Version2.1 2020-12-29T01:40:32Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 21-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@@H](C(=O)Nc1ccc(cc1)NC(=O)C)Oc2c(=O)c3ccccc3oc2c4ccccc4 C40167752 RHF 6-31G(d) (6D,7F) C[C@@H](C(=O)Nc1ccc(cc1)NC(=O)C)Oc2c(=O)c3ccccc3oc2c4ccccc4 C01[X(C26H22N2O5)] 159 C1 539 CC(=O)Nc1ccc(cc1)NC(=O)[C@@H](Oc1c(oc2c(c1=O)cccc2)c1ccccc1)C CC(=O)Nc1ccc(cc1)NC(=O)[C@@H](Oc1c(oc2c(c1=O)cccc2)c1ccccc1)C C[C@H](OC1=C(Oc2ccccc2C1=O)c3ccccc3)C(=O)Nc4ccc(NC(C)=O)cc4 InChIKey=LQINWKFOLFKFBS-INIZCTEOSA-N InChI=1S/C26H22N2O5/c1-16(26(31)28-20-14-12-19(13-15-20)27-17(2)29)32-25-23(30)21-10-6-7-11-22(21)33-24(25)18-8-4-3-5-9-18/h3-16H,1-2H3,(H,27,29)(H,28,31)/t16-/m0/s1 InChI=1/C26H22N2O5/c1-16(26(31)28-20-14-12-19(13-15-20)27-17(2)29)32-25-23(30)21-10-6-7-11-22(21)33-24(25)18-8-4-3-5-9-18/h3-16H,1-2H3,(H,27,29)(H,28,31)/t16-/m0/s1/f/h27-28H C[C@@H](C(=O)Nc1ccc(cc1)NC(=O)C)Oc2c(=O)c3ccccc3oc2c4ccccc4 C01[X(C26H22N2O5)] 159 C01 539 CC(=O)Nc1ccc(cc1)NC(=O)[C@@H](Oc1c(oc2c(c1=O)cccc2)c1ccccc1)C CC(=O)N[C]1[CH][CH][C]([CH][CH]1)NC(=O)[C@@H](OC1=C(O[C]2[C]([CH][CH][CH][CH]2)C1=O)[C]1[CH][CH][CH][CH][CH]1)C C[C@H](OC1=C(O[C]2[CH][CH][CH][CH][C]2C1=O)[C]3[CH][CH][CH][CH][CH]3)C(=O)N[C]4[CH][CH][C]([CH][CH]4)NC(C)=O InChIKey=LQINWKFOLFKFBS-INIZCTEOSA-N InChI=1S/C26H22N2O5/c1-16(26(31)28-20-14-12-19(13-15-20)27-17(2)29)32-25-23(30)21-10-6-7-11-22(21)33-24(25)18-8-4-3-5-9-18/h3-16H,1-2H3,(H,27,29)(H,28,31)/t16-/m0/s1 InChI=1/C26H22N2O5/c1-16(26(31)28-20-14-12-19(13-15-20)27-17(2)29)32-25-23(30)21-10-6-7-11-22(21)33-24(25)18-8-4-3-5-9-18/h3-16H,1-2H3,(H,27,29)(H,28,31)/t16-/m0/s1/f/h27-28H 3115.9442005117 -1480.6468672 1-A 21871.4465 116 423 539 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.65817 -20.59587 -20.55849 -20.52167 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8.97968
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2.0980 1.8863 2.2670 2.0421 3.8013 2.2497 1.1534 1.1797 2.7441 2.6139 2.3400 1.8834 2.8805 3.1630 1.9859 4.3344 2.3036 2.2170 1.3851 1.3388 1.3052 1.5771 4.0869 1.2639 2.0727 1.5864 2.1633 1.0459 1.0651 1.0477 1.1053 3.1027 2.5150 2.2214 2.1129 2.5442 6.1946 2.1043 5.7386 5.2625 3.3821 4.1006 5.4429 9.9298 12.7765 7.8051 8.6680 1.0368 1.0390 1.0842 1.1048 1.1018 1.1024 1.1042 1.0895 1.0875 1.0953 1.0889 1.0918 1.0960 1.0927 1.0955 1.0963 1.0960 1.0944 1.0912 1.0945 1.0799 1.0781 0.0010 0.0006 0.0008 0.0024 0.0027 0.0048 0.0079 0.0096 0.0121 0.0157 0.0160 0.0253 0.0300 0.0657 0.0768 0.0852 0.1138 0.1464 0.1470 0.0578 0.2514 0.1329 0.2498 0.3026 0.3204 0.3848 0.4243 0.5204 0.5834 0.5137 0.5771 0.5684 0.3561 0.4138 0.5829 0.6602 0.7469 0.2201 1.3193 1.1564 0.8165 0.5315 0.7481 1.9542 1.5792 1.4851 0.6666 1.8920 1.7078 1.7151 1.7130 2.0090 0.3928 2.1492 