Version2.4 2021-06-12T13:03:20Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 02-May-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)COc1ccc(cc1)C(=O)C2=C(C(=O)N([C@@H]2c3ccccc3OCC=C)CCOCCO)[O-] C40080646 RHF 6-31G(d) (6D,7F) CC(C)COc1ccc(cc1)C(=O)C2=C(C(=O)N([C@@H]2c3ccccc3OCC=C)CCOCCO)[O-] C01[X(C28H32N1O7)] 198 C1 604 C=CCOc1ccccc1[C@H]1N(CCOCCO)C(=O)C(=C1C(=O)c1ccc(cc1)OCC(C)C)[O-] C=CCOc1ccccc1[C@H]1N(CCOCCO)C(=O)C(=C1C(=O)c1ccc(cc1)OCC(C)C)[O-] CC(C)COc1ccc(cc1)C(=O)C2=C([O-])C(=O)N(CCOCCO)[C@@H]2c3ccccc3OCC=C InChIKey=CGZJYIKKLAOOPW-RUZDIDTESA-M InChI=1S/C28H33NO7/c1-4-15-35-23-8-6-5-7-22(23)25-24(27(32)28(33)29(25)13-16-34-17-14-30)26(31)20-9-11-21(12-10-20)36-18-19(2)3/h4-12,19,25,30,32H,1,13-18H2,2-3H3/p-1/t25-/m1/s1 InChI=1/C28H33NO7/c1-4-15-35-23-8-6-5-7-22(23)25-24(27(32)28(33)29(25)13-16-34-17-14-30)26(31)20-9-11-21(12-10-20)36-18-19(2)3/h4-12,19,25,30,32H,1,13-18H2,2-3H3/p-1/t25-/m1/s1/fC28H32NO7/h32h/q-1 CC(C)COc1ccc(cc1)C(=O)C2=C(C(=O)N([C@@H]2c3ccccc3OCC=C)CCOCCO)[O-] C01[X(C28H32N1O7)] 198 C01 604 C=CCOc1ccccc1[C@H]1N(CCOCCO)C(=O)C(=C1C(=O)c1ccc(cc1)OCC(C)C)[O-] C=CCO[C]1[CH][CH][CH][CH][C]1[C@H]1N(CCOCCO)C(=O)[C]([C]1[C](=O)[C]1[CH][CH][C]([CH][CH]1)OCC(C)C)=O CC(C)CO[C]1[CH][CH][C]([CH][CH]1)C(=O)[C]2[C@@H]([C]3[CH][CH][CH][CH][C]3OCC=C)N(CCOCCO)C(=O)C2=O InChIKey=FUCIQDPWQMPWDW-RUZDIDTESA-N InChI=1S/C28H32NO7/c1-4-15-35-23-8-6-5-7-22(23)25-24(27(32)28(33)29(25)13-16-34-17-14-30)26(31)20-9-11-21(12-10-20)36-18-19(2)3/h4-12,19,25,30H,1,13-18H2,2-3H3/t25-/m1/s1 InChI=1/C28H32NO7/c1-4-15-35-23-8-6-5-7-22(23)25-24(27(32)28(33)29(25)13-16-34-17-14-30)26(31)20-9-11-21(12-10-20)36-18-19(2)3/h4-12,19,25,30H,1,13-18H2,2-3H3/t25-/m1/s1 4066.5495893251 -1657.4068737 1-A 17880.7782 132 472 604 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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 9.8457 15.3991 17.4308 26.7079 28.3517 40.2754 48.5332 50.0854 52.4427 60.6764 62.8760 70.5987 74.8148 91.2828 96.7972 106.7795 108.5800 117.3122 135.2253 143.4008 151.7329 168.8342 172.8070 193.3249 212.9748 231.9108 238.0175 238.5556 251.4599 269.3476 282.3052 299.1742 307.3793 323.9983 336.5907 349.8555 353.3635 362.7529 376.5192 380.5018 426.0980 435.4325 449.5604 461.4549 472.5895 487.2217 516.4351 532.1802 539.0557 543.3027 554.8799 575.1077 587.6758 603.3951 615.1183 622.1944 645.5458 678.6424 692.2723 702.6183 722.9845 767.3226 794.7269 821.0718 846.3300 849.1614 862.9846 883.4422 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61 62 63 64 65 66 67 68 6 6 6 6 8 6 6 6 6 6 6 6 8 6 6 6 8 7 6 1 6 6 6 6 6 6 8 6 6 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 1 1 1 1 1 1 12.00000 12.00000 12.00000 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 15.99491 14.00307 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 13058.5543 23329.9596 26665.8725 0.99998 0.00483 0.00398 -0.00468 0.99926 -0.03811 -0.00416 0.03809 0.99927 1 0.00663 0.00371 0.00325 0.13820 0.07736 0.06768 14.17 22.16 25.08 38.43 40.79 57.95 69.83 72.06 75.45 87.30 90.46 101.58 107.64 131.34 139.27 153.63 156.22 168.79 194.56 206.32 218.31 242.91 248.63 278.15 306.42 333.67 342.45 343.23 361.79 387.53 406.17 430.44 442.25 466.16 484.28 503.36 508.41 