Version2.0 2020-07-20T09:33:37Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 31-May-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCC[NH+](CCCC)Cc1c(ccc2c1oc(c(c2=O)Oc3ccc(cc3)C(=O)OCCC)C)O C41584286 RHF 6-31G(d) (6D,7F) CCCC[NH+](CCCC)Cc1c(ccc2c1oc(c(c2=O)Oc3ccc(cc3)C(=O)OCCC)C)O C01[X(C29H38N1O6)] 216 C1 616 CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+](CCCC)CCCC)O CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+](CCCC)CCCC)O CCCC[NH+](CCCC)Cc1c(O)ccc2C(=O)C(=C(C)Oc12)Oc3ccc(cc3)C(=O)OCCC InChIKey=TXRWDFURIRYYTG-UHFFFAOYSA-O InChI=1S/C29H37NO6/c1-5-8-16-30(17-9-6-2)19-24-25(31)15-14-23-26(32)27(20(4)35-28(23)24)36-22-12-10-21(11-13-22)29(33)34-18-7-3/h10-15,31H,5-9,16-19H2,1-4H3/p+1 InChI=1/C29H37NO6/c1-5-8-16-30(17-9-6-2)19-24-25(31)15-14-23-26(32)27(20(4)35-28(23)24)36-22-12-10-21(11-13-22)29(33)34-18-7-3/h10-15,31H,5-9,16-19H2,1-4H3/p+1/fC29H38NO6/h30H/q+1 CCCC[NH+](CCCC)Cc1c(ccc2c1oc(c(c2=O)Oc3ccc(cc3)C(=O)OCCC)C)O C01[X(C29H38N1O6)] 216 C01 616 CCCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2C[NH+](CCCC)CCCC)O CCCC[NH](C[C]1[C]([CH][CH][C]2[C]1OC(=C(C2=O)O[C]1[CH][CH][C]([CH][CH]1)C(=O)OCCC)C)O)CCCC CCCC[NH](CCCC)C[C]1[C](O)[CH][CH][C]2[C]1OC(=C(O[C]3[CH][CH][C]([CH][CH]3)C(=O)OCCC)C2=O)C InChIKey=GEGLKEOTMVBCFE-UHFFFAOYSA-N InChI=1S/C29H38NO6/c1-5-8-16-30(17-9-6-2)19-24-25(31)15-14-23-26(32)27(20(4)35-28(23)24)36-22-12-10-21(11-13-22)29(33)34-18-7-3/h10-15,30-31H,5-9,16-19H2,1-4H3 InChI=1/C29H38NO6/c1-5-8-16-30(17-9-6-2)19-24-25(31)15-14-23-26(32)27(20(4)35-28(23)24)36-22-12-10-21(11-13-22)29(33)34-18-7-3/h10-15,30-31H,5-9,16-19H2,1-4H3 3765.7502198036 -1623.7673948 1-A 31175.5299 133 483 616 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.75755 -20.75039 -20.68870 -20.65107 -20.63873 -20.58956 -15.83237 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90.50 91.15 93.69 102.70 125.47 142.77 157.50 161.45 171.25 183.22 199.89 208.54 221.62 241.96 272.84 280.58 290.99 315.06 332.21 361.96 369.02 372.15 391.15 421.92 428.40 451.94 463.43 477.77 484.06 513.15 530.14 542.61 554.09 569.39 604.42 616.30 624.80 647.93 668.49 705.77 729.11 741.77 779.66 801.49 804.26 823.34 828.05 845.31 884.85 952.46 984.50 1014.29 1031.43 1073.68 1085.42 1110.83 1139.10 1143.12 1178.92 1181.72 1204.71 1234.60 1239.60 1243.36 1256.04 1290.04 1325.62 1333.88 1334.82 1347.42 1357.08 1389.11 1400.54 1404.45 1423.12 1440.19 1444.93 1451.74 1514.81 1532.64 1551.53 1553.37 1563.16 1574.11 1584.46 1601.25 1606.53 1616.15 1620.69 1625.42 1629.88 1630.78 1654.34 1684.94 1688.36 1725.67 1734.47 1753.37 1772.96 1788.58 1806.65 1814.82 1854.62 1867.78 1874.08 1874.62 1881.08 1894.48 1907.20 1936.34 1958.48 1969.11 1971.14 1995.35 2009.73 2018.41 2035.15 2048.42 2069.50 2077.00 2079.57 