Version2.4 2021-05-25T21:30:06Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 20-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(=O)N1CCN(CC1)C(=O)CSc2nc3cc(ccc3c(=O)n2CCCOC)C(=O)[O-] C13233852 RHF 6-31G(d) (6D,7F) CC(=O)N1CCN(CC1)C(=O)CSc2nc3cc(ccc3c(=O)n2CCCOC)C(=O)[O-] C01[X(C21H25N4O6S1)] 165 C1 534 COCCCn1c(SCC(=O)N2CCN(CC2)C(=O)C)nc2c(c1=O)ccc(c2)C(=O)[O-] COCCCn1c(SCC(=O)N2CCN(CC2)C(=O)C)nc2c(c1=O)ccc(c2)C(=O)[O-] COCCCN1C(=O)c2ccc(cc2N=C1SCC(=O)N3CCN(CC3)C(C)=O)C([O-])=O InChIKey=YYHGRVZHYGZRNQ-UHFFFAOYSA-M InChI=1S/C21H26N4O6S/c1-14(26)23-7-9-24(10-8-23)18(27)13-32-21-22-17-12-15(20(29)30)4-5-16(17)19(28)25(21)6-3-11-31-2/h4-5,12H,3,6-11,13H2,1-2H3,(H,29,30)/p-1 InChI=1/C21H26N4O6S/c1-14(26)23-7-9-24(10-8-23)18(27)13-32-21-22-17-12-15(20(29)30)4-5-16(17)19(28)25(21)6-3-11-31-2/h4-5,12H,3,6-11,13H2,1-2H3,(H,29,30)/p-1/fC21H25N4O6S/q-1 CC(=O)N1CCN(CC1)C(=O)CSc2nc3cc(ccc3c(=O)n2CCCOC)C(=O)[O-] C01[X(C21H25N4O6S1)] 165 C01 534 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1601.4762 1610.6215 1624.5170 1632.3433 1636.9159 1640.5892 1640.7823 1645.3318 1646.0461 1647.0348 1653.5300 1656.4126 1659.3319 1659.9712 1685.1621 1751.1330 1798.6272 1816.8916 1917.7949 1924.8987 1931.4479 1941.6518 3150.1969 3171.4022 3180.3654 3182.4929 3193.1921 3194.6028 3206.0063 3211.6117 3220.3685 3240.7854 3276.5898 3280.8266 3283.2637 3292.8296 3294.4913 3325.9060 3336.2232 3336.9548 3337.6509 3342.3030 3355.2271 3358.7268 3387.7563 3420.0705 3425.6204 6.7801 5.1261 5.0404 7.1579 5.4461 4.6946 10.8986 4.0920 2.6106 5.5165 7.7031 5.0196 2.9364 3.7732 7.0630 6.1727 2.9880 2.6554 3.5186 3.9909 5.0030 1.1543 3.9762 1.6439 3.6568 8.0911 2.5907 2.4574 6.9938 5.3053 7.4435 6.3627 6.3366 3.7732 1.9592 5.1900 4.1102 4.3445 3.5227 2.6096 4.2401 4.3163 8.1481 3.6920 5.9551 6.1024 2.5974 6.1262 3.2160 3.6690 8.0570 2.9260 4.6916 9.5098 3.1515 5.7619 5.5998 1.1601 4.1914 3.6523 11.5073 6.1143 5.5788 1.9755 1.6388 2.0170 1.8207 2.8482 2.9012 4.6285 2.0172 1.4767 4.3901 2.4208 1.8454 5.5235 1.3141 2.5369 2.3146 1.7883 3.6702 1.9180 1.7752 2.1238 1.7725 2.1332 2.0504 3.4072 1.3353 3.2158 1.1064 2.6808 2.5093 1.5961 1.6785 1.2091 1.8761 2.3752 2.0148 2.2414 2.6862 1.8390 1.3826 1.6545 1.1151 2.8923 1.5082 1.2811 10.1591 1.8543 1.3019 1.3617 1.3821 1.3512 1.4775 5.0525 1.4344 1.4228 1.6625 2.7039 1.1549 1.0758 1.1882 1.6891 1.4398 1.0486 1.0899 1.1244 1.1257 1.0809 1.0740 1.1072 1.0999 8.7443 6.3270 11.1731 11.7948 11.5024 12.5238 10.4267 1.0525 1.0419 1.1052 1.0756 1.0751 1.0738 1.0733 1.1051 1.0406 1.0627 1.0707 1.1019 1.0608 1.0983 1.0979 1.0918 1.1031 1.1061 1.1008 1.0924 1.0920 1.0927 1.0904 1.0938 1.0919 0.0004 0.0013 0.0017 0.0026 0.0034 0.0033 0.0163 0.0096 0.0069 0.0180 0.0374 0.0254 0.0168 0.0245 0.0573 0.0580 0.0389 0.0371 0.0549 0.0742 0.1042 0.0316 0.1165 0.0583 0.1315 0.3878 0.1292 0.1431 0.4151 0.3270 0.4816 0.4202 0.5369 0.3577 0.2117 0.5859 0.4823 0.5299 0.5059 0.3929 0.6798 0.6945 1.3894 0.7078 1.2338 1.3601 0.6054 1.4713 0.7894 0.9568 2.1453 0.8390 1.4008 3.0337 1.1302 2.0698 2.0421 0.4601 1.7258 1.6011 5.1713 2.8393 2.6896 1.0060 0.8402 1.1325 1.0248 1.7167 1.7894 2.9052 1.2693 