Version2.4 2021-05-26T05:35:19Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 02-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C=CCn1c(nnc1[S-])CC2=N[C@@H](SC2)NC(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4 C38798723 RHF 6-31G(d) (6D,7F) C=CCn1c(nnc1[S-])CC2=N[C@@H](SC2)NC(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4 C01[X(C20H23N6O3S3)] 159 C1 538 C=CCn1c(nnc1[S-])CC1=N[C@@H](SC1)NC(=O)c1ccc(cc1)S(=O)(=O)N1CCCC1 C=CCn1c(nnc1[S-])CC1=N[C@@H](SC1)NC(=O)c1ccc(cc1)S(=O)(=O)N1CCCC1 [S-]c1nnc(CC2=N[C@H](NC(=O)c3ccc(cc3)[S](=O)(=O)N4CCCC4)SC2)n1CC=C InChIKey=AQRPVMUNYUPGRP-LJQANCHMSA-M InChI=1S/C20H24N6O3S3/c1-2-9-26-17(23-24-20(26)30)12-15-13-31-19(21-15)22-18(27)14-5-7-16(8-6-14)32(28,29)25-10-3-4-11-25/h2,5-8,19H,1,3-4,9-13H2,(H,22,27)(H,24,30)/p-1/t19-/m1/s1 InChI=1/C20H24N6O3S3/c1-2-9-26-17(23-24-20(26)30)12-15-13-31-19(21-15)22-18(27)14-5-7-16(8-6-14)32(28,29)25-10-3-4-11-25/h2,5-8,19H,1,3-4,9-13H2,(H,22,27)(H,24,30)/p-1/t19-/m1/s1/fC20H23N6O3S3/h22H/q-1 C=CCn1c(nnc1[S-])CC2=N[C@@H](SC2)NC(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4 C01[X(C20H23N6O3S3)] 159 C01 538 C=CCn1c(nnc1[S-])CC1=N[C@@H](SC1)NC(=O)c1ccc(cc1)S(=O)(=O)N1CCCC1 C=CCN1C(=[N][N][C]1S)CC1=N[C@@H](SC1)NC(=O)[C]1[CH][CH][C]([CH][CH]1)S(=O)(=O)N1CCCC1 S[C]1[N]N=C(CC2=N[C@H](NC(=O)[C]3[CH][CH][C]([CH][CH]3)[S](=O)(=O)N4CCCC4)SC2)N1CC=C InChIKey=AQRPVMUNYUPGRP-LJQANCHMSA-N InChI=1S/C20H24N6O3S3/c1-2-9-26-17(23-24-20(26)30)12-15-13-31-19(21-15)22-18(27)14-5-7-16(8-6-14)32(28,29)25-10-3-4-11-25/h2,5-8,19H,1,3-4,9-13H2,(H,22,27)(H,24,30)/t19-/m1/s1 InChI=1/C20H24N6O3S3/c1-2-9-26-17(23-24-20(26)30)12-15-13-31-19(21-15)22-18(27)14-5-7-16(8-6-14)32(28,29)25-10-3-4-11-25/h2,5-8,19H,1,3-4,9-13H2,(H,22,27)(H,24,30)/t19-/m1/s1/f/h22,30H 3889.3044719908 -2514.5124262 1-A 17309.6734 129 409 538 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2.4690 4.8098 2.9227 3.1193 2.1194 1.4939 1.4051 2.8505 1.4819 1.5747 1.9006 1.1936 1.4029 1.2700 1.8481 1.5417 1.2953 1.4714 3.6652 1.6002 1.8998 2.1875 1.3709 1.4590 1.6453 1.3990 1.3843 3.2129 2.5820 1.2279 1.0979 1.1383 1.1425 2.0727 1.5899 1.1043 1.0909 2.1453 1.1033 1.9493 6.2047 9.9575 5.3745 4.3061 9.5987 10.9311 1.0714 1.0688 1.0708 1.0598 1.0633 1.0616 1.0659 1.1092 1.0986 1.0993 1.1053 1.0988 1.0777 1.0885 1.1041 1.0810 1.0879 1.0918 1.0909 1.1164 1.0946 1.0950 1.0799 0.0008 0.0007 0.0023 0.0029 0.0051 0.0056 0.0091 0.0066 0.0058 0.0125 0.0119 0.0189 0.0211 0.0320 0.0339 0.0618 0.0467 0.0869 0.1483 0.1422 0.1728 0.1563 0.2156 0.2450 0.0972 0.1958 0.1809 0.4145 0.6433 0.5834 0.2578 0.7601 0.5592 0.6710 0.2717 0.3693 0.8549 0.6747 0.5755 1.0590 0.3649 0.6020 0.4544 1.1010 0.4595 0.4623 1.4971 1.0313 1.8367 1.8725 2.0154 2.3147 1.7026 3.7392 1.9127 1.5617 1.5048 1.4871 1.4416 2.0156 1.9280 0.9057 1.7945 1.0826 0.6910 1.7175 1.1442 1.3786 