521.92 541.73 547.46 613.06 626.49 646.82 663.93 679.95 701.00 743.03 765.69 775.58 781.69 798.35 827.45 845.53 868.15 885.02 895.20 928.80 976.42 996.03 1010.91 1040.21 1104.01 1143.43 1181.34 1217.68 1221.75 1241.64 1271.08 1276.90 1279.26 1306.66 1313.85 1325.84 1329.30 1338.63 1374.23 1383.79 1411.28 1443.67 1458.94 1465.34 1470.07 1473.14 1507.74 1515.59 1533.66 1552.24 1555.19 1578.16 1582.68 1584.11 1591.12 1605.47 1648.73 1659.91 1664.65 1695.20 1709.41 1717.10 1722.33 1723.43 1755.30 1765.53 1770.27 1788.02 1806.76 1843.20 1850.00 1855.52 1863.22 1866.80 1872.93 1881.62 1883.31 1900.99 1915.21 1941.86 1952.84 1984.65 1986.56 2006.22 2013.63 2018.47 2030.02 2032.17 2050.11 2065.04 2085.72 2105.69 2124.88 2172.04 2181.49 2193.44 2197.72 2212.63 2217.67 2238.74 2239.36 2254.40 2258.12 2268.38 2281.72 2305.55 2308.86 2313.46 2330.90 2347.03 2353.55 2356.92 2372.01 2381.02 2387.17 2389.32 2391.04 2408.06 2409.30 2422.14 2432.70 2547.35 2567.94 2591.36 2593.73 2614.02 2710.09 2789.18 2803.62 4530.59 4556.08 4577.73 4583.01 4589.06 4595.36 4600.29 4605.96 4626.14 4640.03 4658.06 4658.48 4664.76 4684.38 4690.17 4692.02 4696.53 4745.80 4751.85 4762.15 4786.31 4811.86 4824.89 4845.11 4848.80 4861.33 4884.20 4888.44 4888.72 4890.99 4908.96 5896.45 0.600458 0.634400 0.635344 0.528754 -1656.806416 -1656.772474 -1656.771529 -1656.878120 3.575080D-04 MUNgauss RevisionA2.1 retrievium 12-Jun-2021 DUDE CC(C)COc1ccc(cc1)C(=O)C2=C(C(=O)N([C@@H]2c3ccccc3OCC=C)CCOCCO)[O-] C40080646 RHF 6-31G(d) (6D,10F) C1 494.217878 |X|Y|Z| 101.938395 68.301622 53.141979 71.790809 18 6 7 17 1 |36.858105| |12.450879|36.858105| |7.536838|12.441604|36.858105| |7.543158|12.495217|7.609104|36.858105| |6.577757|8.027559|5.121667|13.632660|73.516695| |4.577190|5.196815|3.904718|7.984972|24.901767|36.858105| |3.847872|4.062714|3.150138|5.249421|14.514869|13.674841|36.858105| |3.040208|3.186968|2.622825|3.983634|9.395587|7.940415|13.841529|36.858105| |2.768352|2.956425|2.525514|3.768611|8.142821|6.798990|7.878847|13.644073|36.858105| |3.015061|3.329215|2.874280|4.502733|9.217662|7.949021|6.916558|8.018486|13.794194|36.858105| |3.804326|4.390526|3.634162|6.710207|13.954963|13.786131|7.943563|6.889920|7.854328|13.668859|36.858105| |2.270214|2.392671|2.108908|2.904785|5.964928|4.407637|5.020302|7.577872|12.512558|7.451951|4.961104|36.858105| |2.111345|2.226808|1.966598|2.639209|5.432135|3.868281|4.557830|6.675574|8.209801|5.484645|4.105198|15.679600|73.516695| |2.091416|2.180591|1.963545|2.616128|5.168700|3.657603|3.906278|5.165233|7.499093|6.083410|4.244373|13.322002|14.367955|36.858105| |1.811296|1.883955|1.725751|2.204505|4.266870|2.892193|3.062086|3.832495|4.925512|4.293077|3.273053|7.558800|11.425571|13.472887|36.858105| |1.729133|1.782470|1.654859|2.068288|3.917741|2.593879|2.666489|3.172346|3.932983|3.701742|2.950980|5.081783|7.662723|8.093289|12.364050|36.858105| |1.564928|1.609993|1.511002|1.840975|3.447124|2.233424|2.282660|2.648072|3.160070|3.026316|2.506753|3.903799|6.233115|5.407333|7.711049|15.815719|73.516695| |1.897662|1.943695|1.798315|2.279963|4.308289|2.872493|2.903629|3.414246|4.291357|4.180514|3.322500|5.126287|7.257577|8.186000|8.165284|14.113818|14.963870|53.358707