0.9671 2.9875 1.6810 1.3216 4.0515 0.9798 1.9205 1.7872 1.4304 2.9640 1.5658 1.4571 1.7525 1.5460 1.8936 1.8515 3.3396 1.3147 3.1788 1.1237 2.7486 2.5785 1.6916 1.8006 1.3098 2.0475 2.6454 2.2595 2.5645 3.1269 2.1672 1.6708 2.0197 1.3748 3.6007 1.9039 1.7092 13.7864 2.5268 1.8096 1.8965 1.9596 1.9377 2.1416 7.3425 2.1448 2.1429 2.5121 4.1327 1.7957 1.6889 1.8758 2.6785 2.2838 1.6725 1.7398 1.7971 1.8134 1.7473 1.7424 1.7976 1.8404 15.7985 12.0595 21.7311 25.5591 25.1105 27.5266 23.1602 6.1539 6.1742 6.5867 6.4187 6.4588 6.4565 6.5000 6.7158 6.3584 6.5761 6.7729 6.9879 6.7377 7.0162 7.0211 7.1155 7.2337 7.2570 7.2250 7.1896 7.2432 7.2628 7.3732 7.5378 7.5495 0.0416 2.1285 2.3885 0.4595 1.6262 3.6239 1.0146 2.2873 2.7191 3.5738 6.3343 8.8272 1.3805 3.4283 0.7113 6.1204 2.2570 1.7547 3.1485 5.0550 4.1771 0.5906 6.4894 3.7399 4.0657 3.1708 16.2543 4.7679 1.5320 8.0232 2.2302 0.9851 9.7019 4.7630 0.3695 3.3556 17.3597 5.9727 0.2341 0.0840 3.1640 2.5068 14.3383 39.3255 1.4405 6.4213 19.8515 12.1009 6.5208 6.2171 8.9847 27.8992 8.6665 0.8696 5.8470 9.3928 12.2695 6.2196 22.2618 91.0154 138.6121 2.9079 3.4848 2.1737 0.1173 22.5479 11.0220 0.7427 0.2738 16.9743 11.0582 13.0691 19.3980 59.6315 49.9006 2.7858 0.0552 9.6726 47.3141 5.9330 10.4775 8.6760 2.3057 20.3171 19.9110 83.6623 10.5796 183.9133 1.1347 104.3658 0.7293 3.2975 37.2137 491.4027 45.0302 99.0619 105.9491 8.8814 125.0964 0.3235 14.6711 101.8126 9.8698 66.2373 13.5005 164.8830 8.5661 0.1213 696.9261 55.9156 10.7618 27.6730 10.5286 18.8524 0.0634 66.5574 92.7459 241.6805 452.0558 79.7852 13.5298 10.9883 0.2039 18.6911 10.0002 2.6550 11.0887 4.1452 10.1446 10.7884 13.8709 0.3886 1.2237 142.4223 45.5352 535.5778 656.0946 449.4375 460.2960 355.2515 30.9761 100.4644 57.7518 24.6653 6.9772 43.6854 111.0817 95.3977 7.4354 15.6941 21.9599 18.6612 22.8941 25.4745 61.8019 39.3024 19.2641 0.0709 12.0609 12.9704 5.0333 2.9356 7.4299 6.2889 1.4060 0.4835 0.4667 1.1151 0.9532 1.4576 1.2745 1.1309 0.3540 0.1807 1.5927 0.6715 0.2406 0.0539 0.1301 1.2305 0.2975 0.9443 0.2360 0.4559 1.9614 0.6647 0.1444 1.1044 0.5504 1.4500 4.7106 0.0469 0.1999 1.6435 1.7871 2.5161 2.2449 1.0193 0.2347 0.6581 1.2292 0.7970 0.6873 0.3713 2.2774 3.2421 0.8589 0.9118 0.1201 2.1877 0.4813 0.3053 2.6403 1.8636 2.0691 0.5561 0.7419 5.0402 1.4366 15.5494 1.9844 5.4356 1.2565 5.7817 2.5851 12.6022 0.5078 26.8410 1.7123 2.4068 1.3785 2.3867 1.7629 3.6226 18.7152 0.9305 2.0584 4.3977 0.0652 5.1165 2.9133 0.0487 8.7286 8.8293 1.1784 15.8998 4.8452 1.3479 4.4872 3.2228 2.9044 3.6111 20.0550 4.9831 4.7877 8.8104 5.3626 0.8254 6.4079 16.6369 6.7820 1.4376 20.6370 7.7724 23.8202 7.5526 26.7892 3.0039 2.4978 34.5915 94.0013 10.3155 1.8821 34.5576 29.0771 3.8754 0.8573 0.2478 4.1740 4.8621 15.3363 4.7507 1.9135 3.4201 6.5273 13.8277 24.2289 2.1183 17.8044 17.2937 22.6474 0.9481 40.7806 2.4258 13.3668 6.9820 11.1394 12.7512 98.6687 90.0361 154.5664 24.2069 8.8114 0.4523 13.0972 11.1278 146.6591 50.2543 71.6539 148.6902 49.8748 10.4840 65.3438 90.7674 56.4912 84.6430 44.7853 31.0243 32.0612 113.9305 107.5266 26.8011 19.7835 80.9370 100.2442 46.1028 46.5897 57.9729 129.1390 61.1459 0.7471 