2083.11 2089.75 2090.99 2103.52 2107.10 2109.14 2126.95 2183.49 2192.46 2196.78 2220.11 2244.04 2257.07 2259.84 2262.68 2263.09 2263.47 2281.01 2284.36 2292.69 2314.13 2327.01 2332.38 2335.30 2352.44 2352.61 2357.85 2359.26 2362.26 2364.21 2364.24 2366.10 2367.64 2371.73 2374.90 2380.78 2385.99 2390.91 2402.06 2407.67 2429.81 2563.55 2592.53 2600.80 2608.20 2718.83 2856.97 2864.51 4602.06 4606.16 4610.86 4611.40 4613.47 4619.37 4620.00 4623.19 4631.96 4645.22 4648.08 4662.93 4675.65 4686.34 4688.31 4702.81 4709.95 4712.18 4712.59 4713.02 4714.73 4717.25 4733.21 4733.46 4756.90 4764.78 4804.74 4811.78 4829.25 4845.90 4856.71 4872.75 4891.68 4915.55 4916.77 4919.11 5315.51 5876.41 0.679079 0.714612 0.715556 0.605013 -1623.088316 -1623.052783 -1623.051839 -1623.162382 3.707630D-04 MUNgauss RevisionA2.0 retrievium 20-Jul-2020 DUDE CCCC[NH+](CCCC)Cc1c(ccc2c1oc(c(c2=O)Oc3ccc(cc3)C(=O)OCCC)C)O C41584286 RHF 6-31G(d) (6D,10F) C1 496.269913 |X|Y|Z| 68.424481 40.863332 157.554638 76.089634 17 6 8 15 2 |36.858105| |12.468553|36.858105| |7.494025|12.426738|36.858105| |4.895219|7.545721|12.491873|36.858105| |3.764458|4.917506|7.562890|12.654872|53.358707| |3.808636|4.735250|7.458201|9.278594|25.702977|0.500000| |3.400210|4.184654|5.934173|7.615377|17.191556|0.258346|36.858105| |2.894802|3.322484|4.462380|5.004491|10.255916|0.209150|12.488887|36.858105| |2.560432|2.845107|3.567661|3.826870|6.684291|0.132052|7.553509|12.426884|36.858105| |2.220161|2.392459|2.909483|3.030274|5.115198|0.106250|4.897655|7.495704|12.468355|36.858105| |3.024373|3.819282|4.994299|7.615509|17.168466|0.260391|7.648971|5.900107|4.181444|3.388374|36.858105| |2.934959|3.636963|4.511013|6.159717|10.326333|0.204718|4.982672|4.313689|3.251314|2.810605|12.666383|36.858105| |2.824125|3.332436|4.137919|4.951096|8.301690|0.194961|4.335816|4.130757|3.111917|2.803063|7.596950|13.732473|36.858105| |2.571715|2.939634|3.427400|3.858160|5.840882|0.132701|3.303873|3.193757|2.548420|2.361965|5.010118|7.831071|13.687524|36.858105| |2.440972|2.808115|3.123156|3.561858|5.073718|0.108679|2.923954|2.745893|2.257927|2.081369|4.437636|6.824967|8.005133|13.866573|36.858105| |2.507566|2.978295|3.264538|3.927653|5.418704|0.109702|3.085243|2.783818|2.299439|2.075784|4.994104|7.844557|6.893535|7.902103|13.658430|36.858105| |2.740876|3.387543|3.860538|5.089252|7.197686|0.138002|3.870777|3.342092|2.688387|2.357876|7.496918|13.622087|8.001100|6.867922|7.960831|13.769967|36.858105| |2.684631|3.374343|3.706716|5.042822|6.703390|0.120258|3.811370|3.172140|2.631032|2.272407|6.774872|8.149210|5.303456|4.628381|5.242535|8.014381|14.189332|73.516695| |2.417342|2.955957|3.076722|3.886141|5.001014|0.092417|3.030270|2.593088|2.231112|1.962911|4.567592|5.274832|4.018154|3.821519|4.571251|6.867982