| |2.190599|2.252088|2.039996|2.712585|5.255582|3.663498|3.733509|4.573860|6.233123|5.908332|4.341876|7.283575|9.075372|12.516337|7.902334|8.075312|9.647019|17.734922|36.858105| |2.352123|2.449643|2.231297|3.015418|5.722717|4.017692|3.863341|4.522348|6.305332|7.024604|5.087103|6.337797|8.062570|8.695292|6.018699|6.222366|8.195660|12.557187|17.675135|0.500000| |2.317388|2.308569|2.059348|2.742252|5.424667|3.725865|3.927508|4.713744|5.645298|5.087630|4.112878|5.863221|7.909581|7.391773|5.411097|5.511583|7.495209|10.521302|12.378413|0.248752|36.858105| |2.140935|2.107900|1.873854|2.439987|4.895218|3.289356|3.658130|4.468492|4.890594|4.100707|3.429733|5.435221|7.987630|6.345163|5.154287|4.998477|7.089123|8.142631|7.500842|0.156452|13.747888|36.858105| |2.150758|2.065231|1.828647|2.336826|4.700309|3.050387|3.420298|3.943255|3.962390|3.418696|3.045506|4.095929|6.415953|4.379192|3.770287|3.717284|5.639080|5.832181|4.970595|0.116427|7.848765|13.734253|36.858105| |2.354819|2.210089|1.951950|2.485058|4.959215|3.143350|3.419199|3.701956|3.655582|3.326246|3.101131|3.521739|5.481841|3.699591|3.161758|3.193016|4.931337|5.145915|4.390686|0.110601|6.803674|7.979537|13.807176|36.858105| |2.603653|2.449084|2.167567|2.810829|5.520566|3.520488|3.638198|3.835210|3.933558|3.786922|3.578541|3.620132|5.441034|3.864630|3.207729|3.305622|5.048654|5.602099|4.950554|0.132188|7.853868|6.917451|7.947321|13.739699|36.858105| |2.575151|2.510698|2.235913|2.981040|5.812512|3.878886|3.906508|4.291265|4.811506|4.757444|4.225067|4.436926|6.295443|5.015846|3.940565|4.117549|6.021998|7.558312|7.410861|0.201639|13.618100|8.000984|6.872913|7.928915|13.717255|36.858105| |2.706098|2.682704|2.432210|3.247461|6.058250|3.993181|3.725064|3.914934|4.538831|5.042395|4.635763|4.037097|5.737486|4.555134|3.639827|3.886624|5.783440|7.193374|6.747610|0.225500|8.119861|5.287119|4.612089|5.200308|7.903107|14.008074|73.516695| |2.948374|2.850965|2.620293|3.379230|6.060557|3.748963|3.383488|3.344764|3.653708|4.122126|4.183796|3.196201|4.750475|3.435871|2.875954|3.047190|4.735741|5.258111|4.519432|0.145409|5.224919|3.988891|3.796311|4.529567|6.755842|7.951465|24.223023|36.858105| |2.834703|2.834972|2.716979|3.363505|5.697902|3.448356|3.002286|2.943550|3.279197|3.880265|4.015944|2.898515|4.358702|3.123047|2.682378|2.869838|4.546904|4.843230|3.974765|0.133374|4.087922|3.209247|2.989806|3.363012|4.444501|5.244578|14.509399|12.705435|36.858105| |3.162280|3.205500|3.170641|3.785183|6.047320|3.499334|2.940136|2.784500|3.033951|3.655688|4.036437|2.631809|4.033832|2.740238|2.372659|2.475061|3.966485|4.010221|3.292386|0.108718|3.329028|2.723135|2.572098|2.867046|3.617142|4.054936|9.859936|7.630644|14.455396|36.858105| |1.824290|1.853194|1.740562|2.145728|3.963974|2.565859|2.533969|2.847689|3.416127|3.484800|2.944642|3.762606|5.576379|5.119172|5.122361|7.816086|12.070174|18.027742|7.452922|0.191754|6.036463|4.781699|3.801562|3.569914|4.006332|5.218934|9.517847|4.088546|3.874100|3.112546|36.858105| |1.749170|1.801427|1.723114|2.081514|3.756011|2.397981|2.310336|2.541488|3.047346|3.246326|2.797921|3.281618|4.969015|4.231136|4.327150|6.091624|10.524769|10.479790|5.453579|0.159458|4.320095|3.533929|2.946320|2.839726