0.7451 0.7444 0.7399 0.7436 0.7467 0.7495 0.7455 0.7494 0.7470 0.7282 0.7498 0.5977 0.7493 0.7494 0.7260 0.2530 0.6785 0.6988 0.0511 0.2167 0.7484 0.7473 0.3951 0.5300 0.2780 0.5189 0.6186 0.7337 0.4998 0.6187 0.6938 0.5097 0.1622 0.1977 0.3558 0.5726 0.7402 0.2979 0.7127 0.1501 0.7496 0.4078 0.7465 0.1470 0.2806 0.5879 0.1892 0.7390 0.6022 0.6096 0.2179 0.3948 0.5356 0.1375 0.6964 0.1688 0.6787 0.5300 0.7498 0.1887 0.7487 0.2305 0.7209 0.4519 0.7175 0.7459 0.4412 0.7452 0.2038 0.7209 0.7497 0.6279 0.7085 0.1781 0.6063 0.7209 0.6461 0.4951 0.7385 0.2083 0.5833 0.5908 0.1027 0.3950 0.6280 0.5744 0.2574 0.7489 0.6878 0.7498 0.7052 0.7328 0.6942 0.6666 0.6961 0.4266 0.2492 0.6918 0.3394 0.3911 0.2472 0.7319 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0.7368 0.7428 0.1863 0.5664 0.7715 0.7297 0.4094 0.8564 0.8150 0.8570 0.8271 0.8458 0.8195 0.8000 0.8208 0.5981 0.3990 0.8179 0.5068 0.5623 0.3964 0.8452 0.5017 0.7864 0.2788 0.7963 0.8553 0.2457 0.8313 0.8044 0.6811 0.4592 0.8569 0.5693 0.8546 0.8435 0.5746 0.5424 0.8478 0.8549 0.8532 0.8509 0.5053 0.6633 0.8541 0.8489 0.6720 0.8059 0.7380 0.6747 0.8465 0.8462 0.5013 0.7643 0.3816 0.3308 0.4794 0.8142 0.5608 0.3250 0.0634 0.7331 0.3254 0.3647 0.4257 0.4304 0.8533 0.0313 0.1523 0.1996 0.8559 0.1437 0.7861 0.6546 0.4600 0.6533 0.8568 0.7938 0.4800 0.4737 0.4721 0.6121 0.3949 0.3725 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 6 6 8 7 6 6 7 6 6 6 8 6 16 6 7 6 6 6 6 6 6 6 8 7 6 6 6 8 6 6 8 8 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 15.99491 14.00307 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 15.99491 12.00000 31.97207 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 15.99491 15.99491 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 15506.3756 28228.7973 42247.0099 0.99973 -0.02301 0.00116 0.02302 0.99972 -0.00524 -0.00104 0.00526 0.99999 1 0.00559 0.00307 0.00205 0.11639 0.06393 0.04272 14.78 30.09 34.29 35.85 46.93 49.68 72.52 90.85 96.46 107.01 130.63 133.22 141.94 151.17 168.88 181.69 213.95 221.54 234.19 255.56 270.55 310.21 320.86 352.86 355.44 410.36 418.63 452.37 456.65 465.33 476.78 481.69 545.64 577.16 616.17 629.77 642.10 654.61 710.35 727.32 750.51 751.89 774.02 820.75 853.20 884.93 904.92 918.58 928.66 957.19 967.23 1003.70 1024.22 1058.69 1122.49 1123.44 1131.94 1180.49 1202.77 1241.07 1256.55 1277.31 1301.50 1337.61 1342.09 1404.54 1406.25 1455.22 1472.07 1485.05 1486.88 1516.95 1546.28 1561.98 1586.29 1605.35 1618.52 1630.86 1647.10 1676.40 1684.45 1693.62 1698.24 1702.74 1750.58 1766.03 1781.18 1855.71 1859.89 1863.62 1889.05 1897.98 1900.10 1929.68 1941.40 1950.92 1958.17 1978.16 1985.01 2005.00 2022.33 2034.84 2060.56 2071.00 2081.26 2091.41 2106.00 2165.07 2183.57 2188.08 2209.94 2212.11 2231.94 2244.66 2256.68 2259.63 2292.07 2300.40 2304.17 2317.33 2337.32 2348.58 2355.16 2360.44 2360.72 2367.27 2368.29 2369.72 2379.06 2383.21 2387.41 2388.33 2424.57 2519.49 2587.82 2614.10 2759.28 2769.50 2778.92 2793.60 4532.43 4562.94 4575.84 4578.90 4594.29 4596.32 4612.73 4620.79 4633.39 4662.77 4714.28 4720.38 4723.88 4737.65 4740.04 4785.24 4800.08 4801.13 4802.14 4808.83 4827.42 4832.46 