82.6850 34.5361 45.9709 30.2716 12.2764 18.1326 25.7588 9.4268 21.5686 14.5732 0.1403 1.0192 0.2312 1.8154 1.0641 2.0482 0.6178 0.9108 1.8782 4.2131 2.3581 0.7032 0.2726 0.3767 0.2822 0.2086 0.4701 1.2424 0.5921 0.7021 1.9844 1.4477 1.2862 3.4406 0.1281 0.9892 0.4441 1.5112 1.9158 1.5110 0.1850 2.8325 3.3525 4.7287 3.1838 2.0616 2.6246 4.0207 1.5009 2.1291 1.0680 0.4640 0.4486 0.8207 0.3493 2.2141 3.6777 1.2518 3.9245 1.0590 2.3070 2.0247 4.5183 9.4718 4.9163 0.3112 0.8505 1.4897 1.1839 2.9103 6.2747 2.7714 1.5231 8.5879 1.1463 18.0969 1.3212 1.4682 0.9424 11.7240 5.9886 1.8496 0.9132 4.3002 0.8089 2.9211 1.2417 5.6529 9.1310 1.9649 1.1057 32.7976 4.1782 0.8535 1.1042 13.5244 0.7096 1.1803 5.4522 4.5221 1.0388 5.2946 2.6227 4.2411 1.6252 9.6901 7.2266 7.4533 3.8092 6.1716 6.6576 3.4160 1.8432 2.9042 5.6707 50.1455 13.6252 13.3471 0.4741 0.6315 1.6101 1.8120 21.7730 8.4964 13.0505 2.9967 8.2241 2.6546 25.9602 1.8763 4.7401 1.9436 2.6309 1.6376 15.2361 1.5714 3.5692 9.5330 17.7450 3.1259 8.5368 49.3908 22.8794 8.2836 0.5777 17.0476 8.0199 32.0992 0.6744 1.0931 11.0072 2.0968 6.9659 9.7341 23.2304 76.6962 71.6954 63.6157 43.5318 26.7569 34.2113 16.4668 23.7376 4.2213 197.3826 270.6716 82.2775 132.8043 73.6780 69.4607 15.6687 27.6305 6.7844 94.1040 86.1235 62.9901 53.3202 140.4106 58.8239 29.6594 54.0836 56.3226 42.1436 77.5961 37.7474 109.2262 117.8299 26.6571 0.7049 0.7414 0.7370 0.7109 0.7476 0.7443 0.7223 0.7197 0.7500 0.7305 0.6693 0.6447 0.5671 0.4300 0.2625 0.4865 0.7306 0.4120 0.5611 0.4583 0.7444 0.4439 0.6991 0.7422 0.6872 0.3532 0.2634 0.3468 0.3853 0.4683 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0.3065 0.1458 0.1971 0.1987 0.8269 0.8515 0.8486 0.8310 0.8556 0.8534 0.8388 0.8370 0.8571 0.8443 0.8019 0.7839 0.7237 0.6014 0.4159 0.6545 0.8443 0.5836 0.7189 0.6285 0.8534 0.6148 0.8229 0.8520 0.8146 0.5220 0.4170 0.5150 0.5563 0.6379 0.6178 0.4965 0.7417 0.5352 0.2943 0.8032 0.0471 0.2799 0.7640 0.8536 0.4655 0.2862 0.7695 0.8415 0.7661 0.4247 0.6364 0.3860 0.6149 0.7985 0.7658 0.8008 0.2063 0.3084 0.7571 0.3543 0.6297 0.4045 0.4569 0.8554 0.2042 0.6601 0.2664 0.8372 0.1445 0.7482 0.7437 0.8564 0.2378 0.8438 0.8474 0.3112 0.8570 0.7111 0.6791 0.5831 0.8568 0.8311 0.7871 0.8524 0.1920 0.4492 0.4762 0.6320 0.7743 0.8571 0.8569 0.2908 0.4400 0.6007 0.5111 0.8380 0.1582 0.8565 0.8560 0.3015 0.4330 0.1878 0.6944 0.4073 0.4898 0.8570 0.5789 0.4119 0.3998 0.3765 0.5559 0.6868 0.7870 0.7862 0.7615 0.8433 0.8463 0.8522 0.6741 0.8506 0.3944 0.6652 0.8560 0.8301 0.8252 0.5261 0.8541 0.6225 0.6677 0.7795 0.4543 0.8524 0.3817 0.8211 0.7834 0.8335 0.8560 0.8570 0.8562 0.8326 0.8454 0.8492 0.7430 0.6848 0.8298 0.7878 0.7443 0.8056 0.5888 0.7991 0.4472 0.4679 0.4557 0.6093 0.4238 0.7341 0.6120 0.0935 0.0624 0.7821 0.0564 0.8021 0.1929 0.4022 0.7973 0.7399 0.7780 0.8442 0.7167 