|3.198082|3.998610|7.907436|3.665630|3.807201|3.142569|12.526746|36.858105| |1.924556|2.011957|1.933268|2.368294|4.210681|2.706386|2.530686|2.749854|3.370208|3.807417|3.279711|3.480626|5.171182|4.350128|4.145821|5.163034|8.296369|8.904603|5.624123|0.188893|4.298372|3.383203|2.828631|2.780456|3.221609|4.123121|8.833474|4.101588|4.550501|3.761819|7.957784|13.581619|73.516695| |1.812914|1.917762|1.879399|2.233126|3.890729|2.450120|2.266230|2.418158|2.902430|3.310494|2.951417|2.966187|4.557424|3.511864|3.440377|4.049442|6.889667|6.220533|4.109038|0.133299|3.299096|2.727945|2.348610|2.320131|2.638449|3.213149|6.751443|3.374638|3.906194|3.462496|5.182263|8.086520|24.312520|36.858105| |1.983151|2.145432|2.124264|2.538745|4.326848|2.718749|2.438628|2.554561|3.079163|3.697517|3.377120|3.018410|4.637790|3.398446|3.192757|3.473076|5.727323|5.272591|3.837682|0.129501|3.116221|2.573168|2.234480|2.228427|2.550661|3.089252|6.617618|3.394609|4.078530|3.836049|4.038943|5.221144|14.395729|12.577507|36.858105| |2.232760|2.414720|2.410141|2.888051|4.800554|2.976279|2.592259|2.642612|3.133138|3.880553|3.736184|2.928842|4.464378|3.216380|2.907145|3.118551|5.061353|4.914835|3.756697|0.130337|3.206154|2.606520|2.301138|2.355953|2.769576|3.348785|7.579746|4.087138|5.402249|5.239852|3.820136|4.585805|12.131124|7.878228|13.613531|73.516695| |1.671758|1.743722|1.604274|2.013008|3.888905|2.592231|2.768506|3.420387|4.169271|3.627652|2.868609|6.166794|11.050440|7.878050|15.751891|7.971894|11.717879|7.496679|5.278648|0.122311|4.102860|4.126924|3.226913|2.724169|2.708532|3.180773|5.266871|2.436490|2.300455|2.077375|3.989852|3.564411|6.066346|2.987225|2.807516|4.513865|73.516695| |17.599375|8.785683|5.484687|6.901744|13.168198|5.086086|4.461608|3.406871|2.992235|3.172064|3.971889|2.427213|4.023438|2.207643|1.897030|1.795584|2.873364|2.681885|2.298950|0.067798|2.473129|2.310777|2.344837|2.574236|2.813926|2.743099|4.995596|3.009223|2.794812|3.017453|1.875128|1.773254|3.441387|1.802721|1.951785|3.866071|3.109507|0.500000| |17.511838|8.780326|6.841873|6.793101|10.184316|4.313458|3.599614|2.925411|2.727781|3.009298|3.765148|2.250646|3.674853|2.111252|1.827852|1.768293|2.846626|2.671197|2.258156|0.067886|2.407469|2.197514|2.214303|2.466637|2.785873|2.739907|5.214371|3.314792|3.200370|3.653723|1.910569|1.833276|3.596464|1.899545|2.073541|4.218751|2.976524|0.301342|0.500000| |17.530668|8.783297|6.867894|5.487443|8.761061|3.682795|3.237566|2.635889|2.407788|2.581689|3.143606|2.021951|3.384028|1.872603|1.644652|1.574730|2.554952|2.332443|1.949188|0.057618|2.056896|1.925003|1.947001|2.121883|2.308797|2.263988|4.194440|2.563411|2.483053|2.755223|1.655536|1.593563|3.091109|1.650619|1.795098|3.560491|2.721105|0.300921|0.301402|0.500000| |8.911690|17.520431|8.898106|9.006643|13.231856|4.934144|4.053154|3.164213|2.876325|3.157424|4.055955|2.345134|3.950219|2.107132|1.831529|1.714258|2.759077|2.512706|2.132233|0.063635|2.174864|2.015887|1.975460|2.084757|2.264917|2.317815|4.319843|2.523917|2.488842|2.745885|1.745050|1.694015|3.337518|1.794924|1.998655|3.920401|3.044426|0.213150|0.173528|0.213336|0.500000| |6.796834|8.760006|17.519142|6.863262|8.305419|3.729843|2.999148|2.541900|2.492611|2.871932|3