1.0301 1.4824 1.4011 0.9762 1.2696 0.9561 0.9232 1.8850 1.6416 1.2834 1.4628 1.1133 0.9686 3.1062 4.2010 2.7169 3.4999 1.6711 2.8341 1.7195 1.2995 2.0993 2.2963 4.5577 2.8283 3.0351 2.1205 1.5200 1.4388 2.9254 1.5760 1.6769 2.1240 1.3446 1.6067 1.4690 2.1788 1.8668 1.5904 1.8270 4.6004 2.0242 2.4796 2.8776 1.8083 1.9396 2.2171 1.8911 1.9180 4.4814 3.6646 1.8455 1.6853 1.7768 1.8008 3.2792 2.5186 1.7673 1.7983 3.5399 1.8478 3.3760 11.3667 18.4920 10.4347 8.9749 21.2590 24.4067 6.5168 6.5055 6.5427 6.5166 6.5673 6.5761 6.6288 6.9803 6.9854 6.9970 7.0500 7.0662 6.9610 7.0881 7.2165 7.0745 7.1439 7.3920 7.4123 7.6474 7.5378 7.5500 9.5243 5.9571 1.5199 4.5658 6.7186 4.7454 1.0936 4.5579 1.2972 2.0579 0.1537 3.5407 1.6299 0.8651 0.5530 0.5839 5.4431 9.7114 8.0385 1.3213 4.5155 1.7991 1.9453 1.3091 1.8429 0.5935 6.4580 2.5220 5.4718 9.5381 10.9597 2.0561 7.5877 16.2012 4.8619 1.8492 2.5009 12.0990 6.7264 0.4989 0.8953 40.4182 6.3201 15.2186 1.6935 11.7633 1.9511 39.0464 112.0475 90.7712 6.5440 79.1285 6.5327 42.7729 3.9607 46.0312 29.4691 62.4716 17.0368 9.8470 17.8824 56.1502 5.8674 4.9091 5.6307 1.4518 25.4193 17.0392 3.9999 1.0044 13.7668 10.9037 4.6078 7.0781 4.0579 46.7477 2.1817 36.3992 12.9069 1.8566 1.8128 9.5143 7.6851 23.1621 76.9831 25.2400 3.7424 122.7288 16.4003 30.9552 22.9557 104.3753 316.2195 41.5919 1.7353 28.9372 6.8452 10.1642 15.2564 23.4677 47.3453 22.3408 6.8077 24.3397 2.8388 246.2772 9.9397 4.3719 37.6690 133.5797 44.4019 4.8640 49.1080 5.0927 27.8673 46.8234 3.0393 15.0112 63.8076 25.4238 19.3998 1.3478 12.7070 28.3718 106.0786 134.4255 1.5429 0.9323 30.2606 5.4720 621.3210 17.1647 24.4603 8.2690 2.0225 319.9399 143.5417 50.7418 32.5663 82.2767 20.5300 32.2140 65.3667 3.7841 7.2215 0.7307 14.7264 57.8130 26.7500 22.0902 17.7774 30.0775 16.2234 8.5299 2.8925 2.2081 23.7552 1.1779 0.1344 71.1772 0.7065 1.1600 1.0609 1.0821 0.4793 0.9697 4.3840 2.0705 5.5106 0.7188 2.1632 1.0022 4.2365 2.7105 1.5556 0.5983 0.9151 1.0217 1.3081 0.6975 0.6265 1.1119 0.7541 1.5782 1.4131 1.9024 1.7239 1.4012 1.6710 4.2843 1.7022 1.4616 0.4855 1.2072 3.1813 0.4830 0.5589 7.0277 4.8258 1.3539 1.3878 2.6256 1.1725 4.2715 0.7046 9.7535 0.6633 2.4829 4.0894 3.7030 7.5647 4.6175 0.6561 1.9838 18.0303 3.2524 1.9169 8.6859 5.9995 3.0829 2.9834 3.1252 1.2178 4.2800 1.6799 5.1049 3.5954 6.5223 2.8093 13.4113 7.1058 1.5164 3.3151 2.0043 2.5018 2.4837 3.1824 2.7016 0.2585 0.3116 2.8126 7.4816 7.3444 8.6200 1.3073 0.8810 8.5231 9.2861 9.8486 3.0592 4.9260 17.5542 1.5597 2.6693 3.0052 1.3278 2.1397 3.8615 5.9692 6.4705 4.3082 8.2378 3.7091 22.5698 12.6621 5.1207 20.4648 1.0849 2.7286 0.3273 7.9192 5.7734 3.8477 6.4906 14.3090 4.6198 5.3120 40.6613 0.8232 16.2765 18.5443 21.7118 20.7402 18.3909 9.0626 11.3181 2.4966 0.9583 10.8976 2.4071 1.9003 37.3519 75.1296 30.5454 31.1473 8.6223 133.1538 66.0607 97.1789 