0.8569 0.7551 0.8563 0.6227 0.7507 0.7749 0.7776 0.4061 0.4692 0.2545 0.3293 0.3316 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 6 6 6 6 7 6 1 6 6 6 8 8 6 8 6 6 6 6 6 6 6 8 6 6 6 6 6 6 6 6 6 6 35 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 1.00783 12.00000 12.00000 12.00000 15.99491 15.99491 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 78.91834 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 15146.9303 27539.6968 32742.0624 0.99850 0.05462 0.00245 -0.05423 0.99513 -0.08230 -0.00693 0.08204 0.99660 1 0.00572 0.00315 0.00265 0.11915 0.06553 0.05512 15.20 23.81 28.12 35.57 42.66 57.49 67.50 76.41 90.58 94.57 111.59 129.48 141.47 177.47 180.56 209.48 219.43 234.24 250.98 275.76 285.37 302.94 310.59 340.12 350.28 362.73 370.57 383.81 395.89 402.39 451.27 467.69 498.41 507.27 519.71 530.17 559.56 576.07 623.96 658.33 673.19 678.62 710.66 718.45 771.77 798.74 850.27 868.49 893.88 924.81 948.93 980.85 1034.53 1048.62 1089.91 1129.33 1139.16 1157.74 1186.44 1224.76 1225.68 1246.04 1285.34 1293.73 1306.06 1316.88 1345.65 1362.09 1399.76 1412.17 1459.13 1463.25 1467.18 1485.60 1492.22 1501.23 1508.08 1515.80 1548.03 1554.03 1556.92 1578.18 1586.52 1599.99 1631.06 1665.99 1688.38 1695.63 1706.78 1727.60 1759.71 1764.79 1771.61 1794.06 1805.66 1825.72 1869.11 1872.51 1880.39 1883.80 1891.02 1903.28 1934.80 1947.59 1982.32 2018.91 2031.78 2032.91 2038.38 2058.73 2065.85 2087.91 2105.39 2131.71 2154.76 2172.38 2188.34 2202.23 2239.76 2242.90 2248.36 2257.71 2258.22 2262.36 2280.12 2299.15 2308.32 2344.41 2351.90 2352.76 2353.87 2356.42 2358.33 2361.91 2365.38 2366.81 2372.37 2382.82 2387.09 2404.02 2425.86 2552.20 2558.81 2580.73 2602.92 2614.62 2796.50 2824.78 4567.92 4574.78 4578.13 4589.38 4590.79 4596.14 4601.74 4605.35 4607.24 4615.97 4638.79 4638.97 4667.40 4668.80 4673.40 4676.43 4684.22 4688.75 4691.58 4718.68 4728.26 4747.26 4824.31 4849.81 4855.61 4868.79 4883.26 4887.61 4908.90 0.535712 0.566488 0.567433 0.467936 -3924.764564 -3924.733787 -3924.732843 -3924.832340 3.337146D-04 MUNgauss RevisionA2.1 retrievium 26-May-2021 DUDE CCCCN1[C@H](C(=C(C1=O)[O-])C(=O)c2ccc(c(c2)C)OCC(C)C)c3cccc(c3)Br C40094132 RHF 6-31G(d) (6D,10F) C1 498.127995 |X|Y|Z| 74.057551 53.330599 111.620976 76.108040 18 6 7 17 1 |36.858105| |12.462221|36.858105| |7.470597|12.455996|36.858105| |4.867163|7.485683|12.445038|36.858105| |3.783380|4.965011|7.663315|13.214999|53.358707| |3.274152|4.024320|5.645716|7.461070|17.804738|36.858105| |3.569598|4.278896|6.089161|6.853915|12.493771|17.515553|0.500000| |2.746327|3.202821|4.256088|5.110999|11.135337|12.528497|0.241106|36.858105| |2.746038|3.203330|4.250850|5.112413|11.103543|7.913096|0.167394|13.464574|36.858105| |3.342508|4.123993|5.848660|7.787809|19.136744|8.086802|0.173065|8.087151|12.363547|36.858105| |3.390833|4.142723