|8.068393|24.809660|36.858105| |2.248048|2.669183|2.740626|3.284647|4.259979|0.081808|2.602580|2.298005|1.990072|1.786561|3.760628|4.576594|3.800522|3.903778|5.045835|7.708661|6.884168|14.372056|14.317036|36.858105| |2.264918|2.648282|2.769758|3.243416|4.310622|0.085781|2.582599|2.332683|1.991991|1.810627|3.796706|5.044416|4.491798|5.059434|7.619660|12.891198|7.683504|11.983171|7.776159|12.918861|36.858105| |2.075420|2.362670|2.439257|2.753054|3.667841|0.074253|2.250284|2.072905|1.793927|1.654386|3.120033|3.990425|3.813301|4.510942|6.681123|8.103487|5.327252|8.425417|5.380230|8.096789|15.962604|73.516695| |2.006714|2.329278|2.340255|2.717174|3.513628|0.067844|2.223301|1.988648|1.760736|1.596434|2.995385|3.457285|3.003505|3.115809|3.878080|5.128842|4.627423|9.442528|8.197788|14.078251|7.849308|12.186679|73.516695| |1.990350|2.275538|2.226867|2.508049|3.175786|0.061958|2.022816|1.814510|1.618271|1.473634|2.605642|2.977071|2.666121|2.803082|3.440484|4.261057|3.797492|7.414717|5.686344|8.046050|6.129330|10.864709|24.718101|36.858105| |1.748464|1.959169|1.916800|2.122223|2.724238|0.053494|1.771357|1.612462|1.456940|1.340428|2.213541|2.481516|2.274404|2.402375|2.880256|3.376465|3.032297|5.798367|4.165126|5.340300|4.539092|8.623964|14.519492|13.742732|36.858105| |1.687281|1.861277|1.794103|1.945311|2.476611|0.048934|1.622790|1.482706|1.348485|1.245449|1.968491|2.183941|2.033610|2.150876|2.527454|2.860480|2.591594|4.874795|3.333010|4.026177|3.634565|6.989839|9.404227|7.989525|13.829483|36.858105| |1.820529|1.998778|1.891034|2.023007|2.529710|0.050118|1.649514|1.498372|1.359856|1.251875|1.975883|2.191718|2.047677|2.162707|2.522746|2.831916|2.579318|4.817956|3.223249|3.801748|3.503925|6.644417|8.195799|6.890279|7.914626|13.676273|36.858105| |2.097303|2.337247|2.186658|2.349385|2.880375|0.056900|1.847814|1.657265|1.489038|1.359049|2.241818|2.513294|2.321317|2.442903|2.876463|3.299980|3.006566|5.640275|3.799509|4.501572|4.105300|7.532111|9.239664|7.982427|6.871436|7.946309|13.747985|36.858105| |2.223058|2.546933|2.426462|2.689730|3.299819|0.064584|2.080710|1.847686|1.641457|1.487090|2.631942|3.007966|2.705862|2.836616|3.438814|4.187501|3.777487|7.262020|5.229170|6.665164|5.591832|9.723859|13.984157|13.780503|7.902394|6.869432|7.911047|13.746123|36.858105| |1.693690|1.822658|1.711342|1.796909|2.250609|0.044840|1.485265|1.359242|1.244086|1.151970|1.731430|1.896113|1.796376|1.893448|2.159233|2.354989|2.170653|4.007955|2.587456|2.937878|2.786545|5.280427|6.026458|4.478593|5.077451|7.698278|12.789649|7.556768|5.027128|36.858105| |1.531697|1.638165|1.550357|1.626263|2.059147|0.041079|1.371298|1.264300|1.164261|1.083844|1.586900|1.726711|1.644399|1.732596|1.960878|2.118003|1.958541|3.608761|2.313622|2.606639|2.483667|4.729016|5.