22.9013 198.4370 142.6814 133.9669 80.1071 82.2539 105.0887 69.1360 90.2462 34.4019 109.5772 68.3949 107.8207 50.9831 40.7097 50.3540 66.7814 71.6152 68.0166 28.1265 0.7500 0.7366 0.6824 0.7469 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0.3627 0.6472 0.3021 0.2118 0.7957 0.4716 0.2869 0.4316 0.7888 0.2375 0.1731 0.2250 0.8246 0.5342 0.8222 0.6709 0.5533 0.8322 0.4233 0.6971 0.2627 0.2358 0.5285 0.6705 0.7983 0.3395 0.2574 0.2338 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 6 6 6 7 6 7 7 6 16 6 6 7 6 1 16 6 7 6 8 6 6 6 6 6 6 16 8 8 7 6 6 6 6 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 14.00307 12.00000 14.00307 14.00307 12.00000 31.97207 12.00000 12.00000 14.00307 12.00000 1.00783 31.97207 12.00000 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 15.99491 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 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 11525.4270 22600.7742 29214.6587 0.99996 -0.00856 -0.00117 0.00853 0.99972 -0.02218 0.00135 0.02217 0.99975 1 0.00752 0.00383 0.00296 0.15659 0.07985 0.06178 20.99 21.80 33.65 40.18 49.90 63.25 66.45 74.01 83.77 98.12 100.53 123.67 133.73 152.27 176.24 200.20 215.30 242.39 275.38 294.50 307.19 342.68 358.22 365.96 403.19 417.59 471.71 492.08 542.11 550.18 552.56 562.08 582.21 586.32 621.52 658.18 708.24 710.78 721.22 757.35 770.19 791.80 812.35 855.49 898.33 920.83 923.01 956.13 987.66 994.42 1005.38 1094.76 1134.81 1139.79 1145.63 1179.88 1204.99 1221.98 1231.96 1240.09 1254.16 1340.39 1347.22 1382.97 1390.88 1396.55 1403.60 1415.51 1434.46 1447.38 1465.14 1468.96 1504.33 1525.84 1546.58 1581.31 1584.24 1592.78 1609.66 1621.06 1631.09 1680.33 1691.38 1695.95 1705.42 1716.09 1745.32 1773.73 1785.18 1795.09 1807.69 1824.64 1843.89 1848.93 1874.89 1890.69 1896.72 1898.89 1933.06 1934.33 1981.55 1989.44 2005.99 2015.93 2035.23 2062.64 2077.00 2088.69 2100.00 2108.17 2141.43 2149.84 2152.80 2161.18 2175.89 2179.26 2206.35 2213.72 2233.11 2297.99 2322.30 2341.90 2353.29 2357.67 2359.20 2371.25 2406.58 2407.78 2425.78 2466.80 2537.03 2554.38 2611.80 2706.07 2789.54 2800.85 4622.85 4624.41 4633.36 4648.01 4658.47 4665.13 4674.47 4702.30 4726.46 4728.99 4733.95 4753.36 4763.94 4783.29 4792.06 4795.13 4803.42 4877.36 4885.98 4905.88 4918.85 4921.90 5566.51 0.461322 0.489936 0.490880 0.395934 -2514.051104 -2514.022490 -2514.021546 -2514.116492 3.184504D-04 MUNgauss RevisionA2.1 retrievium 26-May-2021 DUDE C=CCn1c(nnc1[S-])CC2=N[C@@H](SC2)NC(=O)c3ccc(cc3)S(=O)(=O)N4CCCC4 C38798723 RHF 6-31G(d) (6D,10F) C1 491.099379 |X|Y|Z| 103.929291 70.570653 39.090762 65.939464 25 6 7 16 17 6 2 |36.858105| |14.461827|36.858105| |7.627882|12.630040|36.858105| |5.403385|7.717580|13.179758|53.358707| |4.250130|5.826812|7.510514|18.953179|36.858105| |3.547574|4.454086|5.337248|11.953697|14.940667|53.358707| |3.652231|4.375419|5.338246|11.915951|8.893490|18.946412|53.358707| |4.565541|5.573047|7.551074|18.724547|8.736066|11.964197|19.938863|36.858105| |4.463712|4.758458|5.943561|9.423413|4.930944|6.690377|9.438104|10.949714|388.023441| |3.822842|5.190343|6.038671|10.164334|12.680725|10.558009|7.210202|5.229900|25.774869|36.858105| |3.442394|4.480412|5.590597|8.273945|7.633732|7.503243|5.863172|4.449748|23.759623|12.537860|36.858105| |3.018086|3.755987|4.829878|7.476495|6.559684|7.294677|5.921544|4.390478|23.881426|7.913303|15.233900|53.358707| |2.745613|3.283674|4.150112|5.843717|4.559320|5.315153|4.696735|3.598714|21.325058|5.151025|8.370028|18.090470|36.858105| |2.380136|2.782075|3.378546|4.827408|3.830046|4.702808|4.178833|3.107688|18.779028|4.298971|6.235817|12.391047|17.677070|0.500000| |2.825365|3.348565|3.972554|5.071731|3.847748|4.363809|3.885146|3.046977|18.661534|4.634937|7.207269|9.694881|10.256716|0.219281|388.023441| |3.406272|4.305155|4.979648|6.343585|5.101337|5.351281|4.515890|3.539083|20.476651|7.235088|12.575820|10.857321|7.265975|0.155976|74.825211|36.858105| |2.834267|3.324822|4.397606|6.123649|4.369108|5.209131|4.927266|3.924365|24.289511|4.379074|6.051751|11.422784|13.267134|0.256389|48.622181|5.304945|53.358707| |2.510812|2.831198|3.577292|4.820833|3.370364|4.160685|4.069821|3.238237|21.447816|3.351404|4.293278|7.257496|7.713129|0.194337|39.381510|4.099708|19.246145|36.858105| |2.247873|2.504396|3.033947|4.044862|2.894295|3.597408|3.472899|2.715944|18.063696|2.976907|3.801272|6.201114|6.710558|0.191040|39.540004|3.833565|11.547893|15.841849|73.516695| |2.505665|2.751627|3.478885|4.679177|3.130760|3.961184|4.074354|3.308804|23.417480|2.952644|3.513818|5.647602|5.055265|0.128658|28.439699|3.306032|10.873129|12.665802|14.195778|36.858105| |2.374113|2.531876|3.085289|3.997770|2.650884|3.352768|3.470227|2.836432|20.897426|2.525769|2.936599|4.482871|3.924141|0.101489|24.711307|2.886622|7.308822|7.646052|11.503231|13.734668|36.858105| |2.296464|2.390371|2.857849|3.713948|2.429723|3.125564|3.318155|2.723828|21.108750|2.267404|2.538464|3.794161|3.142986|0.081768|20.093473|2.472475|5.539997|5.055805|7.854791|7.934053|13.757043|36.858105| |2.324259|2.416227|2.907927|3.895925|2.526112|3.319647|3.626382|2.976039|23.930215|2.289855|2.501837|3.758340|2.992615|0.077850|18.510222|2.362983|5.259054|4.468220|6.716448|6.896882|7.956988|13.732985|36.858105| |2.423312|2.579118|3.191740|4.468304|2.906455|3.879334|4.297834|3.496629|27.565052|2.575885|2.812032|4.343511|3.396239|0.088065|19.827167|2.560800|6.171138|5.029682|7.141350|7.925716|6.856039|7.898770|13.737480|36.858105| |2.527289|2.773312|3.540264|5.017225|3.322208|4.354249|4.660418|3.764011|27.257059|2.984640|3.396082|5.492350|4.461417|0.114315|24.279499|3.039386|9.009316|7.557783|9.539151|13.701454|7.923179|6.864454|7.972129|13.789215|36.858105| |2.145318|2.167923|2.509909|3.359689|2.182104|2.910506|3.224772|2.626256|22.052778|1.969881|2.087497|3.057048|2.362490|0.061981|15.078881|1.983431|3.910580|3.157712|4.976893|4.200276|4.722059|6.929126|10.716886|6.967995|4.740707|388.023441| |1.958026|1.990802|2.287751|3.152973|2.085613|2.843959|3.172213|2.515898|20.909863|1.874000|1.964404|2.897153|2.208447|0.058774|13.870726|1.840461|3.596607|2.857661|4.538135|3.673667|3.858236|5.032258|7.338059|6.306193|4.346797|94.640078|73.516695| |1.986326|1.987652|2.254973|2.961005|1.942688|2.567038|2.789801|2.260512|18.525745|1.790005|1.907585|2.764890|2.164666|0.057159|14.230544|1.851952|3.513194|2.882825|4.703015|3.697788|4.444300|6.563087|7.370342|4.944528|3.830006|94.515401|13.601000|73.516695| |2.439151|2.412543|2.773076|3.662481|2.313841|3.075415|3.482063|2.914069|26.188250|2.050706|2.128270|3.054104|2.301957|0.059361|14.891009|2.017806|3.760480|2.904114|4.531883|3.696139|3.978657|5.229702|7.004728|5.671935|4.179102|83.764793|13.782259|13.758895|53.358707| |2.580903|2.556794|2.943981|4.012012|2.509232|3.402129|3.989557|3.351250|32.308294|2.163246|2.192734|3.139369|2.297985|0.059064|14.626261|2.033791|3.715177|2.761434|4.262939|3.408536|3.419598|4.113709|5.450234|5.340615|4.048617|50.005355|11.541980|8.815387|17.577186|36.858105| |2.847300|2.716148|3.021171|3.999874|2.464362|3.303818|3.871774|3.316852|33.313503|2.124956|2.117010|2.955190|2.138410|0.054562|13.996857|1.987400|3.373193|2.462446|3.850035|2.913208|2.946346|3.412039|4.081744|3.949533|3.286138|34.757293|7.791829|7.152101|11.146133|12.497065|36.858105| |3.185090|2.988494|3.337205|4.178837|2.531220|3.286327|3.751237|3.294581|31.803817|2.217725|2.245962|3.105049|2.282719|0.057556|15.286213|2.153692|3.628926|2.672349|4.175602|3.172164|3.313856|3.856181|4.357810|3.995118|3.419122|34.954583|7.091817|7.657708|10.986451|7.983439|12.445391|36.858105| |2.690556|2.597688|2.942351|3.717609|2.314620|3.007588|3.359132|2.869789|25.719941|2.072999|2.154626|3.031703|2.293942|0.058470|15.326662|2.086229|3.708748|2.848590|4.484839|3.520892|3.907569|4.963536|5.630762|4.569614|3.724495|50.443586|8.831427|11.476595|17.614695|7.792409|7.873827|12.411521|36.858105| |17.699690|9.103542|5.470958|5.872092|3.651703|4.269782|4.330818|3.773528|26.185953|3.404011|3.042290|3.628089|2.436676|0.059625|18.082919|3.059728|3.366097|2.217318|3.587864|2.200928|2.104010|2.042940|2.060614|2.132866|2.212011|13.714910|3.154764|3.208900|2.963033|2.294164|2.539109|2.800156|2.392902|0.500000| |17.711965|9.107593|6.937342|6.804469|3.830445|4.481736|4.794077|4.501687|34.746753|3.375746|3.148037|3.886180|2.655817|0.064192|19.160149|3.101627|3.845544|2.551174|4.034459|2.616031|2.514701|2.477472|2.522807|2.597029|2.653863|16.758354|3.775601|3.870989|3.741323|2.910976|3.308923|3.819377|3.107327|0.288682|0.500000| |9.192649|17.649078