4874.23 4920.72 4928.70 0.490644 0.520145 0.521089 0.424171 -1873.880209 -1873.850708 -1873.849764 -1873.946682 3.250646D-04 MUNgauss RevisionA2.1 retrievium 25-May-2021 DUDE CC(=O)N1CCN(CC1)C(=O)CSc2nc3cc(ccc3c(=O)n2CCCOC)C(=O)[O-] C13233852 RHF 6-31G(d) (6D,10F) C1 461.149482 |X|Y|Z| 122.664818 90.087063 23.899785 64.159182 19 6 7 16 14 4 1 |36.858105| |12.550767|36.858105| |8.072965|15.861376|73.516695| |7.715460|13.969798|15.076342|53.358707| |6.522174|7.628567|9.443840|17.856244|36.858105| |4.556022|5.199302|7.295841|10.616903|12.511753|36.858105| |3.751565|4.574902|6.938963|9.203927|7.799396|13.125889|53.358707| |3.924427|5.253512|8.419034|10.582465|6.627234|7.823634|17.801975|36.858105| |4.994304|7.836325|12.421453|17.815708|7.821291|6.637026|10.597971|12.502175|36.858105| |2.986025|3.456255|5.447869|6.240406|5.292186|7.867074|19.033737|7.587735|5.199341|36.858105| |2.782928|3.073503|4.810250|5.336471|4.784434|7.024574|11.552684|5.294810|4.110216|15.846335|73.516695| |2.557842|2.991946|4.942408|5.131887|3.955685|5.020681|10.585653|6.553666|4.582216|12.552127|14.238474|36.858105| |2.105239|2.361590|3.929866|3.857271|3.041215|3.709381|6.482214|4.056446|3.220664|6.995581|11.944263|10.527735|388.023441| |1.883643|2.127681|3.641577|3.377150|2.541382|2.937147|5.020285|3.506880|2.881469|4.643311|7.500988|7.014290|75.825787|36.858105| |1.952940|2.246272|3.902590|3.557080|2.592894|2.947368|5.138665|3.834337|3.134001|4.479044|6.831188|6.960393|51.365677|15.103018|53.358707| |1.760424|2.010946|3.552518|3.100689|2.225523|2.457434|4.106232|3.149981|2.698988|3.392366|5.333841|4.648036|34.329056|8.327291|18.625761|36.858105| |1.777147|2.050537|3.690778|3.117672|2.178122|2.355438|3.901773|3.137292|2.749527|3.068401|4.762418|4.012950|26.915577|5.370699|10.793405|13.672125|36.858105| |1.598742|1.822022|3.306227|2.714409|1.894407|2.017672|3.239803|2.587868|2.340968|2.510838|3.993565|3.111774|21.497522|4.058296|7.066591|7.912737|13.816789|36.858105| |1.453253|1.631885|2.938045|2.422888|1.718133|1.833860|2.900035|2.252496|2.046723|2.280482|3.712968|2.783850|20.336681|3.878346|6.225520|6.869900|7.934504|13.562599|36.858105| |1.442785|1.610278|2.864890|2.412113|1.738689|1.877599|2.975345|2.253638|2.023218|2.398547|3.955401|2.962871|22.932490|4.622978|7.015431|7.888857|6.852605|7.891757|13.889204|36.858105| |1.572216|1.764437|3.108911|2.687036|1.954183|2.145543|3.472810|2.595789|2.274564|2.879270|4.712458|3.723322|30.051914|6.999353|10.703832|13.687628|7.903640|6.834195|7.942011|13.602986|36.858105| |1.530546|1.697055|2.953198|2.595587|1.928893|2.140859|3.428148|2.469696|2.157464|2.924853|4.945479|3.721946|33.688569|7.894107|9.192452|7.752563|5.097269|4.489558|5.097529|7.662496|13.084957|36.858105| |1.402111|1.537671|2.676566|2.328021|1.737420|1.912372|2.993175|2.144707|1.904842|2.522408|4.356234|3.064909|27.401969|5.439688|6.445199|5.313816|3.994024|3.775517|4.483673|6.611277|8.051283|15.809806|73.516695| |1.664425|1.847711|3.173966|2.873971|2.172351|2.465271|4.013546|2.799889|2.389064|3.586609|6.123764|4.732891|50.250420|13.802099|11.059885|6.974595|4.619008|3.818947|3.962646|5.134298|7.904929|13.616340