0.6576 1.3708 1.3672 1.8427 0.8564 0.8207 1.1991 2.0902 2.3606 0.7099 2.5274 0.6844 1.6929 0.8196 0.8274 4.1361 2.4246 3.3538 0.9068 0.9511 4.0545 4.3528 0.9725 0.9950 1.8775 0.9865 1.2203 1.5538 1.0505 1.0137 1.5923 1.9039 1.4056 1.4632 2.0708 2.1417 1.8431 1.6798 2.0224 1.8356 3.6159 2.1672 1.1648 1.2073 2.8537 2.7433 2.4696 2.0005 3.0977 3.4601 2.2691 5.0690 2.8002 2.7091 1.7506 1.7282 1.7520 2.1763 5.8184 1.8046 3.0146 2.3143 3.3114 1.6107 1.6718 1.6462 1.7402 4.9486 4.0209 3.6565 3.5527 4.3889 11.4592 3.9146 10.7198 10.1349 6.5682 7.9837 10.7153 19.6710 27.4193 17.6632 19.7572 6.3557 6.3941 6.7427 7.0827 7.0773 7.0908 7.1804 7.1603 7.2499 7.3191 7.3011 7.3348 7.4177 7.3985 7.4724 7.4851 7.5224 7.5769 7.6673 7.7488 9.2372 9.6229 1.8338 2.2952 5.4880 1.2476 1.0225 0.0037 2.3685 2.9330 0.3889 4.8002 0.8879 1.2056 0.7779 0.7558 2.6043 0.4879 12.4975 0.3982 4.7706 1.4388 3.5091 0.8244 7.7217 3.5175 3.2710 0.5321 2.3774 16.0268 18.1676 0.2560 7.9488 1.2921 0.1556 0.1594 1.3251 2.3829 12.4261 104.8852 7.6101 7.7588 7.6756 7.2964 1.7494 0.5606 6.9410 7.8608 0.3087 10.1835 16.0784 21.6559 4.6408 10.2364 70.8389 10.4102 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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 1 6 8 7 6 6 6 6 6 6 7 6 8 6 8 6 6 8 6 6 6 6 6 6 8 6 6 6 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 12.00000 12.00000 1.00783 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 15.99491 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 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
8529.7851 32486.4672 38894.7925 0.99997 0.00725 0.00376 -0.00727 0.99997 0.00351 -0.00373 -0.00354 0.99999 1 0.01015 0.00267 0.00223 0.21158 0.05555 0.04640 17.20 23.71 38.52 46.54 60.76 68.91 78.85 88.56 104.71 114.78 132.93 144.21 191.73 215.59 243.50 280.40 311.68 316.12 381.49 392.31 407.21 432.23 460.17 471.91 478.94 529.25 542.50 582.46 602.62 618.27 640.93 652.78 662.37 701.87 725.89 736.25 785.89 788.75 814.77 839.06 848.78 853.91 906.62 969.61 976.13 978.38 1013.98 1023.90 1029.71 1047.76 1061.63 1083.10 1098.75 1109.92 1135.21 1143.79 1225.97 1232.67 1250.27 1268.91 1287.02 1325.56 1331.49 1336.99 1382.02 1388.25 1405.56 1413.56 1422.42 1485.05 1513.50 1527.03 1531.38 1560.64 1571.20 1591.35 1599.19 1600.59 1617.16 1619.99 1625.64 1626.59 1631.41 1635.94 1674.22 1683.84 1711.92 1742.15 1752.61 1756.86 1768.89 1770.40 1777.14 1828.16 1839.76 1883.61 1896.24 1911.47 1920.23 1925.63 1931.81 1943.84 1960.48 2003.65 2027.04 2066.63 2072.05 2107.24 2129.68 2171.73 2201.92 2236.53 2239.77 2260.53 2263.93 2319.09 2326.18 2348.38 2349.59 2351.93 2367.23 2370.08 2404.84 2430.58 2461.90 2549.40 2556.59 2561.88 2601.26 2612.14 2615.44 2629.99 2638.22 2745.94 2819.77 2829.90 4640.94 4650.03 4674.53 4746.07 4750.69 4753.77 4779.91 4805.32 4839.65 4845.39 4853.58 4858.37 4876.28 4877.43 4895.39 4897.83 4910.70 4932.03 4968.55 4987.51 5482.19 5600.10 0.465508 0.491715 0.492659 0.404259 -1480.181359 -1480.155152 -1480.154208 -1480.242608 2.964951D-04