|5.530174|6.764524|11.438777|5.436633|0.128410|5.410129|7.720541|15.858254|73.516695| |2.430761|2.754939|3.482562|3.982881|7.492157|5.285785|0.122552|7.884961|15.770835|7.971293|11.721680|73.516695| |2.347298|2.643389|3.317463|3.758606|6.974359|7.278924|0.176049|13.316336|7.552059|5.078542|6.942297|10.967843|36.858105| |2.073432|2.300733|2.804802|3.134780|5.555698|5.106056|0.125996|8.083054|6.412297|4.304808|6.228639|11.025152|15.700276|73.516695| |2.304362|2.553579|3.126690|3.415230|5.843699|6.228254|0.175808|7.505706|4.932562|3.937841|5.629718|7.429123|12.513649|14.592288|36.858105| |2.510771|2.725696|3.345514|3.455352|5.656042|5.834386|0.193027|6.072205|4.312253|3.706919|5.399386|6.501170|7.472596|9.814128|13.816043|36.858105| |2.322955|2.467710|2.895957|2.927557|4.507359|4.313897|0.140831|4.244884|3.285036|2.956280|4.472092|5.131635|4.974802|7.333746|7.887726|13.669970|36.858105| |2.032907|2.168282|2.483089|2.568895|3.916873|3.666880|0.112203|3.665533|2.900162|2.600967|3.984520|4.624000|4.416781|6.887690|6.820402|7.937940|13.796182|36.858105| |1.912238|2.071522|2.380476|2.543104|3.962681|3.742994|0.107956|3.906546|3.058866|2.668140|4.062077|4.912840|5.004542|8.056531|7.829364|6.847454|7.891353|13.599721|36.858105| |2.016043|2.219254|2.615109|2.866299|4.675445|4.610303|0.127044|5.186550|3.833821|3.180336|4.718371|6.070438|7.572219|11.765956|13.649241|8.016587|6.920532|7.983898|13.810311|36.858105| |1.681634|1.812726|2.034296|2.176912|3.315491|2.986714|0.084220|3.095969|2.550769|2.263376|3.522786|4.196530|3.784278|6.478896|4.986254|4.439114|5.021110|7.553338|12.621296|7.549881|36.858105| |1.867652|1.963277|2.188314|2.234413|3.306007|2.960498|0.089923|2.912821|2.405913|2.209923|3.459558|3.899868|3.359335|5.434543|4.588027|5.185468|7.869099|13.996159|8.151459|5.295014|6.935711|73.516695| |1.904027|1.963199|2.158491|2.146639|3.107611|2.713235|0.084099|2.620754|2.211845|2.075221|3.287683|3.594260|2.909395|4.699137|3.775959|4.507576|6.722059|7.971026|5.238593|3.990479|4.602659|24.233311|36.858105| |1.687832|1.729268|1.863245|1.856013|2.650411|2.254013|0.068333|2.183865|1.888795|1.787731|2.873595|3.109918|2.395010|3.961114|2.959889|3.331063|4.395335|5.191382|4.059447|3.189761|4.004384|14.261724|12.494407|36.858105| |1.521262|1.558114|1.682770|1.685660|2.430112|2.051445|0.061108|2.041064|1.785005|1.668062|2.694287|2.983091|2.274278|3.858956|2.764759|3.008317|3.800820|4.566912|3.847111|3.042072|4.018404|11.669651|7.540290|12.451083|36.858105| |1.680479|1.692750|1.796458|1.757781|2.468368|2.055482|0.062685|1.972033|1.734420|1.667547|2.709523|2.863836|2.111586|3.491611|2.529838|2.878480|3.639042|3.902382|3.147401|2.625625|3.045294|9.104376|7.611637|12.440712|7.538421|36.858105| |2.912704|3.592087|4.509545|6.093846|10.562885|12.430755|0.250375|7.395153|5.385085|5.480904|7.457067|7.261