363190|3.818790|4.544757|6.767436|8.056692|5.278214|3.992989|16.000936|73.516695| |1.795707|1.912870|1.767947|1.829055|2.264638|0.045258|1.493551|1.363354|1.247752|1.153674|1.716324|1.872787|1.782142|1.871956|2.110181|2.279233|2.118376|3.886332|2.457142|2.732543|2.626208|4.908651|5.372262|3.849154|4.007420|5.267107|8.116937|6.923816|4.604651|14.408078|15.293475|73.516695| |1.653633|1.731977|1.599639|1.635148|2.035935|0.040846|1.357337|1.248107|1.150887|1.069954|1.529996|1.652915|1.587342|1.662711|1.844092|1.958997|1.836100|3.347788|2.077081|2.268779|2.204494|4.111930|4.389186|2.997725|3.145799|3.952756|5.181962|4.561232|3.424821|8.110828|12.784269|23.737803|36.858105| |1.756372|1.813169|1.650543|1.660611|2.049303|0.041248|1.367680|1.255896|1.158845|1.076341|1.518315|1.632363|1.574382|1.641304|1.797706|1.893770|1.790841|3.247113|1.978355|2.125452|2.083098|3.837721|3.997780|2.661421|2.680803|3.178570|4.050068|3.961541|3.101732|5.266794|8.200346|14.249976|12.560334|36.858105| |1.589823|1.619510|1.481116|1.479638|1.840725|0.037154|1.241085|1.148197|1.067158|0.996737|1.357752|1.447866|1.405602|1.461441|1.581729|1.648773|1.568332|2.833649|1.707637|1.816757|1.789330|3.293048|3.397480|2.204824|2.241315|2.605049|3.125911|3.017017|2.486962|3.921937|6.638656|9.034523|7.557733|12.462866|36.858105| |2.294712|2.793585|2.843721|3.553853|4.508814|0.081751|2.884428|2.446013|2.166160|1.893948|3.942084|4.068016|3.200240|2.989138|3.377174|4.479986|5.236048|14.336228|12.764747|7.548631|4.921553|6.952022|11.683389|4.994802|3.911526|3.192865|3.069669|3.523467|4.590405|2.503396|4.018060|4.217901|2.023235|1.923897|1.670681|36.858105| |2.857123|3.287119|4.265752|4.825790|8.908402|0.240394|4.899772|5.110477|3.650802|3.332061|6.967426|8.216174|14.095043|7.934247|5.243836|4.630829|5.304365|7.273504|3.223580|3.020146|3.407189|5.345595|4.427823|2.251460|1.961868|1.781372|1.799399|2.016190|2.293747|1.605505|2.631353|2.849442|1.446274|1.445250|1.303967|2.722926|73.516695| |17.551675|8.772869|6.787205|4.521904|4.962385|0.106589|3.224231|2.833649|2.476222|2.187202|2.963547|2.961225|2.943883|2.722302|2.553829|2.561352|2.745980|4.653312|2.353966|2.226151|2.292914|3.769694|3.523257|1.970819|1.734741|1.677081|1.810949|2.083325|2.201378|1.688290|2.715428|3.186225|1.653189|1.758807|1.593909|2.192017|5.330096|0.500000| |17.581545|8.811112|5.471375|4.069398|4.343485|0.088440|2.916299|2.509649|2.263062|1.984537|2.672733|2.623178|2.512248|2.334362|2.261569|2.339257|2.518624|4.450155|2.310125|2.166869|2.162994|3.554681|3.490819|1.975535|1.744694|1.701664|1.854308|2.137195|2.228932|1.741135|2.792674|3.317406|1.727372|1.856994|1.682550|2.219763|4.445328|0.302023|0.500000| |17.551455|8.772020|6.787219|4.511789|4.955897|0.102308|3.470166|2.993204|2.707472|2.342