MUNgauss RevisionA2.0 retrievium 29-Dec-2020 DUDE C[C@@H](C(=O)Nc1ccc(cc1)NC(=O)C)Oc2c(=O)c3ccccc3oc2c4ccccc4 C40167752 RHF 6-31G(d) (6D,10F) C1 442.152872 |X|Y|Z| 130.133173 64.772305 27.226632
61.224291 26 6 7 8 23 1 2
|36.858105| |12.566227|36.858105| |8.876593|17.572649|0.500000| |7.526861|12.402944|0.248742|36.858105| |6.924932|7.987326|0.175537|15.875280|73.516695| |5.103849|7.899258|0.196648|14.125695|14.917900|53.358707| |3.806292|5.031737|0.131311|7.668307|11.543703|18.429072|36.858105| |3.113995|4.010370|0.109706|5.175521|7.888048|10.867349|13.695085|36.858105| |2.582487|3.140306|0.085969|3.906057|6.400330|7.077592|7.914428|13.821927|36.858105| |2.466960|2.894869|0.078030|3.665336|6.390154|6.161101|6.794817|7.908603|13.702603|36.858105| |2.772689|3.219522|0.084845|4.307505|7.941967|6.952208|7.894976|6.899210|7.979688|13.729940|36.858105| |3.472750|4.189889|0.107623|6.266027|11.586913|10.480947|13.721605|7.976885|6.909222|7.904333|13.733054|36.858105| |2.087883|2.383207|0.064717|2.884856|5.093576|4.615712|4.519949|5.188445|7.961814|13.482194|7.693710|5.104830|53.358707| 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|4.210600|6.087159|0.197992|5.258811|7.040986|8.502337|4.712988|4.720384|3.566299|2.966357|2.967281|3.544479|3.368949|2.135437|3.672330|1.884878|12.408099|8.128201|15.775971|73.516695| |3.539036|4.306965|0.133799|3.485387|5.119808|4.970457|3.009930|3.013754|2.508349|2.183810|2.183166|2.494987|2.599743|1.698122|2.936097|1.539941|9.144259|7.709296|12.982553|14.385410|36.858105| |2.911165|3.475640|0.109018|2.995428|4.500130|4.381818|2.777608|2.881435|2.450397|2.116075|2.074714|2.319178|2.552511|1.662977|2.848681|1.523860|6.908086|5.036751|7.602211|11.805136|13.602391|36.858105| |2.489356|2.838221|0.087087|2.479807|3.832193|3.560323|2.316036|2.400324|2.102771|1.846382|1.807658|1.987695|2.267087|1.494137|2.562066|1.385410|5.555018|3.910574|5.070182|7.994522|7.926073|13.893498|36.858105| |2.444976|2.698688|0.081082|2.321531|3.629573|3.251755|2.107920|2.144961|1.892082|1.687755|1.669806|1.837214|2.080929|1.385181|2.391846|1.286442|5.342624|3.803657|4.497198|6.754496|6.879668|7.952219|13.605399|36.858105| |2.767982|3.019512|0.089353|2.517023|3.916250|3.457048|2.196686|2.191332|1.913703|1.717475|1.720291|1.915073|2.102092|1.402654|2.438044|1.293993|6.155508|4.593703|5.080571|7.105677|7.876760|6.835344|7.887938|13.868467|36.858105| |3.400558|3.846623|0.114273|3.075474|4.654674|4.213773|2.588694|2.549073|2.171702|1.933664|1.951213|2