862|5.862112|7.908851|5.639664|5.014992|4.077079|3.728897|3.952788|4.770887|3.242807|5.431633|2.740241|2.309289|2.087137|2.080386|36.858105| |2.860735|3.443670|4.074583|4.965795|7.351681|7.495964|0.206918|5.177819|3.969173|4.049648|5.893710|5.699634|4.679366|6.576685|5.198914|5.015559|4.458283|4.162035|4.252528|4.713372|3.500159|6.157693|3.111423|2.604691|2.290026|2.333439|13.759217|36.858105| |2.493608|2.949181|3.281997|3.917055|5.528116|4.979044|0.134113|3.926683|3.211194|3.263341|4.961468|4.821968|3.732142|5.593313|4.116447|3.891807|3.700504|3.715032|3.904599|4.112180|3.465736|5.797808|2.913039|2.532090|2.233259|2.261476|7.884909|13.706055|36.858105| |2.262118|2.682609|2.953430|3.620221|5.162564|4.394226|0.111234|3.682062|3.132746|3.170916|4.893641|4.790706|3.497099|5.437031|3.630216|3.282892|3.070479|3.134633|3.431773|3.713613|3.184855|4.952636|2.478947|2.208148|2.001118|1.979189|6.796707|7.928285|13.811774|36.858105| |2.292153|2.758442|3.117692|4.015163|6.015426|5.009376|0.117367|4.298418|3.720252|3.750200|5.704211|5.630711|3.934565|6.142204|3.786760|3.293819|2.944910|2.943684|3.277466|3.755676|2.993529|4.558679|2.281980|2.021683|1.863197|1.819376|7.951866|6.957126|8.024626|13.733411|36.858105| |2.557845|3.135490|3.750058|5.127237|8.543444|7.498361|0.155940|6.090386|5.054352|5.085196|7.241979|7.175282|5.077447|7.510079|4.560142|3.879500|3.276039|3.144652|3.469559|4.188270|3.013921|4.719576|2.369336|2.055281|1.893897|1.853587|13.653218|7.971826|6.877845|7.881911|13.849553|36.858105| |1.952907|2.302489|2.523308|3.139616|4.601050|3.540655|0.084905|3.324569|3.115669|3.119894|5.008688|5.007291|3.124029|5.220513|2.920850|2.553622|2.323446|2.355469|2.634403|2.966944|2.522683|3.751137|1.894938|1.722447|1.620940|1.563204|4.580882|4.098897|4.609827|6.693972|9.976919|6.685837|2539.412838| |17.529526|8.757772|5.449497|4.040668|4.358553|2.819073|0.084043|2.400060|2.400894|2.869522|5.218318|3.832124|2.086861|3.315707|2.059782|2.224581|2.091305|1.859762|1.754843|1.833718|1.563444|3.076212|1.769948|1.590049|1.435244|1.593807|2.592568|2.580831|2.311227|2.116976|2.127139|2.323988|62.678938|0.500000| |17.528801|8.773294|6.767745|4.493500|4.976998|3.318726|0.104207|2.774903|2.703415|3.188372|5.571492|4.238537|2.406891|3.754109|2.415346|2.697426|2.527375|2.182564|2.017817|2.105438|1.762018|3.574624|2.076828|1.828011|1.632058|1.833445|2.943210|2.960852|2.558247|2.274807|2.271259|2.529392|65.024446|0.301448|0.500000| |17.537841|8.780750|6.779714|4.503289|4.987915|3.129367|0.093576|2.712929|2.782509|3.391158|6.294594|4.444647|2.316738|3.673455|2.240045|2.429613|2.227625|1.946574|1.838875|1.950900|1.617706|3.171453|1.814968|1.610398|1.465776|1.602071|2.720440|2.615423|2.279486|2.094005|2.150734|2.417519|63.254791|0.301413|0.301779|0.500000| |8.862367|17.494534|8.843524|6.871459|6.294842|3.954