190|2.884989|2.724808|2.633399|2.375916|2.231475|2.281615|2.507897|4.385163|2.216545|2.052033|2.060258|3.364615|3.275544|1.815245|1.609783|1.551973|1.659492|1.886523|1.996984|1.550772|2.513836|2.905744|1.516176|1.603868|1.466144|2.129560|4.853764|0.301313|0.302060|0.500000| |8.857842|17.528297|8.849717|6.928259|6.244816|0.116926|4.138072|3.216395|2.834812|2.355173|3.650181|3.359997|3.001263|2.645463|2.564099|2.772738|3.187287|5.881359|2.939329|2.608134|2.516460|3.980897|4.094580|2.246000|1.940950|1.843802|1.974140|2.297045|2.499974|1.802095|2.886386|3.353835|1.710704|1.786402|1.598811|2.880217|5.244741|0.172935|0.213356|0.210787|0.500000| 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|6.900514|8.859733|17.545637|8.802485|9.370140|0.189544|6.504917|4.943352|4.055266|3.233537|4.498563|3.885437|3.636363|3.022660|2.732199|2.823472|3.304981|5.706469|2.703834|2.414972|2.428044|3.845831|3.726473|1.993088|1.740878|1.635491|1.713486|1.952318|2.143866|1.564614|2.540352|2.868031|1.473641|1.520950|1.378341|2.555865|6.975892|0.169522|0.140980|0.204705|0.212045|0.173806|0.302905|0.500000| |4.511353|6.819420|8.750577|17.608370|12.412244|0.182684|7.413942|4.688471|3.815098|2.963802|6.600587|5.098726|4.052848|3.272664|3.115250|3.511345|4.519862|8.681975|3.878161|3.190958|3.025600|4.575173|4.778654|2.476291|2.104732|1.928944|1.999797|2.310957|2.640101|1.778225|2.867746|3.210532|1.616671|1.638465|1.462296|3.763988|7.000076|0.110865|0.108312|0.118770|0.205330|0.171180|0.172994|0.208288|0.500000| |4.552592|6.877894|8.861863|17.658711|12.386608|0.211088|5.635922|4.139730|3.240890|2.670572|7.580206|7.328475|5.540109|4.396457|4.207275|4.840142|6.489568|11.248133|4.701503|3.939284|3.907269|5.739398|5.600516|2.894772|2.391578|2.172872|2.269712|2.686791|3.147670|1.985997|3.165439|3.588162|1.780830|1.800850|1.586450|4.072881|8.700825|0.120399|0.109059|0.111478|0.170533|0.208510|0.214128|0.173340|0.302132|0.500000| |3.878466|4.757656|6.847508|7.612910|12.359420|0.208359|17.655830|8.864045|6.894786|4.559018|5.656884|4.146553|3.706667|2.947666|2.646956|2.781976|3.390614|6.013672|2.777074|2.409806|2.379472|3.726073|3.711011|1.930086|1.696595|1.570221|1.609763|1.805758|2.009782|1.460339|2.394512|2.630478|1.350777|1.371344|1.247622|2.685238|7.335202|0.099407|0.090826|0.113686|0.133395|0.111897|0.155990|0.239362|0.216840|0.149180|0.500000| |3.044097|3.755141|4.875542|6.547399|12.400602|0.183577|17.609161|8.756422|6.838493|4.518466|7.508225|4.738632|3.937357|3.068406|2.799048|3.034101|3.857533|7.112222|3.189294|2.677191|2.588525|3.983674|4.083646|2.067513|1.812046|1.649865|1.665203|1.858198|2.103804|1.493824|2.457047|2.654840|1.354614|1.357176|1.230774|3.129235|7.477391|0.079246|0.074525|0.085689|0.107270|0.095431|0.117960|0.142757|0.201