.213345|2.329447|1.542986|2.686948|1.407503|8.234689|6.907897|7.754719|9.484132|13.789231|7.943270|6.893956|8.008335|13.678813|36.858105| |3.881452|4.208567|0.118731|3.247961|4.947701|4.287489|2.597583|2.489171|2.120014|1.915671|1.964134|2.249150|2.300497|1.534531|2.696049|1.393015|9.427206|8.121970|6.792953|8.442963|7.997850|5.226226|4.634982|5.307525|8.149978|14.138800|73.516695| |5.108144|5.665128|0.150225|4.071692|6.042218|5.202695|3.023226|2.807356|2.342858|2.122761|2.212186|2.593771|2.509773|1.669568|2.951298|1.497035|14.368354|14.186024|7.785505|9.553452|6.844629|4.554941|3.826667|4.025328|5.296136|8.086199|25.130306|36.858105| |5.116966|4.932314|0.122711|3.711106|5.805538|4.561802|2.726635|2.491048|2.125598|1.972698|2.084016|2.428054|2.352718|1.587422|2.834860|1.425532|11.467752|7.526149|4.935001|6.958910|4.482147|3.375415|2.998883|3.213814|4.089736|5.257643|14.481691|12.858611|36.858105| |4.252613|3.873703|0.100725|3.030553|4.910280|3.732857|2.299570|2.122280|1.848258|1.732908|1.825571|2.090497|2.096318|1.428441|2.556154|1.294568|8.019508|5.162475|3.895970|5.666754|3.817701|3.013708|2.798045|3.102073|3.973889|4.678740|12.297941|7.680728|13.674473|36.858105| |3.730007|3.285004|0.084277|2.698367|4.516645|3.309057|2.086238|1.920139|1.698372|1.615153|1.710318|1.939510|1.970251|1.356244|2.441553|1.233071|6.538028|3.898130|3.082671|4.691523|2.996816|2.475489|2.333103|2.561121|3.136198|3.509171|8.256033|5.071953|7.910049|13.776364|36.858105| |3.732111|3.267789|0.081215|2.772380|4.716417|3.380588|2.149157|1.960097|1.740716|1.670216|1.782648|2.022799|2.035879|1.407243|2.546962|1.274984|6.536807|3.662987|2.884801|4.499231|2.715629|2.268202|2.115046|2.269605|2.705331|3.050892|6.913279|4.469721|6.850489|7.943196|13.746259|36.858105| |4.263111|3.821825|0.091293|3.256991|5.479644|3.951922|2.481309|2.236450|1.964184|1.879497|2.018165|2.320093|2.265970|1.557005|2.819516|1.398360|8.024546|4.270451|3.234655|5.062843|2.924319|2.409376|2.197045|2.311998|2.741088|3.194580|7.239323|5.050068|7.920179|6.881655|7.943230|13.752805|36.858105| |5.115453|4.866324|0.113606|3.906536|6.244147|4.749659|2.869466|2.578206|2.209065|2.074593|2.218003|2.596189|2.465888|1.670397|3.002809|1.490981|11.435750|6.142803|4.218803|6.364214|3.670086|2.895998|2.570717|2.684715|3.245589|3.997766|9.511573|7.600049|13.685641|7.925460|6.867961|7.931583|13.763965|36.858105| |17.613730|8.857602|0.173729|6.852344|12.262066|6.478103|3.689908|3.002266|2.526247|2.450076|2.784660|3.473925|2.832514|1.929683|3.553660|1.676665|12.564285|5.163654|3.899716|6.555657|3.153087|2.618763|2.271555|2.251378|2.551599|3.086877|6.363459|4.704842|5.134767|4.235292|3.899555|4.141191|4.952669|5.723305|0.500000| |17.605501|8.890503|0.213732|6.879909|12.735185|6.406483|3.666