.605121|2.092098|3.430508|1.979277|1.740032|1.689120|2.744741|2.521686|2.092788|0.064150|2.116738|1.905802|1.859771|2.004362|2.258427|2.333528|4.599799|2.858789|3.033179|3.673033|1.814608|1.805118|3.621567|1.982858|2.247594|4.629093|2.856488|0.139448|0.202000|0.167939|0.173243|0.500000| |5.473552|8.743111|17.537874|6.926547|8.451748|3.786382|3.048734|2.578155|2.518759|2.895715|3.639194|2.114727|3.521334|1.964217|1.734264|1.656266|2.693481|2.431806|2.019194|0.061544|2.001317|1.818033|1.754623|1.849055|2.044746|2.139922|4.149762|2.469146|2.597564|3.013485|1.722656|1.722233|3.455932|1.911918|2.190281|4.383945|2.879715|0.122561|0.139518|0.140536|0.212977|0.301352|0.500000| |6.896817|8.780137|17.545334|5.513069|7.478977|3.297535|2.780547|2.344719|2.239736|2.489850|3.043553|1.903177|3.187348|1.777682|1.578738|1.517400|2.479392|2.230693|1.839761|0.055264|1.868299|1.721714|1.695846|1.810283|1.986078|2.021413|3.859185|2.339417|2.405758|2.767067|1.592151|1.574406|3.104672|1.702194|1.900625|3.790167|2.626189|0.140755|0.170235|0.206340|0.212215|0.301830|0.301677|0.500000| |5.494474|8.839935|7.076071|17.525242|16.571807|7.098429|4.797966|3.822122|3.745174|4.600448|6.790428|2.918873|4.745822|2.620014|2.223877|2.074211|3.290908|3.078067|2.670307|0.082997|2.614391|2.321950|2.188778|2.284634|2.562951|2.772293|5.403555|3.091083|3.169964|3.563079|2.118680|2.087374|4.264998|2.299496|2.670140|5.350524|3.634217|0.140436|0.139908|0.123090|0.214394|0.173605|0.212763|0.143171|0.500000| |6.892599|8.835354|6.852513|17.504277|16.534901|7.095044|4.779143|3.810644|3.749186|4.618499|6.826492|2.911274|4.604562|2.695551|2.262364|2.160915|3.413167|3.301422|2.889200|0.091005|2.937681|2.554954|2.443028|2.642377|3.079523|3.294572|6.628717|4.029259|4.092249|4.803510|2.315939|2.251950|4.608713|2.429092|2.773602|5.796608|3.626483|0.171593|0.203447|0.140360|0.174847|0.202753|0.168577|0.140160|0.301240|0.500000| |4.019877|4.085437|3.106552|4.867943|13.455149|8.949712|17.718861|8.893061|5.607188|4.974823|5.664023|4.091914|6.940750|3.293521|2.683912|2.365088|3.659543|3.466206|3.160382|0.089328|3.397610|3.290242|3.208215|3.240151|3.346184|3.423261|5.731518|3.018757|2.677595|2.647535|2.258914|2.063058|3.959805|2.014465|2.149389|4.056000|4.396159|0.135433|0.101357|0.095318|0.116982|0.080867|0.082352|0.077778|0.120739|0.120018|0.500000| |2.721166|2.795202|2.332342|3.328357|7.593235|5.646814|8.951899|17.738542|8.945498|5.693843|4.962846|7.126342|12.807785|4.885666|3.789591|3.087590|4.625289|4.402114|4.174211|0.109392|4.412753|4.546095|4.100765|3.698245|3.622185|3.903908|6.117520|2.961947|2.598045|2.445851|2.689280|2.376288|4.456340|2.211986|2.293613|4.161315|6.182197|0.085042|0.072538|0.066936|0.078141|0.062658|0.063593|0.058949|0.088796|0.088365|0.213942|0.500000| |2.695351|2.978844|2.675297|3.909910|7.447894|5.667367|4.976197|5.678191|8.957827|17.733593|8.951008|6.883288|9.008260|6.497731|4.683585|4.135004|5.962256|6.403644|6.507191|0.237314|4.979359|3.905491|3.198235|3.094326|3.546641|4.575208|9.077706|4.099253|4.059190|3.769791|3.900778|3.760733|8.229443|4.001928|4.592207|8.325581|6.894959|0.077120|0.075722|0.065049|0.078098|0.075317|0.075755|0.064674|0.113763|0.114168|0.107924|0.124828|0.500