713|0.143986|0.302800|0.500000| |2.594989|2.976641|3.874982|4.498392|9.343102|0.193241|8.805687|17.559615|8.852271|6.894281|6.443094|4.708590|4.566901|3.466187|2.941153|2.962613|3.567221|5.911848|2.695464|2.395546|2.452924|3.865898|3.665535|1.859775|1.654389|1.510327|1.513949|1.667738|1.871001|1.367411|2.266302|2.422413|1.244553|1.244462|1.136624|2.510346|10.248514|0.071357|0.063394|0.073153|0.079755|0.077453|0.106781|0.112953|0.116312|0.109313|0.173415|0.208316|0.500000| |3.071986|3.430651|4.704755|4.844983|9.387348|0.222736|8.885359|17.517487|8.840942|6.885361|5.174834|4.132778|4.207740|3.288585|2.766086|2.731017|3.196982|5.256301|2.442049|2.204966|2.277628|3.634845|3.398767|1.763010|1.569189|1.452209|1.475968|1.634529|1.809810|1.345064|2.222246|2.410341|1.244705|1.258611|1.152612|2.273212|9.804266|0.085341|0.072907|0.088822|0.089580|0.086030|0.133112|0.147400|0.120152|0.112295|0.213923|0.173029|0.303338|0.500000| |2.742988|3.004096|3.733571|3.825035|6.250547|0.123245|6.968975|8.842529|17.527293|8.859465|3.742216|2.977074|2.845185|2.367496|2.118555|2.162449|2.508606|4.403438|2.124497|1.899307|1.892495|3.041619|3.005831|1.569286|1.414261|1.317579|1.336904|1.466200|1.605410|1.228907|2.042465|2.202823|1.146391|1.160488|1.070779|2.079984|5.834837|0.072787|0.067064|0.082498|0.084011|0.073877|0.096520|0.123251|0.107553|0.088484|0.209132|0.171654|0.173702|0.211618|0.500000| |2.388318|2.686225|3.277965|3.649426|6.241032|0.117540|6.934147|8.847840|17.527950|8.858959|4.148740|3.173361|2.949975|2.432034|2.194886|2.272855|2.676970|4.769552|2.285807|2.017663|1.990107|3.174044|3.186466|1.636786|1.476019|1.360828|1.365259|1.490421|1.648121|1.246161|2.076946|2.212541|1.146524|1.149627|1.058146|2.257624|5.926635|0.063544|0.059459|0.069521|0.075781|0.068259|0.084979|0.100970|0.104826|0.087046|0.170920|0.206007|0.211857|0.173591|0.303587|0.500000| |2.286743|2.419288|2.953858|2.972919|4.952232|0.106851|4.523480|6.788375|8.772882|17.551215|3.207396|2.739575|2.806351|2.384909|2.078919|2.042865|2.291939|3.871462|1.886384|1.734328|1.776445|2.903130|2.755500|1.440446|1.310972|1.223424|1.234820|1.341821|1.461697|1.139964|1.905515|2.036849|1.064902|1.075120|0.997115|1.802996|6.056910|0.063354|0.056442|0.067388|0.065206|0.061552|0.082420|0.091850|0.079108|0.072971|0.120529|0.110996|0.169402|0.204239|0.210824|0.172946|0.500000| |2.055228|2.190702|2.592771|2.677399|4.338455|0.088705|4.071566|5.472062|8.811151|17.581848|2.911077|2.452160|2.426215|2.085637|1.867652|1.872200|2.107847|3.659466|1.805562|1.647780|1.657833|2.707527|2.644700|1.379065|1.262180|1.177080|1.182361|1.277474|1.390043|1.092816|1.833509|1.945844|1.019068|1.025500|0.953272|1.763902|4.984329|0.055912|0.051587|0.060580|0.060596|0.055952|0.070197|0.080080|0.074064|0.066065