374|2.985531|2.515637|2.442164|2.776447|3.459134|2.825655|1.924697|3.542357|1.673363|10.085199|4.589180|3.816693|6.641474|3.122069|2.663349|2.304376|2.246902|2.490839|2.973890|5.829060|4.045571|4.015110|3.543858|3.206393|3.196510|3.520071|3.991556|0.301724|0.500000| |17.574907|8.885347|0.213357|5.492039|8.862223|5.710333|3.236551|2.763599|2.322294|2.201360|2.419832|2.937387|2.576451|1.745407|3.167854|1.539521|12.583540|6.223005|4.579766|7.246876|3.780633|3.047874|2.635714|2.643506|3.061828|3.783585|7.959209|5.925217|6.087532|5.224338|4.395048|4.165714|4.552680|5.509783|0.300201|0.300391|0.500000| |4.852981|7.813279|0.211247|9.556848|10.893475|25.949410|9.290906|7.624539|4.917226|4.057678|4.268590|5.721954|4.275536|2.653959|4.616686|2.245357|14.029101|6.173761|6.591387|16.159971|4.423461|3.840786|3.011510|2.703624|2.871921|3.583905|6.338296|4.323267|3.588834|2.894687|2.509691|2.523300|2.939192|3.624348|0.122644|0.120675|0.116561|0.500000| |3.094587|4.065198|0.114366|4.850222|7.098906|10.032614|8.902115|17.704618|8.962808|5.639411|4.964664|5.658392|5.739276|3.278595|5.375279|2.763672|7.452222|3.813309|4.369280|10.323441|3.473648|3.363308|2.736780|2.397672|2.429226|2.848577|4.837184|3.036016|2.616138|2.216301|1.977341|1.995442|2.269574|2.656180|0.081645|0.081156|0.077869|0.234323|0.500000| |2.312238|2.776587|0.077021|3.291610|5.377942|5.753143|5.644804|8.980534|17.685090|8.888500|5.655064|4.968377|9.988257|4.821741|7.088139|4.029771|4.969209|2.579124|2.811262|5.955651|2.433304|2.428426|2.103036|1.879520|1.877820|2.105229|3.608471|2.203584|1.991361|1.745457|1.603776|1.634961|1.829946|2.050820|0.062665|0.062417|0.058771|0.116725|0.217733|0.500000| |2.570581|2.878569|0.075655|3.744706|7.208568|5.642218|5.645395|4.974147|5.668471|8.931112|17.825773|8.958091|9.502785|6.814358|15.021318|4.428116|4.767819|2.311408|2.295959|4.571135|1.963397|1.867634|1.647641|1.535176|1.583126|1.779832|3.203695|2.019538|1.932477|1.712598|1.622624|1.699164|1.910803|2.064965|0.072513|0.072370|0.062588|0.097857|0.107866|0.124218|0.500000| |3.819025|4.413453|0.110155|6.832791|14.930194|9.499763|8.928143|5.666729|4.979052|5.650610|8.964155|17.821793|5.641217|3.736840|7.224526|2.881576|6.828913|3.080165|2.944300|5.872617|2.403111|2.207021|1.905149|1.782067|1.874609|2.166691|3.975167|2.603862|2.488749|2.151613|2.014243|2.117074|2.431541|2.689544|0.108247|0.107885|0.087554|0.142730|0.124288|0.107924|0.217370|0.500000| |1.968877|2.253863|0.061787|2.666014|4.623756|4.289846|4.069556|4.933673|7.665182|9.347536|5.742957|4.283002|26.104427|9.493712|10.892311|7.672448|3.953504|2.042437|2.148239|4.349615|1.904350|1.892066|1.686373|1.539744|1.543541|1.700826|2.960283|1.799307|1.675909|1.496921|1.402949|1.442536|1.599160|1.743894|0.054223|0.054119