000| |3.886389|4.670132|4.057070|7.419767|12.445125|8.871720|5.632136|4.964010|5.630099|8.932718|17.751631|4.064329|6.116491|3.693710|2.965738|2.759243|4.239068|4.237249|3.892266|0.130040|3.632643|3.018127|2.710214|2.798636|3.267768|3.832319|7.899837|4.218515|4.353792|4.626320|2.851478|2.796995|5.979321|3.108281|3.705017|7.598418|4.654532|0.107454|0.109071|0.089154|0.115670|0.114555|0.115014|0.091827|0.225553|0.228003|0.124132|0.107750|0.217805|0.500000| |1.976040|1.968356|1.759294|2.267227|4.539909|3.048852|3.429867|4.310761|4.781970|3.884733|3.188042|5.951381|9.110197|7.153045|6.242334|5.645076|7.901021|8.245520|7.063557|0.142904|9.008913|17.738469|8.923349|5.668262|4.976997|5.686052|7.598556|3.332195|2.812244|2.434503|4.560727|3.435016|5.759741|2.652383|2.490986|4.378155|8.926065|0.059025|0.055768|0.049713|0.052857|0.049367|0.047819|0.045051|0.060789|0.065045|0.086100|0.126448|0.104249|0.078027|0.500000| |1.987455|1.905567|1.692733|2.122603|4.265760|2.724345|3.092511|3.547403|3.473988|2.976862|2.680197|3.672060|6.037263|3.832425|3.456382|3.358836|5.238659|4.997333|4.071446|0.096492|5.612078|8.904923|17.711046|8.908580|5.642777|4.951538|6.505677|3.136369|2.559669|2.249090|3.278977|2.610096|4.419336|2.107382|2.006172|3.638379|5.462533|0.060260|0.056345|0.050537|0.051148|0.047527|0.045206|0.043961|0.055488|0.060867|0.082588|0.106258|0.077537|0.066621|0.215118|0.500000| |2.301252|2.122217|1.878649|2.331801|4.627919|2.845741|3.091397|3.244764|3.118241|2.868824|2.748941|2.989664|4.791686|3.076811|2.701794|2.723484|4.310803|4.261206|3.517924|0.090627|4.914434|5.653459|8.907920|17.696645|8.938331|5.646536|7.465806|3.933002|3.006989|2.627912|3.019247|2.479447|4.315230|2.070428|1.998058|3.762744|4.244793|0.070130|0.066980|0.058265|0.055783|0.053512|0.049139|0.048887|0.059245|0.068462|0.083878|0.091183|0.074149|0.069735|0.124234|0.213781|0.500000| |2.761811|2.538528|2.258291|2.866439|5.515285|3.383718|3.390228|3.407276|3.433539|3.427503|3.395250|3.098127|4.745838|3.247717|2.753570|2.849178|4.451528|4.731775|4.039815|0.112817|5.601667|4.978236|5.665248|8.956742|17.756372|8.872764|12.631704|7.567363|4.759784|3.913561|3.508671|2.929881|5.320174|2.506413|2.449716|4.826910|4.213340|0.082421|0.083924|0.068054|0.064386|0.066114|0.058455|0.057661|0.071578|0.088651|0.088215|0.088658|0.089456|0.088377|0.107987|0.124375|0.217190|0.500000| |3.492686|3.285452|2.941727|3.913716|7.078889|4.277351|3.791044|3.584927|3.752278|4.222101|4.557130|3.154260|4.739729|3.243085|2.689541|2.754595|4.286055|4.594334|4.045140|0.127327|4.753471|3.800758|3.734289|4.560201|6.678993|6.984553|16.502552|17.547067|8.891301|7.215524|3.422841|3.090582|6.117047|2.929535|3.028542|6.424246|4.108410|0.100025|0.111488|0.082550|0.079433|0.089374|0.075438|0.072489|0.095709|0.132698|0.094687|0.087240|0.111070|0.126285|0.088460|0.086508|0.112706|0.222418|0.500000| |2.666028|2.530719|2.350499|2.892361|5.203435|3.152542|2.939115|2.928833|3.135836|3.395000|3.401797|2.843085|4.311308|3.086662|2.665388|2.878337|4.562202|4.915718|4.001180|0.121751|4.765902|3.837445|3.808056|4.708091|6.990025|7.110248|16.562000|17.512166|8.955872|6.041671|3.970805|3.509205|6.629337|3.097916|3.015339|6.271550|4.055544|0.075727