|8.609696|9.219950|6.029920|6.190078|5.693632|4.914337|28.352957|5.884924|4.723901|5.154515|3.232137|0.076797|23.851200|4.570064|4.267794|2.653048|4.239368|2.520395|2.308815|2.162377|2.176196|2.330482|2.527660|13.902482|3.229398|3.205908|2.910381|2.259149|2.369877|2.559234|2.271152|0.219533|0.173960|0.500000| |6.010092|8.915857|17.545227|12.519909|6.836563|6.542077|6.154454|5.762722|33.174851|6.490272|6.940213|7.792434|5.044962|0.109159|36.069811|6.592206|7.094285|4.100794|6.178166|3.791728|3.333401|2.977952|2.938053|3.201128|3.678193|17.579821|3.977857|3.998689|3.616929|2.738483|2.751694|3.077462|2.824601|0.129594|0.152998|0.204706|0.500000| |7.279820|8.931388|17.671894|12.732202|5.707583|6.199144|6.730350|7.287581|50.713585|4.609277|4.504867|5.701704|3.814202|0.087681|25.617179|4.126946|5.857095|3.652172|5.433567|3.749078|3.383116|3.208002|3.303881|3.589949|3.868640|20.310731|4.540359|4.512581|4.423635|3.461929|3.602960|4.110973|3.516972|0.143367|0.218988|0.171866|0.302758|0.500000| |3.216512|4.115442|4.556969|7.673886|9.122732|10.247002|6.714141|4.493097|22.786056|17.594521|8.908326|9.341625|4.595169|0.113393|28.849849|5.784198|5.241882|3.029726|4.876958|2.674945|2.296218|2.074028|2.104665|2.371623|2.727879|12.998152|3.132209|2.958435|2.567658|1.995211|1.949306|2.004875|1.886549|0.081859|0.079962|0.129365|0.131912|0.103022|0.500000| |4.242858|5.920465|6.053938|8.884448|8.816625|8.107621|6.112926|4.615112|24.033911|17.535534|8.894374|7.916286|4.329291|0.101965|30.872098|7.152486|5.106097|2.992133|4.815876|2.669354|2.347466|2.125945|2.128923|2.344050|2.660347|13.215401|3.123949|3.034745|2.656780|2.048300|2.048519|2.158960|2.003021|0.107003|0.099912|0.208694|0.180070|0.125550|0.302062|0.500000| |3.063696|3.770826|4.071484|5.323239|4.420334|4.842874|4.050606|3.086064|18.033136|6.435892|8.898787|8.462696|5.649491|0.134972|55.918520|17.563565|5.727010|3.425748|5.885118|2.817625|2.504912|2.177703|2.087804|2.246883|2.618170|12.681648|2.967936|2.981224|2.464311|1.827697|1.794010|1.927052|1.867071|0.078779|0.076871|0.115333|0.138571|0.095279|0.157810|0.188513|0.500000| |4.052387|5.247336|5.866121|6.734422|5.041564|5.175238|4.495549|3.654405|21.515074|6.632481|8.831202|8.271569|5.644488|0.123779|55.649563|17.601192|6.430168|3.792223|6.234575|3.197830|2.862999|2.488545|2.374023|2.535991|2.947133|14.316606|3.287182|3.354316|2.833706|2.095961|2.082253|2.290442|2.190872|0.099991|0.100448|0.154737|0.230260|0.131206|0.141732|0.204073|0.302481|0.500000| |3.163761|3.767280|5.304496|7.643817|5.175451|6.089543|5.912624|4.881165|29.545343|4.798277|6.246788|11.320230|9.217227|0.186375|40.169845|5.100973|26.037870|9.373262|10.856330|7.643003|5.167386|4.141773|4.121126|5.037153|7.387899|21.801357|5.006014|4.778329|4.117237|3.057136|2.769626|2.969148|2.970441|0.075230|0.088171|0.096494|0.170545|0.146240|0.