|15.036146|53.358707| |1.584390|1.729717|2.944509|2.679105|2.066640|2.351330|3.709133|2.509250|2.169739|3.338254|6.033789|4.059759|45.268620|7.612144|7.044907|4.540325|3.408724|2.965635|3.109723|3.874939|5.086097|7.832466|12.755125|17.706371|36.858105| |1.546636|1.678186|2.852521|2.587822|2.011519|2.240842|3.480609|2.340011|2.080475|3.082408|5.647960|3.597935|37.219842|5.644146|5.774018|3.818733|3.005002|2.669844|2.803679|3.413012|4.225773|5.889614|10.409938|10.402660|12.469909|36.858105| |1.449487|1.548892|2.621263|2.367900|1.860269|2.065097|3.110366|2.070890|1.863007|2.714578|5.137390|2.992750|29.298613|4.043141|4.395105|2.952725|2.435962|2.213816|2.323964|2.749140|3.220277|4.185708|7.826756|6.772779|7.570835|12.541000|36.858105| |1.405011|1.493349|2.529465|2.267719|1.784028|1.942778|2.889674|1.931045|1.773434|2.469887|4.662705|2.665478|24.509050|3.364555|3.828152|2.610823|2.212415|2.035379|2.130879|2.471866|2.814730|3.472439|6.484479|5.331311|5.107049|8.031999|13.633906|73.516695| |1.317701|1.385194|2.343269|2.085992|1.646833|1.783926|2.600648|1.737556|1.608917|2.189669|4.176939|2.300953|20.417003|2.751698|3.210136|2.207291|1.912193|1.779133|1.858981|2.120855|2.360527|2.827757|5.314866|4.243554|3.926522|5.215497|8.146899|24.385458|36.858105| |1.575601|1.798852|3.318706|2.631721|1.804993|1.888580|2.983644|2.434974|2.262669|2.243810|3.568908|2.678351|17.893181|3.133103|5.240943|4.966652|7.480802|12.254971|7.415341|4.965612|4.387464|3.285817|5.148335|3.987441|2.395995|2.203488|1.880732|3.121848|1.560397|36.858105| |1.714714|1.984102|3.704129|2.894884|1.949510|2.025668|3.216751|2.701414|2.527920|2.369480|3.714273|2.811293|18.013313|3.057451|5.182085|4.580399|6.887383|8.106089|5.254958|3.999356|3.821931|2.973114|4.625046|3.763228|2.280213|2.102649|1.804489|3.003337|1.506360|15.499817|73.516695| |1.434523|1.618012|2.984087|2.343762|1.617617|1.683900|2.615821|2.104534|1.978777|1.967895|3.178510|2.301407|15.716276|2.705774|4.334342|4.006219|5.293286|8.113615|6.859343|4.592053|3.827716|2.972966|4.825054|3.555955|2.189489|2.034096|1.759973|2.940572|1.481128|15.501954|15.155077|73.516695| |17.568417|8.789852|10.951594|9.369533|6.499741|4.872446|5.195024|3.872586|4.562906|3.048170|5.125727|2.566693|15.109301|1.880947|2.634678|1.737574|1.742297|1.565744|1.428879|1.424897|1.556528|1.523898|2.485141|2.265480|1.593550|1.545517|1.456050|2.495985|1.321222|1.535378|2.957208|2.488128|0.500000| |17.559859|8.802454|11.066111|9.204615|6.617865|4.438220|4.935174|3.634262|4.580659|2.944180|4.963681|2.505290|14.872621|1.858246|2.598993|1.718807|1.721916|1.551060|1.418687|1.415619|1.544236|1.513382|2.472451|2.245736|1.581838|1.560453|1.468777|2.549286|1.347832|1.520340|2.921011|2.468136|0.301289|0.500000| |17.647451|9.037656|13.883525|7.774154|4.790607|3.651108|4.288483|3.363046|4.197597|2.583511|4.292261|2.275550|13.519776|1.730716|2.452561|1.645735|1.675218|1.522374|1.385068|1.367253|1.476775|1.431561|2.341471|2.098627|1.466354|1.432294|1.344999|2.323265|1.229360|1.515483|2.936745|2.465927|0.299965|0.300284|0.500000| |5.467075|6.216903|8.342470|12.398103|17.497282|8.887081|9.454828|5.770589|6.956274|5.180724