|0.083172|0.065689|0.062895|0.071025|0.061379|0.059346|0.073739|0.093388|0.074675|0.074097|0.093972|0.094520|0.088829|0.088027|0.116521|0.239136|0.300606|0.500000| |2.456081|2.483719|2.408424|2.911165|4.969625|3.038331|2.704041|2.720178|3.088136|3.607680|3.568810|2.834406|4.268645|3.151539|2.772025|3.065549|4.912719|5.232291|4.071830|0.137006|4.008039|3.143276|2.876937|3.151687|4.039663|4.875751|12.985686|8.711279|17.679124|9.159154|4.425496|4.560847|9.942903|4.720952|4.705236|11.194680|4.210482|0.067389|0.075521|0.060706|0.061655|0.073792|0.064972|0.059843|0.078080|0.095132|0.067105|0.067543|0.108831|0.106645|0.077605|0.068847|0.078039|0.115913|0.172153|0.206161|0.500000| |2.879977|2.986585|3.069429|3.456570|5.417011|3.105260|2.623825|2.500929|2.736690|3.292001|3.596400|2.418239|3.751240|2.523688|2.229210|2.335207|3.795800|3.713942|2.967724|0.097353|2.911029|2.422297|2.277768|2.488684|3.036069|3.392283|7.883264|5.480208|9.113483|17.721267|2.905836|3.048391|6.564964|3.579043|4.084934|10.355471|3.507235|0.075284|0.090954|0.070999|0.071764|0.099403|0.082728|0.074832|0.093437|0.118363|0.066044|0.061527|0.096422|0.116584|0.061251|0.056088|0.063863|0.089623|0.142558|0.130217|0.218651|0.500000| |3.809018|3.788844|3.718048|4.460306|6.916838|3.841167|3.156249|2.888460|3.052652|3.657187|4.259330|2.585730|3.997450|2.619515|2.251654|2.299710|3.677628|3.672675|3.071406|0.099357|3.181295|2.654401|2.551596|2.877450|3.604988|3.889920|8.938753|6.910643|9.089349|17.686202|2.777068|2.743803|5.695399|2.957807|3.280629|7.545770|3.533305|0.099238|0.127372|0.090238|0.087384|0.123056|0.095180|0.088877|0.111898|0.166221|0.079730|0.070120|0.100632|0.135954|0.065794|0.062257|0.074180|0.110524|0.215899|0.153803|0.173502|0.288720|0.500000| |1.958414|1.968466|1.842891|2.283543|4.210623|2.713764|2.655465|2.933850|3.465114|3.587228|3.102141|3.630294|5.338386|4.701242|4.356257|5.772315|8.845084|12.603813|7.237036|0.198212|6.822725|5.068290|4.145514|4.087240|4.860805|6.590278|12.490838|5.154654|4.686727|3.573840|17.616507|8.903604|12.842679|4.786702|3.918054|7.023683|6.142388|0.055953|0.057586|0.049124|0.051006|0.053777|0.050220|0.046721|0.061820|0.069447|0.065772|0.076193|0.109187|0.083708|0.125270|0.096347|0.094626|0.118121|0.114096|0.141478|0.150197|0.090363|0.087609|0.500000| |1.677432|1.691453|1.592574|1.928260|3.569036|2.279135|2.281949|2.555649|2.975636|2.961821|2.551044|3.316923|5.089596|4.369150|4.640273|7.128909|12.685939|12.543197|5.692617|0.141086|5.110853|4.483735|3.694830|3.419127|3.670771|4.453171|7.714585|3.504368|3.291794|2.707781|17.562934|8.985845|10.235503|4.268888|3.372521|5.664544|6.733607|0.047976|0.048678|0.042633|0.044484|0.045984|0.043712|0.040801|0.052767|0.057347|0.057402|0.068417|0.089789|0.068473|0.121907|0.090935|0.081763|0.089907|0.083304|0.097970|0.102801|0.070744|0.068035|0.301600|0.500000| |1.673008|1.710243|1.650718|1.950041|3.485450|2.184609|2.097723|2.266803|2.644528|2.816625|2.507556|2.788426|4.306007|3.443610|3.503150|4.662943|8.426360|7.631320|4.315784|0.125806|3.723444|3.133783|2.714413|2.672171|3.008406|3.616862|7.190302|3.523892|3.730778|3.085970|8.875344|17.449665|16.532256|7.126003|4.676152|7.610632|5.317875|0.046885|0.048992|0.042579