114014|0.112197|0.111770|0.131842|0.500000| |2.281279|2.425402|2.894106|3.685360|2.477180|3.104148|3.156322|2.562627|18.577131|2.422317|2.849272|4.281993|3.843850|0.100478|25.735406|2.901354|6.762474|7.133415|12.476893|8.943563|17.741496|8.898720|5.648188|4.945304|5.647520|27.710872|5.769102|6.915362|4.604879|2.926064|2.609085|2.961154|3.445746|0.056665|0.066596|0.062005|0.088431|0.086600|0.061279|0.063278|0.070396|0.080010|0.126792|0.500000| |2.162769|2.214833|2.578837|3.309250|2.175489|2.798579|2.959009|2.419195|18.857871|2.050254|2.274336|3.337333|2.745768|0.071978|18.220117|2.254482|4.628745|4.114032|6.752968|5.638769|8.889422|17.761719|8.934237|5.639200|4.951142|47.103469|8.350864|13.642381|6.838016|3.797581|3.257121|3.746171|5.029568|0.053999|0.065050|0.055831|0.074422|0.080094|0.052309|0.054084|0.055798|0.063537|0.095131|0.213259|0.500000| |2.356009|2.495245|3.046917|4.393721|2.872542|3.945924|4.496839|3.593386|29.118177|2.496702|2.650078|4.063518|3.062177|0.080065|17.888184|2.377054|5.316126|4.097491|5.994799|5.644407|4.947351|5.629012|8.894462|17.765754|8.939817|47.230623|12.502554|8.067909|7.807506|6.046061|4.210355|3.959969|4.344851|0.057886|0.070096|0.062857|0.082763|0.094718|0.064547|0.063000|0.058560|0.065379|0.122069|0.107468|0.124115|0.500000| |2.538369|2.839057|3.658044|5.487597|3.737961|5.018903|5.358242|4.185555|28.614307|3.297498|3.732355|6.282389|4.873570|0.125675|24.805452|3.186492|9.665620|6.954244|8.895326|8.873057|5.633401|4.949020|5.670796|8.974614|17.735502|27.915352|6.752844|5.713314|4.921905|3.703224|3.066339|3.103143|3.235489|0.061778|0.072879|0.072742|0.104701|0.107732|0.084535|0.079556|0.076331|0.084201|0.231983|0.124083|0.107519|0.216828|0.500000| |2.784972|2.821992|3.359904|4.690955|2.888098|3.933407|4.717951|4.030299|40.233479|2.436330|2.469133|3.572792|2.588562|0.065947|16.081520|2.246805|4.260725|3.109702|4.684700|3.881436|3.714695|4.319683|5.874044|6.492422|4.869034|44.790647|10.546197|7.854157|12.162006|17.576515|8.866644|6.840443|6.381257|0.067751|0.086626|0.068889|0.086067|0.110836|0.062067|0.063242|0.055572|0.064035|0.099969|0.086556|0.105710|0.215236|0.125525|0.500000| |2.289161|2.275930|2.581418|3.585537|2.299687|3.172531|3.708873|3.011618|27.894504|1.994766|2.012325|2.892714|2.112150|0.055021|13.396242|1.861185|3.367021|2.509937|3.927481|3.051740|3.044718|3.624935|4.758994|4.755768|3.636070|45.699405|12.636453|8.226148|12.334896|17.657316|8.672057|5.698371|5.766900|0.057342|0.070518|0.056757|0.067065|0.082006|0.051769|0.052380|0.046901|0.052834|0.075972|0.073145|0.094074|0.156947|0.094406|0.299655|0.500000| |3.083261|2.925570|3.223373|4.342570|2.647766|3.585143|4.304697|3.723125|40.047547|2.239777|2.186342|3.027615|2.147368|0.054589|14.001667|2.028780|3.347048|2.387694|3.722701|2.760416|2.715584|3.032527|3.571986|3.634647|3.136128|28.375722