|8.490983|3.948728|22.027881|2.580709|3.557229|2.241788|2.179541|1.897038|1.728364|1.756388|1.977352|1.961421|3.145101|3.013264|2.114787|2.095745|1.935638|3.336202|1.726757|1.798542|3.433925|2.870259|0.142731|0.168431|0.117571|0.500000| |7.742127|7.208602|8.822201|12.403573|17.660280|8.940321|7.710721|4.965037|5.661918|4.282037|7.299324|3.303469|18.987833|2.252749|3.101988|1.985999|1.945606|1.715623|1.569509|1.588418|1.768959|1.755298|2.840159|2.671272|1.890630|1.845755|1.732107|2.965903|1.557665|1.644075|3.140981|2.643543|0.235696|0.228866|0.149713|0.301898|0.500000| |3.928518|4.190940|6.055076|7.687121|8.863776|17.691000|12.553165|5.689871|4.972845|7.685265|14.954004|4.776914|27.082209|2.911036|3.856259|2.359517|2.222597|1.915623|1.765945|1.828973|2.095261|2.131026|3.410135|3.375910|2.423209|2.331708|2.180065|3.652279|1.896507|1.777960|3.347011|2.838760|0.117268|0.110759|0.089416|0.217588|0.212212|0.500000| |4.577115|5.075184|7.213899|9.467652|8.888556|17.497513|12.423476|6.983454|5.791989|6.321436|10.313077|4.433042|24.003289|2.741012|3.765380|2.339187|2.261312|1.951880|1.774306|1.808314|2.050598|2.038419|3.251469|3.164126|2.218434|2.084793|1.934781|3.216375|1.673410|1.840787|3.517375|2.926470|0.144467|0.117978|0.103189|0.174264|0.218852|0.301108|0.500000| |3.284812|4.259837|7.236623|7.697922|4.968129|5.661045|12.361732|17.673856|8.939876|7.152038|8.774054|7.765806|31.904729|4.077427|6.396983|3.774213|3.799789|3.025060|2.573657|2.561382|2.991123|2.781685|4.214196|4.284864|2.729029|2.521509|2.182808|3.598303|1.799481|2.809513|5.598361|4.228576|0.089003|0.085840|0.080701|0.129851|0.109189|0.127491|0.142380|0.500000| |3.899331|5.110577|8.343258|9.402087|5.763308|6.971440|12.409217|17.512151|8.875452|6.178141|8.301604|5.471901|25.982551|3.224217|4.794088|2.962569|2.985780|2.497111|2.175526|2.163414|2.464356|2.338407|3.635089|3.567802|2.360883|2.171130|1.941754|3.201277|1.634102|2.378234|4.708704|3.670095|0.110468|0.096925|0.094162|0.132584|0.129598|0.142894|0.205504|0.302261|0.500000| |4.752094|7.624002|14.739483|12.533263|5.691800|4.981226|7.681521|8.868474|17.691827|4.185335|6.056257|3.940650|20.436270|2.678793|4.042597|2.632379|2.761157|2.378702|2.056009|1.999367|2.214936|2.067666|3.254603|3.057172|2.024429|1.933904|1.732119|2.933846|1.501236|2.353812|4.765435|3.651370|0.118699|0.116970|0.117314|0.142540|0.127612|0.109436|0.130557|0.212033|0.217833|0.500000| |4.430062|6.349562|10.376449|12.405480|6.957343|5.764580|9.417122|8.881506|17.506887|5.076462|7.224870|4.611644|23.437733|2.963295|4.375812|2.767995|2.803605|2.384937|2.091321|2.073884|2.336600|2.219695|3.481509|3.346953|2.230893|2.177109|1.937109|3.310078|1.679234|2.290593|4.519725|3.562907|0.110082|0.120132|0.105259|0.204137|0.142087|0.129673|0.132836|0.219208|0.174188|0.301442|0.500000| |2.507136|2.952861|4.959998|4.975497|3.673024|4.629346|9.360553|6.720073|4.487411|8.844709|11.011593|17.641131|56.652112|6.691051|10.050037|4.982021|4.415679|3.357383|2.941453|3.083327|3.857918|3.719396|5.410293|6.208246|3.802216|3.255246|2.733732|4.302711|2.112706|2.893225|5.458602|4.365457|0.070323|0.066973|0.062545|0.098261|0.086511|0.118135