629|0.117507|3.078009|2.985290|3.719782|6.438483|4.552427|2.582356|3.982596|2.547950|2.719324|2.504485|2.222631|2.119069|2.245967|1.863343|3.602006|2.027859|1.792068|1.600288|1.754803|3.744028|3.744431|3.254948|2.917180|2.925400|3.249727|81.829891|0.212575|0.210689|0.173019|0.500000| |8.866356|17.508976|8.861165|6.898109|6.312795|3.645416|0.102896|2.993677|3.091047|4.048994|7.622272|4.807562|2.472064|3.886516|2.345360|2.446799|2.213311|1.976013|1.915433|2.061834|1.695801|3.192563|1.783282|1.586752|1.443480|1.549932|3.315575|3.111305|2.733136|2.563270|2.680749|3.022087|78.375818|0.212651|0.172992|0.210915|0.303822|0.500000| |6.841056|8.838846|17.546741|8.911714|9.559045|5.088618|0.147994|4.205119|4.473265|6.302980|11.443996|6.668498|3.271674|5.005761|3.000520|3.189777|2.735424|2.343893|2.257258|2.496641|1.934055|3.672967|2.038582|1.765546|1.613138|1.705102|3.931365|3.478607|2.854121|2.623261|2.810054|3.382787|79.806223|0.139943|0.168319|0.203050|0.173422|0.211725|0.500000| |6.856893|8.850286|17.501951|8.841305|9.487044|6.049999|0.206003|4.448080|4.167275|5.233003|8.282391|6.030234|3.541220|5.215748|3.465819|3.882206|3.356704|2.793243|2.614510|2.846797|2.195133|4.343007|2.432127|2.064280|1.842746|1.991983|4.707827|4.442798|3.464477|3.004991|3.093508|3.708554|83.395766|0.140119|0.203279|0.168948|0.211435|0.173667|0.302940|0.500000| |4.526446|6.855272|8.823162|17.553120|12.576007|7.081659|0.185472|4.662010|4.358904|5.805057|8.940003|6.159428|3.598294|5.321700|3.407974|3.445972|2.990922|2.662312|2.635518|2.929328|2.268509|4.140662|2.231850|1.934072|1.739499|1.826884|6.981552|6.042387|4.745793|4.281679|4.609594|5.712364|116.586776|0.108398|0.119252|0.111201|0.206470|0.171472|0.174050|0.210770|0.500000| |4.539299|6.861942|8.869644|17.599656|12.662867|5.646400|0.139891|4.382390|4.710878|7.368684|13.370312|6.845008|3.316386|5.098842|2.963498|2.937869|2.529180|2.265979|2.270461|2.550903|1.982796|3.549738|1.917855|1.683075|1.543478|1.599460|4.967663|4.089481|3.439252|3.331664|3.775080|4.661455|106.631118|0.108594|0.111270|0.120025|0.170431|0.207507|0.214275|0.173822|0.302516|0.500000| |2.814396|3.033445|3.844374|3.821587|6.299705|6.323655|0.227632|6.451279|4.710665|4.132071|5.982118|6.981856|6.899615|9.092544|8.953435|17.721983|8.927858|5.657428|4.939397|5.674686|3.550105|7.446956|3.913098|2.980493|2.691903|2.679239|4.857291|4.677086|3.574183|3.041988|3.099796|3.722789|82.678725|0.068021|0.084718|0.076303|0.082413|0.074642|0.103273|0.127702|0.102612|0.088780|0.500000| |2.405705|2.497625|2.888806|2.818189|4.204706|3.848317|0.128625|3.685274|2.973805|2.759098|4.249061|4.684892|4.070328|6.146575|5.642178|8.929598|17.748728|8.892840|5.613674|4.979547|4.085781|12.524568|7.474745|4.691804|3.898178|4.074238|3.582590|3.952842|3.328011|2.762579|2.632466|2.902088|71.753947|0.060178|0.074023|