|0.050083|0.083345|0.116938|0.234930|0.143116|0.098123|0.500000| |1.633130|1.812248|0.049671|2.083944|3.689901|3.193831|2.832055|3.169662|4.106148|4.829463|3.847971|3.042996|10.199677|8.679339|10.359624|17.582455|3.176928|1.661689|1.727482|3.405165|1.567469|1.563958|1.423643|1.315497|1.315616|1.426888|2.493298|1.498458|1.417296|1.286642|1.220662|1.256862|1.376712|1.474377|0.045277|0.045200|0.042008|0.062369|0.079191|0.121690|0.107483|0.074830|0.244862|0.500000| |1.603549|1.752220|0.047988|2.023396|3.664749|3.025280|2.655830|2.826795|3.490551|4.295416|3.770639|2.966179|8.289143|8.972741|12.697941|17.587363|3.018266|1.569166|1.614051|3.160239|1.463660|1.452469|1.325851|1.232359|1.237275|1.340903|2.357412|1.420750|1.354904|1.237761|1.180949|1.217561|1.327426|1.410591|0.044532|0.044936|0.041110|0.058188|0.069982|0.097205|0.112716|0.075119|0.163465|0.299935|0.500000| |1.601461|1.749456|0.047321|2.018336|3.643719|3.025294|2.654734|2.830006|3.496939|4.291201|3.756696|2.959478|8.271091|8.973120|12.727022|17.588991|3.063552|1.587378|1.618914|3.147754|1.466158|1.444675|1.319361|1.233002|1.244302|1.350331|2.387962|1.443144|1.384878|1.260310|1.207052|1.253950|1.375416|1.456697|0.044959|0.044386|0.041068|0.058292|0.070108|0.097579|0.111954|0.074884|0.163060|0.299889|0.302616|0.500000| |2.844638|3.471727|0.110320|3.100780|4.635973|4.682819|3.012415|3.206569|2.710573|2.299297|2.225632|2.478498|2.762632|1.780961|3.028096|1.629375|6.708834|4.604944|7.062119|13.142822|8.946595|17.750180|8.909969|5.633805|4.935345|5.669747|7.516651|3.957284|3.026270|2.684236|2.250860|2.099249|2.249439|2.681806|0.070997|0.073315|0.080685|0.115455|0.106543|0.075222|0.055170|0.064595|0.057210|0.046678|0.043112|0.042610|0.500000| |2.224481|2.517713|0.077060|2.256089|3.527834|3.261439|2.168099|2.275870|2.026135|1.780590|1.727995|1.876246|2.208147|1.457147|2.487765|1.361371|4.825978|3.258617|4.114144|6.888202|5.634413|8.954412|17.735093|8.867289|5.632782|4.964323|6.532967|3.157238|2.566962|2.418609|2.063461|1.889699|1.957223|2.251435|0.056706|0.058020|0.064708|0.075721|0.071889|0.056911|0.043871|0.049752|0.045913|0.039031|0.036283|0.035954|0.213660|0.500000| |2.168498|2.349905|0.069972|2.054054|3.258624|2.866355|1.886668|1.923327|1.721588|1.548070|1.528946|1.666023|1.927179|1.290790|2.229361|1.206996|4.583369|3.149243|3.586946|5.577146|4.955770|5.659505|8.878258|17.721296|8.992286|5.678695|7.605627|3.355482|2.811260|2.783216|2.357663|2.092660|2.104510|2.388849|0.055974|0.055941|0.064946|0.065211|0.059136|0.047728|0.039296|0.044986|0.039691|0.034310|0.032201|0.032208|0.123930|0.214450|0.500000| |2.616972|2.765015|0.080271|2.316469|3.660680|3.136937|2.008960|1.988846|1.754745|1.592922|1.603329|1.777343|1.961114|1.318641|2.301422|1.220135|5.599170|4