|0.120913|0.232977|0.170018|0.111650|0.119429|0.500000| |2.581982|3.075317|5.156298|5.258487|3.925492|4.608654|9.499051|6.603146|4.945902|8.835992|10.926464|17.648481|56.652028|6.695204|9.997761|4.970582|4.393298|3.347390|2.939344|3.086066|3.862562|3.732634|5.434463|6.225803|3.817585|3.530262|2.889601|4.684220|2.257621|2.881877|5.426993|4.353359|0.070467|0.070649|0.064084|0.112418|0.089939|0.119504|0.110836|0.239562|0.144115|0.118510|0.147047|0.304787|0.500000| |1.941827|2.279367|4.138050|3.479905|2.381873|2.563757|4.312204|3.616118|3.151515|3.299144|4.988708|4.312258|26.622977|4.902952|9.860641|8.883281|17.772577|8.992695|5.651540|4.945748|5.629708|4.141630|5.939740|5.469522|3.082204|2.751757|2.268673|3.692524|1.810350|7.012911|13.915117|8.642567|0.052656|0.051882|0.050787|0.065757|0.058559|0.066015|0.068420|0.125790|0.095472|0.089272|0.088631|0.135343|0.134086|0.500000| |1.358721|1.516144|2.741148|2.227624|1.576902|1.668960|2.601326|2.020757|1.862553|2.023885|3.322935|2.409771|17.531406|3.191131|4.951472|4.954657|5.675476|8.961523|17.763088|8.908423|5.630414|4.122834|6.846251|4.481946|2.703913|2.483319|2.108395|3.477702|1.728218|7.012688|8.638569|13.967367|0.037085|0.036856|0.036173|0.044040|0.040292|0.044704|0.045036|0.063256|0.054541|0.052275|0.052779|0.070382|0.070343|0.124985|0.500000| |1.343031|1.484704|2.634894|2.211996|1.605762|1.729661|2.701340|2.021738|1.830199|2.178727|3.653317|2.627973|20.779576|4.001891|5.693768|5.637577|4.942904|5.608320|8.906731|17.733809|8.922230|7.100033|13.043161|6.385581|3.783168|3.391296|2.785530|4.465982|2.167279|4.047321|5.917983|7.037881|0.036915|0.036723|0.035428|0.045138|0.041046|0.047173|0.046357|0.062810|0.054079|0.050116|0.052111|0.075058|0.075189|0.107426|0.212114|0.500000| |1.659565|1.805349|3.045458|2.818077|2.203310|2.560923|4.029764|2.657424|2.262204|3.732214|6.962423|4.443895|54.026711|7.230904|6.687974|4.090133|3.165852|2.726839|2.784913|3.337149|4.277517|5.805695|9.317774|12.460999|17.627005|8.800371|6.892162|8.374351|3.795845|2.249206|3.868463|3.640476|0.046707|0.045997|0.042433|0.062259|0.056045|0.074229|0.067265|0.079195|0.069751|0.058074|0.064025|0.114566|0.110464|0.081782|0.067816|0.089355|0.500000| |1.466830|1.591916|2.723680|2.437617|1.867753|2.108776|3.271406|2.245141|1.959234|2.866797|5.179671|3.396794|34.370220|5.805675|5.965194|4.123789|3.180182|2.860128|3.085777|3.902211|4.875330|7.635584|14.767109|12.650621|17.669270|8.855751|6.909887|8.389393|3.801612|2.321448|3.880991|3.827958|0.041064|0.040576|0.037937|0.052743|0.047903|0.060150|0.055984|0.067394|0.059541|0.051308|0.055550|0.091277|0.088996|0.079085|0.075549|0.110100|0.303947|0.500000| |1.468882|1.596175|2.736308|2.438990|1.871927|2.052200|3.179341|2.184800|1.969199|2.742678|4.920841|3.212762|30.760405|5.068228|5.519625|3.877908|3.069544|2.789998|3.006979|3.736041|4.511210|6.364644|12.158483|9.515833|8.885086|17.592227|8.925356|12.961784|4.858942|2.286073|3.822944|3.785422|0.040569|0.041137|0.038007|0.054221|0.047793|0.058667|0.053214|0.065820|0.056414|0.051375|0.057466|0.082214|0.089979|0.076717|0.074252|0.105649|0.173630|0.213587|0.500000| |1.664132|1.813410|3.066044