0.063962|0.070394|0.061622|0.075848|0.094504|0.079749|0.067667|0.216995|0.500000| |1.885244|2.085583|2.437684|2.718684|4.447039|4.230097|0.110909|4.924117|3.792630|3.100244|4.638564|6.159072|7.139333|12.633135|8.967053|5.698917|4.977812|5.663452|8.965350|17.726435|6.997335|7.595068|3.329990|2.794454|2.724915|2.332231|4.504395|4.272180|3.899095|3.738851|3.906619|4.278192|108.873898|0.047922|0.054048|0.050877|0.058525|0.054572|0.065070|0.072103|0.076989|0.068536|0.124912|0.108000|0.500000| |1.673876|1.805268|2.000320|2.139181|3.195351|2.849027|0.080850|2.847918|2.367640|2.152701|3.370852|3.870012|3.331244|5.594248|4.274212|3.973916|4.595864|6.717509|8.831940|5.866130|17.545940|12.408033|4.731050|4.288417|4.143622|3.218280|3.177393|3.566470|3.682449|3.344128|3.023180|2.956352|86.295996|0.043474|0.048791|0.044399|0.052087|0.046863|0.052332|0.059947|0.062783|0.054152|0.090445|0.107902|0.151484|0.500000| |1.621187|1.759397|1.975671|2.144702|3.292856|2.940763|0.080629|3.112521|2.591823|2.275431|3.546480|4.307219|3.836112|6.798413|4.749408|3.983892|4.180663|5.576600|8.887741|7.280657|17.579854|8.876864|3.655478|3.267352|3.315277|2.597485|3.230688|3.379006|3.396678|3.258657|3.131775|3.117970|92.052455|0.041934|0.046755|0.043466|0.050093|0.046126|0.052396|0.058449|0.061904|0.054800|0.090625|0.095980|0.223833|0.301051|0.500000| |1.580675|1.683129|1.876506|1.978279|2.990374|2.637895|0.074974|2.760498|2.326057|2.068077|3.255266|3.885585|3.347060|5.867338|4.273368|3.973860|4.597312|6.705516|8.831008|5.885234|17.542628|12.348048|4.715629|4.270083|4.628204|3.185750|2.782113|2.965296|2.915009|2.697335|2.561219|2.593935|75.315423|0.040942|0.046100|0.042452|0.047820|0.043802|0.049973|0.056221|0.056753|0.050338|0.090552|0.108062|0.152719|0.303045|0.301123|0.500000| |1.909936|1.947760|2.153912|2.113906|3.076917|2.665967|0.083071|2.622263|2.231330|2.080188|3.305440|3.652788|2.922618|4.755522|3.750699|4.611196|6.816974|7.076778|4.773040|3.821998|4.086416|16.537964|17.507647|8.836475|6.896033|6.851218|2.608673|2.877636|2.640639|2.277126|2.139696|2.255906|61.003466|0.049110|0.058066|0.051038|0.055228|0.049112|0.057189|0.067636|0.060158|0.052515|0.114096|0.229347|0.088685|0.111013|0.092840|0.119055|0.500000| |2.084386|2.148264|2.352057|2.319015|3.309480|2.892421|0.091550|2.703392|2.272712|2.170941|3.433143|3.646514|2.918824|4.615520|3.760837|4.622474|6.820963|7.093909|4.781322|3.825593|4.090074|16.576561|17.522301|8.842062|5.493976|7.084954|2.934766|3.428226|3.180309|2.634682|2.393907|2.488911|66.558666|0.053738|0.063824|0.054602|0.062233|0.053639|0.060916|0.074586|0.067652|0.057008|0.114126|0.227480|0.088630|0.119399|0.092954|0.110789|0.301094|0.500000| |1.665341|1.720715|1.843169|1.855799|2.636649|2.242517|0.067405|2.149885|1.857232|1.767357|2.840358|3.047902|2.344005|3.869657|2.882273|3.162921|4.