|0.109223|0.108495|0.140886|0.140750|0.213426|0.213404|0.302029|0.500000| |2.067339|2.242477|2.710498|2.887400|4.947085|0.103034|4.513481|6.790010|8.772500|17.551299|3.454254|2.891260|2.907372|2.451311|2.151371|2.135823|2.419105|4.115069|1.997419|1.823694|1.857003|3.018410|2.893669|1.492481|1.360058|1.258049|1.257196|1.360412|1.493914|1.153771|1.933591|2.044529|1.064983|1.066376|0.986791|1.915903|6.160125|0.056931|0.051647|0.059692|0.061095|0.058162|0.074827|0.081365|0.077991|0.072148|0.111595|0.118909|0.204517|0.169230|0.172947|0.210810|0.301290|0.302037|0.500000| |2.676922|3.239419|4.155899|5.612638|12.418354|0.219958|7.478914|6.812604|4.704423|3.859610|17.661751|8.922558|6.878243|4.662736|4.021017|4.308935|5.855793|9.425884|3.877604|3.298724|3.364324|5.051071|4.805331|2.353601|2.039925|1.819160|1.810126|2.020533|2.341389|1.599019|2.628612|2.806975|1.418425|1.404348|1.265391|3.439085|12.677953|0.073374|0.066116|0.072317|0.086627|0.088437|0.113563|0.109666|0.141987|0.148878|0.147458|0.208237|0.239284|0.157219|0.110816|0.130857|0.099413|0.090240|0.113236|0.500000| |2.919150|3.736422|4.606554|7.200093|12.386465|0.182804|6.823545|5.018735|3.878395|3.116408|17.678221|8.878444|5.599753|4.165624|3.967355|4.732345|7.196491|14.295809|5.248681|4.035738|3.820274|5.508454|5.717875|2.756587|2.326889|2.052958|2.051435|2.330320|2.763501|1.786281|2.908058|3.134112|1.565223|1.546581|1.379301|4.747260|8.917515|0.077738|0.072931|0.077321|0.103306|0.104287|0.117479|0.115943|0.200741|0.202736|0.148081|0.216867|0.146927|0.119617|0.098206|0.111768|0.080614|0.076307|0.087679|0.301666|0.500000| |2.430308|2.692446|3.112037|3.343671|5.048948|0.117092|2.983288|2.982563|2.418036|2.294314|4.094720|5.601588|8.878510|17.718893|8.919003|5.621118|4.949533|6.524283|3.153993|3.254572|4.110440|6.912676|4.813095|2.489481|2.182262|1.984281|1.999560|2.229053|2.524781|1.777447|2.910834|3.136305|1.583761|1.569593|1.408869|2.559808|12.720867|0.072463|0.061405|0.062869|0.067126|0.079091|0.098603|0.077804|0.079607|0.102224|0.075035|0.076325|0.089579|0.087212|0.062596|0.063473|0.065269|0.056388|0.066269|0.110005|0.095986|0.500000| |2.239544|2.515734|2.725156|3.009026|4.210259|0.090094|2.515337|2.392154|2.011999|1.879963|3.550272|4.929651|5.663361|8.927667|17.746952|8.975604|5.678274|7.536289|3.974381|4.618800|7.111155|13.288255|6.693107|3.446632|2.950325|2.612866|2.599882|2.922693|3.424590|2.234040|3.618901|3.863427|1.900835|1.842363|1.621347|3.030955|7.482958|0.065437|0.058381|0.056940|0.064080|0.076878|0.082234|0.067038|0.074451|0.096753|0.064257|0.067164|0.070675|0.067298|0.052784|0.054382|0.052375|0.047290|0.053946|0.091433|0.090431|0.213594|0.500000| |1.630806|1.823151|1.805582|2.007767|2.620071|0.051428|1.718539|1.576737|1.430895|1.322513|2.150653