.035742|4.149138|5.957656|5.634187|4.934928|5.604412|8.879647|17.746515|8.922673|13.300007|4.892568|4.088448|4.219530|3.357535|2.828971|2.789438|3.223914|0.067946|0.065542|0.081192|0.071096|0.060394|0.047760|0.041291|0.048688|0.039913|0.034368|0.032454|0.032730|0.107271|0.123555|0.214320|0.500000| |3.863931|3.592074|0.097462|2.815463|4.548802|3.513186|2.176634|2.032025|1.775111|1.657427|1.733205|1.971891|2.013818|1.371142|2.444588|1.248531|7.218291|4.864404|3.897473|5.614046|4.039209|3.203796|3.038535|3.470848|4.583477|5.214888|13.643015|7.120695|8.900694|17.747803|8.940793|5.653471|4.958910|5.640775|0.102728|0.092163|0.132898|0.076372|0.059384|0.046865|0.045140|0.056021|0.040120|0.034576|0.033259|0.033674|0.077812|0.072351|0.086592|0.139937|0.500000| |3.223250|2.845088|0.074540|2.380287|4.027088|2.940521|1.879589|1.742477|1.556164|1.485495|1.567681|1.760373|1.826296|1.263111|2.274077|1.155029|5.497585|3.290110|2.716097|4.186759|2.701392|2.285160|2.195084|2.432093|2.941250|3.166249|7.131641|4.131678|5.635861|8.937883|17.722103|8.906542|5.646128|4.949759|0.092199|0.079542|0.104694|0.061787|0.049789|0.041017|0.041527|0.050736|0.036199|0.031774|0.030837|0.031431|0.057763|0.054406|0.063230|0.089132|0.216009|0.500000| |3.224783|2.824585|0.070834|2.471588|4.285266|3.030438|1.962806|1.796121|1.614994|1.563537|1.669785|1.874327|1.921601|1.338595|2.430920|1.218010|5.495080|3.043871|2.483291|3.949039|2.355626|2.012004|1.895135|2.027676|2.371524|2.613275|5.699031|3.569317|4.940371|5.648610|8.912032|17.718217|8.914290|5.643893|0.099739|0.079175|0.097686|0.062246|0.050452|0.042233|0.044591|0.054656|0.037799|0.033281|0.032378|0.033402|0.052136|0.047562|0.052571|0.069100|0.124299|0.214661|0.500000| |3.880102|3.522072|0.083586|3.161635|5.441739|3.858360|2.473616|2.221312|1.970761|1.906785|2.059581|2.353891|2.305535|1.593708|2.901101|1.429165|7.231934|3.703873|2.906114|4.680532|2.608510|2.194600|2.003170|2.082592|2.415358|2.778206|6.030678|4.110562|5.642293|4.957085|5.646666|8.911356|17.724420|8.942852|0.128879|0.091244|0.109584|0.078344|0.061843|0.050853|0.054552|0.068929|0.045011|0.038928|0.037600|0.039256|0.057707|0.050117|0.053018|0.067803|0.107635|0.124086|0.214777|0.500000| |5.227796|5.412021|0.121422|4.509562|7.033001|5.561713|3.314740|2.946238|2.487764|2.322314|2.491337|2.957027|2.725413|1.831214|3.287315|1.620227|13.908630|6.632131|4.531982|7.018480|3.742925|2.964853|2.579153|2.626514|3.103659|3.868145|8.679759|7.002193|8.905850|5.642058|4.954330|5.650977|8.937366|17.780831|0.165203|0.112638|0.144307|0.117779|0.084087|0.063583|0.063768|0.084605|0.053360|0.044487|0.042306|0.043946|0.077636|0.063016|0.064588|0.083530|0.124056|0.107553|0.124278|0.216108|0.500000|
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