064265|4.933599|4.050083|3.164534|4.171406|13.229650|9.005461|17.520396|8.909884|8.897789|2.352486|2.697806|2.692592|2.343815|2.108990|2.108875|61.083868|0.043767|0.049855|0.043889|0.049949|0.043984|0.048173|0.056395|0.054275|0.046846|0.078185|0.116167|0.077947|0.131679|0.094518|0.120282|0.174857|0.214345|0.500000| |1.516298|1.541636|1.669749|1.658591|2.397621|2.013766|0.060175|2.023995|1.781303|1.658765|2.686513|2.994120|2.258457|3.854124|2.723084|3.000420|3.760058|4.304776|3.601000|2.930375|3.619371|10.173109|6.795251|8.780396|17.515330|6.839485|2.010943|2.174133|2.088180|1.878082|1.771467|1.821126|52.629546|0.039650|0.045272|0.040828|0.043663|0.039658|0.044798|0.050866|0.047123|0.042215|0.075605|0.109403|0.072803|0.099662|0.084641|0.115839|0.203705|0.139969|0.173515|0.500000| |1.419266|1.449730|1.550372|1.553316|2.221705|1.852126|0.054768|1.837225|1.625422|1.529683|2.488855|2.729144|2.024365|3.457084|2.405074|2.577325|3.141947|3.676253|3.236576|2.636045|3.466861|8.746570|5.486847|8.785800|17.532061|6.874727|1.895161|2.075101|2.051861|1.858553|1.727270|1.739632|51.795756|0.037438|0.042148|0.037984|0.041435|0.037482|0.041310|0.046822|0.044590|0.039774|0.064989|0.089399|0.066962|0.101101|0.082010|0.109495|0.140440|0.123111|0.213255|0.301379|0.500000| |1.505434|1.556312|1.692662|1.715956|2.499662|2.128577|0.062759|2.142624|1.862070|1.720707|2.766196|3.117367|2.429873|4.158711|2.983553|3.159426|3.962870|5.067555|4.459894|3.405676|4.945015|13.115568|6.891339|8.783742|17.600431|5.484820|2.182437|2.382646|2.334179|2.107182|1.966829|1.993890|58.306468|0.039361|0.044595|0.040347|0.044354|0.040190|0.045103|0.051271|0.049194|0.043689|0.076912|0.107645|0.085137|0.139827|0.110206|0.169269|0.171497|0.140281|0.213180|0.301382|0.301035|0.500000| |1.797864|1.805741|1.902024|1.848861|2.566332|2.130921|0.065577|2.006970|1.763397|1.715992|2.788888|2.890000|2.115932|3.458398|2.526207|2.904800|3.647667|3.786181|3.045046|2.580643|2.890921|8.454279|6.928040|8.741386|5.473767|17.536201|2.164800|2.463153|2.386868|2.061962|1.879185|1.912637|54.474552|0.047457|0.054888|0.047223|0.052397|0.045645|0.049737|0.058927|0.053738|0.046537|0.075958|0.115521|0.063527|0.085685|0.069084|0.081623|0.168480|0.213065|0.212962|0.139483|0.140620|0.122545|0.500000| |1.547425|1.557203|1.638568|1.609127|2.250141|1.854113|0.055882|1.785072|1.586006|1.528754|2.500273|2.635270|1.905010|3.181560|2.242787|2.492679|3.046912|3.295856|2.778956|2.346456|2.773620|7.477570|5.514362|8.780976|6.899307|17.547248|1.888416|2.105327|2.071092|1.838304|1.689916|1.706319|50.087582|0.041055|0.046587|0.041041|0.044871|0.039881|0.043304|0.049961|0.046470|0.041002|0.064752|0.092146|0.058928|0.082032|0.066772|0.081182|0.140160|0.143291|0.212225|0.170158|0.206623|0.140820|0.301716|0.500000| |1.682877|1.679496|1.787924|1.732455|2.439539|2.021180