|6.643627|5.910768|7.911121|8.776937|17.611286|8.706669|5.648652|0.076170|0.099780|0.070606|0.079457|0.106650|0.057070|0.060041|0.050960|0.059177|0.077123|0.067229|0.079394|0.109214|0.083720|0.221178|0.195440|0.500000| |2.526526|2.391307|2.595905|3.439902|2.167920|2.921586|3.372354|2.814588|26.759913|1.898339|1.889438|2.630563|1.911215|0.049252|12.638182|1.788959|2.972460|2.188348|3.479280|2.557088|2.622009|3.043686|3.562945|3.376670|2.835629|31.788887|7.350289|6.889206|9.502560|8.846807|17.533166|8.786834|6.761359|0.063887|0.080584|0.058813|0.066421|0.083802|0.048817|0.051129|0.045296|0.051938|0.066685|0.065504|0.082828|0.099804|0.073760|0.174725|0.218292|0.299768|0.500000| |3.787599|3.571827|4.116733|5.016609|2.930384|3.737464|4.293688|3.925728|39.237415|2.529833|2.561117|3.520440|2.567836|0.063672|17.139383|2.442155|4.122966|2.973577|4.561838|3.510073|3.572352|3.999406|4.455480|4.265083|3.782882|32.076398|6.582808|6.916963|8.973155|6.895826|8.887961|17.580523|8.802164|0.089463|0.129500|0.082703|0.103487|0.148980|0.062557|0.068317|0.059916|0.072857|0.095745|0.088133|0.104377|0.115294|0.095841|0.193686|0.138831|0.220139|0.174332|0.500000| |3.190881|2.899139|3.107889|3.826333|2.342594|3.027845|3.407631|2.961883|27.600507|2.080897|2.093345|2.853845|2.094866|0.052981|14.341450|2.036259|3.259496|2.393761|3.805726|2.760814|2.905140|3.305195|3.570414|3.275499|2.898713|28.427468|5.934259|6.644716|7.949590|5.679492|8.667307|17.570781|8.723930|0.079350|0.107668|0.069198|0.079728|0.104366|0.052376|0.057058|0.051045|0.060645|0.073092|0.074134|0.091589|0.089800|0.074011|0.138149|0.125703|0.196106|0.215575|0.301339|0.500000| |2.427029|2.320048|2.560576|3.238136|2.052681|2.676749|2.956236|2.480537|21.638600|1.863770|1.932931|2.705726|2.053063|0.052856|13.921760|1.891159|3.256180|2.515934|4.052261|3.034899|3.415041|4.288597|4.633315|3.763711|3.143403|43.551538|8.008486|11.522177|12.378849|6.010265|6.396101|8.687344|17.599540|0.061063|0.077199|0.057038|0.068744|0.083005|0.047474|0.050376|0.047505|0.055121|0.071198|0.086291|0.127657|0.100336|0.076878|0.135488|0.138204|0.132338|0.176736|0.174664|0.220092|0.500000| |2.788183|2.723481|3.136009|3.876633|2.408269|3.078460|3.383111|2.907654|25.125768|2.182781|2.312665|3.261134|2.514883|0.063632|16.956348|2.266967|4.130313|3.233019|5.068479|4.068776|4.734517|6.145380|6.353902|4.895995|4.110808|47.987763|8.140729|11.568487|12.196203|5.988042|5.753331|8.722367|17.577424|0.068328|0.089017|0.065947|0.085573|0.104609|0.054754|0.058570|0.055858|0.066340|0.091266|0.115736|0.175473|0.121301|0.096338|0.154048|0.129042|0.127842|0.137304|0.224176|0.191337|0.302004|0.500000| 2512.029119 -13733.932686 5070.380132 -252.293787 -6403.817222 3889.304752 -2514.512470 2.000989 40CE540000000004 4504FF00EAF36909 4484EA16D41F49BF 421B2C38787FFFFF B80A22391F5F0C07 442BB585C7C3A759