|0.044555|0.048312|0.045676|0.042124|0.054075|0.058832|0.052660|0.059179|0.088488|0.070364|0.083696|0.067388|0.065885|0.078331|0.082085|0.096797|0.127249|0.084191|0.074266|0.213644|0.219097|0.500000| |1.630531|1.688413|1.618010|1.939854|3.510853|2.238863|2.178263|2.415262|2.892121|3.028947|2.593766|3.209750|4.965753|4.144312|4.552076|6.629601|12.807316|9.535798|4.879227|0.136901|3.806133|3.255418|2.714660|2.563871|2.803054|3.415123|6.504969|3.069418|3.168179|2.714348|8.897475|17.575446|16.554215|7.379547|4.860899|7.168164|6.859098|0.045946|0.047063|0.041480|0.044492|0.046731|0.045198|0.041227|0.054489|0.057526|0.054264|0.063408|0.097497|0.071677|0.091027|0.068145|0.062789|0.071258|0.074156|0.081692|0.101797|0.073952|0.067073|0.174523|0.215445|0.300163|0.500000| |1.739710|1.824629|1.806419|2.092789|3.614594|2.234929|2.067612|2.176016|2.546326|2.871075|2.636311|2.574941|4.011772|2.993785|2.943212|3.464942|6.045891|5.315818|3.508357|0.111020|2.971968|2.497455|2.198986|2.202385|2.505304|2.975510|6.255624|3.261014|3.859445|3.441217|4.645877|7.042062|16.548611|17.472981|8.868758|12.555883|4.615315|0.047813|0.050968|0.044258|0.047284|0.053325|0.050825|0.045727|0.059442|0.063536|0.051657|0.055669|0.093112|0.077549|0.066939|0.055076|0.055191|0.067188|0.078230|0.085203|0.133246|0.100987|0.080744|0.123637|0.111110|0.206288|0.173924|0.500000| |1.676071|1.775610|1.737975|2.050628|3.603229|2.269328|2.131646|2.298306|2.751964|3.058883|2.696931|2.898034|4.534120|3.446127|3.538780|4.194250|7.441251|6.001691|3.832780|0.118597|3.047584|2.591413|2.225372|2.161606|2.401673|2.882198|5.801994|2.887466|3.216607|2.902812|4.811984|7.403955|16.519832|17.487971|8.892743|10.125133|5.590314|0.046456|0.048350|0.042642|0.046643|0.050443|0.049331|0.043993|0.058955|0.060985|0.052908|0.059106|0.101930|0.077736|0.071536|0.056164|0.053820|0.062927|0.071056|0.074586|0.103891|0.082866|0.070777|0.117302|0.114871|0.177853|0.228209|0.299960|0.500000| |1.859353|2.020077|2.033062|2.348638|3.959369|2.439286|2.193999|2.274260|2.677903|3.156106|2.958724|2.630833|4.144021|2.896091|2.777760|2.984865|5.053286|4.382197|3.164451|0.102631|2.647593|2.246886|1.982555|1.979244|2.234191|2.631949|5.501179|2.906765|3.471955|3.390126|3.357968|4.261176|10.289256|8.905149|17.574022|16.898246|4.465064|0.050483|0.053817|0.047183|0.052539|0.059688|0.058728|0.050868|0.069198|0.070571|0.054393|0.057257|0.105180|0.090587|0.060856|0.050035|0.049905|0.060161|0.073387|0.073047|0.109100|0.103018|0.081920|0.090296|0.080850|0.110904|0.114750|0.215178|0.213756|0.500000| |2.034427|2.226369|2.176377|2.674726|4.617883|2.964904|2.661595|2.829854|3.508541|4.293342|3.775131|3.461687|5.276469|3.873364|3.598699|3.766063|6.063194|5.590579|4.201836|0.143279|3.279155|2.705460|2.313403|2.273712|2.579230|3.155371|6.611909|3.288576|3.777479|3.566180|4.000782|4.902369|12.904273|8.930993|17.526349|16.479213|5.612404|0.055977|0.058414|0.050944|0.058093|0.063114|0.062775|0.053843|0.079189|0.079967|0.064349|0.070019|0.156192|0.113870|0.073623|0.057737|0.056312|0.067877|0.083095|0.080200|0.115599|0.102268|0.087419|0.105758|0.092353|0.116284|0.131583|0.174144|0.216804|0.301121|0.500000| 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