|0.061853|1.957462|1.731818|1.660673|2.705866|2.873357|2.097088|3.481551|2.495134|2.873399|3.606911|3.726162|2.996718|2.545759|2.843928|8.303842|6.865793|8.760222|6.799342|17.519643|2.007935|2.216327|2.115176|1.861668|1.734582|1.786459|50.910712|0.044218|0.051160|0.044870|0.047948|0.042686|0.047525|0.055190|0.049529|0.043815|0.075391|0.114990|0.062744|0.081154|0.068036|0.083353|0.202716|0.173827|0.173246|0.201957|0.168144|0.139439|0.301279|0.301863|0.500000| |3.054034|3.590736|4.258804|4.782584|6.878322|6.976557|0.230655|4.875791|3.740159|3.819138|5.615484|5.414258|4.494768|6.281881|5.320645|5.737688|5.276310|4.656973|4.408401|4.666253|3.519159|6.852117|3.548411|2.885922|2.475222|2.599053|8.945193|17.714340|8.921427|5.650269|4.995377|5.659724|113.269052|0.075844|0.090382|0.076886|0.108843|0.087396|0.100070|0.137007|0.157207|0.107007|0.150459|0.133000|0.111891|0.099847|0.091175|0.084002|0.090890|0.112454|0.082301|0.065421|0.061728|0.070655|0.077248|0.064146|0.068609|0.500000| |2.388241|2.756959|2.979403|3.387837|4.650513|4.069135|0.114844|3.318393|2.766098|2.809560|4.360548|4.236307|3.231123|4.937666|3.666209|3.604299|3.620634|3.716522|3.782259|3.750416|3.451854|6.045462|3.079511|2.715705|2.350450|2.429651|5.625463|8.898003|17.704744|8.952091|5.680709|4.953583|130.328680|0.062198|0.068847|0.060312|0.085424|0.070595|0.072243|0.088391|0.112300|0.083388|0.091691|0.092437|0.097449|0.105690|0.091830|0.081315|0.075951|0.094918|0.081837|0.060308|0.060283|0.067759|0.072070|0.061923|0.062184|0.215403|0.500000| |2.054829|2.396497|2.571045|3.061681|4.278917|3.522278|0.091047|3.065965|2.682222|2.710487|4.286331|4.205512|2.970570|4.754472|3.094888|2.831774|2.717983|2.829408|3.093180|3.245215|2.994514|4.605981|2.318904|2.113699|1.926554|1.901056|4.914804|5.630282|8.888099|17.748926|8.896349|5.628776|220.440940|0.054127|0.057322|0.052939|0.072485|0.064201|0.064114|0.072326|0.098772|0.080029|0.072990|0.068767|0.091846|0.089015|0.085704|0.071194|0.058908|0.068033|0.062977|0.049941|0.050233|0.056355|0.054932|0.049568|0.049399|0.124001|0.214266|0.500000| |2.485544|3.034847|3.662498|5.046304|8.908720|6.977307|0.140770|6.499138|5.955082|5.884487|8.328418|8.481764|5.180304|7.968377|4.260763|3.582244|2.984542|2.846935|3.148230|3.855454|2.758826|4.292389|2.168365|1.892751|1.767484|1.716814|8.897573|5.662854|4.958088|5.626063|8.939101|17.761009|219.539634|0.062653|0.067424|0.066406|0.085010|0.082969|0.094958|0.097956|0.144355|0.134136|0.097476|0.073946|0.112160|0.073952|0.080195|0.067086|0.058138|0.062591|0.053497|0.047604|0.045220|0.051691|0.048908|0.044066|0.046336|0.124346|0.107595|0.124068|0.500000| 3923.456692 -16730.263438 5462.673491 -275.092473 -7619.225729 3691.710479 -3927.515250 2.001034 4062000000000021 44B68CBA804BA635 443649DCE98EF949 418014B7FFFFFFFD 37D5C72F9A248A00 42CE43F1CEA901FF