|2.823391|2.213146|2.463439|3.864724|2.560569|2.280421|3.472840|6.374068|4.056121|42.517678|5.926716|6.073055|3.846415|3.055105|2.664335|2.724269|3.227360|4.019098|5.170617|8.519637|9.400920|8.823701|17.567078|8.932272|13.051841|4.871402|2.216186|3.810210|3.602363|0.046013|0.046877|0.042568|0.064865|0.055934|0.071563|0.062620|0.076727|0.064861|0.058230|0.067145|0.097926|0.112606|0.079152|0.066821|0.086802|0.210094|0.173589|0.302023|0.500000| |1.504935|1.600384|2.687758|2.458661|1.956038|2.199842|3.285597|2.146703|1.916907|2.907380|5.666988|3.125957|31.176348|3.959445|4.282405|2.803818|2.332640|2.100751|2.170005|2.524711|2.967236|3.745719|6.753545|6.275414|6.905050|8.823289|17.461558|16.568507|7.312834|1.800987|3.103500|2.983755|0.042243|0.042401|0.038623|0.056382|0.050744|0.065394|0.057278|0.062150|0.056048|0.049152|0.055042|0.078755|0.081863|0.061200|0.054708|0.070115|0.206548|0.170811|0.173787|0.212217|0.500000| |1.355394|1.444545|2.456454|2.191160|1.707650|1.890525|2.830215|1.908942|1.719968|2.434448|4.566460|2.684201|25.491965|3.663341|4.069441|2.813362|2.337520|2.159716|2.304063|2.745518|3.146690|4.126257|8.177105|6.294113|6.898075|8.834619|17.470913|16.561280|7.323423|1.837248|3.109171|3.084515|0.037893|0.038001|0.035108|0.048954|0.044410|0.055071|0.049764|0.055872|0.050274|0.044798|0.049312|0.069751|0.071771|0.060014|0.058551|0.078953|0.170517|0.206818|0.213348|0.173952|0.301171|0.500000| |1.241808|1.304314|2.215362|1.954185|1.531971|1.659741|2.416751|1.629810|1.507292|2.021422|3.827422|2.135740|18.812184|2.596877|3.050830|2.130292|1.850853|1.739779|1.836885|2.103552|2.311358|2.780190|5.362277|4.070740|3.766728|4.737718|7.220863|16.470110|17.491160|1.526976|2.605930|2.593343|0.034645|0.035140|0.032304|0.044290|0.040367|0.048717|0.043623|0.046948|0.042910|0.039313|0.043439|0.055275|0.058008|0.048411|0.047718|0.060490|0.100058|0.106220|0.126825|0.116975|0.176130|0.218004|0.500000| |1.286051|1.348001|2.284015|2.019628|1.592146|1.703192|2.468320|1.657329|1.553285|2.051100|3.888385|2.139862|18.436034|2.496635|2.970721|2.058008|1.806666|1.691375|1.763127|1.989558|2.187201|2.560587|4.785394|3.776444|3.336922|4.355548|5.863580|16.908294|17.606960|1.496342|2.572392|2.533846|0.035684|0.036686|0.033405|0.046632|0.041940|0.050204|0.044266|0.047578|0.043190|0.040332|0.045262|0.054544|0.059032|0.047708|0.045806|0.056445|0.089151|0.089266|0.117640|0.118078|0.147918|0.147998|0.299779|0.500000| |1.353944|1.415696|2.380542|2.137042|1.704058|1.857950|2.682576|1.770412|1.634552|2.269108|4.410941|2.338971|20.780955|2.695078|3.136041|2.124820|1.847347|1.707421|1.765483|1.997563|2.235675|2.652358|4.889687|4.063171|3.766141|4.732003|7.220376|16.468992|17.489339|1.505093|2.601251|2.531071|0.037883|0.038536|0.034983|0.049572|0.044960|0.055456|0.048436|0.050486|0.046337|0.042155|0.047200|0.059441|0.062948|0.049002|0.045535|0.056181|0.106048|0.100187|0.116638|0.126671|0.217644|0.176560|0.299641|0.299759|0.500000| 1872.218763 -10981.128953 4178.747142 -219.678163 -5149.841211 3275.470302 -1874.370909 2.001150 3D4A400000000023 44D3B937B81C676F 4454C75724FD43E1 419735F0A3FFFFFA C008000000000000 4318FD7B52C2DF87