|2.395831|2.200838|2.320461|2.764380|3.216299|2.905214|5.553510|3.956598|4.976354|4.259585|8.094876|13.438994|8.956056|17.749460|8.885010|5.621854|4.954013|5.647117|4.125291|6.964965|5.925402|2.737381|2.355856|2.017801|3.771979|3.389410|0.044944|0.044982|0.042037|0.050281|0.055449|0.049760|0.045905|0.055456|0.062231|0.045478|0.049083|0.045222|0.042456|0.038412|0.040432|0.035820|0.034649|0.037454|0.055721|0.062884|0.058754|0.078706|0.500000| |1.542871|1.685500|1.629581|1.755428|2.253917|0.044656|1.492478|1.374570|1.259003|1.169608|1.785337|1.962480|1.843833|1.948829|2.258963|2.507730|2.288197|4.275642|2.859566|3.363042|3.098302|5.982145|7.589633|5.665752|8.937228|17.755420|8.940922|5.662020|4.953198|7.203480|13.557917|8.589372|3.869807|3.043354|2.559763|2.781028|2.902459|0.042636|0.043264|0.039682|0.046466|0.051378|0.045036|0.041606|0.048447|0.053841|0.040165|0.042175|0.038925|0.037415|0.034179|0.035326|0.031920|0.030814|0.032854|0.046280|0.051574|0.050452|0.065164|0.213215|0.500000| |2.235458|2.465947|2.258084|2.378752|2.872805|0.056988|1.843510|1.649516|1.483149|1.352191|2.190745|2.439004|2.270596|2.378651|2.748644|3.089123|2.854606|5.293812|3.427383|3.885487|3.654320|6.616441|7.452514|5.672361|4.954711|5.652055|8.935561|17.762570|8.941623|6.960082|8.632326|13.966202|5.068182|4.667438|3.395877|3.197997|3.541172|0.061751|0.064082|0.055361|0.067074|0.079377|0.062360|0.055827|0.064808|0.075367|0.050524|0.051127|0.045750|0.045461|0.040820|0.041040|0.037235|0.035325|0.037402|0.054676|0.062856|0.060722|0.077252|0.107602|0.124501|0.500000| |2.531585|2.969206|2.809141|3.149149|3.767303|0.073366|2.325994|2.033977|1.786272|1.602903|2.990391|3.457161|3.050955|3.156983|3.826372|4.803800|4.424905|8.564627|6.052372|7.294253|6.134394|9.805327|12.566742|8.893104|5.626144|4.952417|5.639197|8.921769|17.746008|4.093429|5.930232|7.095851|3.089637|2.922076|2.367238|5.050269|4.541180|0.069450|0.070149|0.062359|0.080402|0.097481|0.076995|0.067678|0.085190|0.105427|0.062457|0.065005|0.056930|0.055395|0.048603|0.049645|0.043803|0.041409|0.044565|0.072311|0.087309|0.076760|0.102667|0.124204|0.107567|0.215829|0.500000| |1.560830|1.628610|1.519125|1.551742|1.950186|0.039309|1.301055|1.204669|1.110997|1.038037|1.470219|1.595446|1.545353|1.631964|1.811733|1.903614|1.767630|3.191496|1.971507|2.171222|2.143133|4.057517|4.199001|2.842767|3.033807|3.811455|4.761032|4.088659|3.164520|7.274293|12.938736|16.518298|17.613542|8.803651|6.828303|1.902618|2.505429|0.043620|0.045019|0.039886|0.044451|0.049761|0.042404|0.038968|0.042415|0.046863|0.035860|0.036003|0.033476|0.033436|0.030669|0.030707|0.028740|0.027460|0.028770|0.038050|0.041568|0.043448|0.052389|0.074374|0.106661|0.121469|0.079145|0.500000| |1.567408|1.643942|1.520667|1.560027|1.947254|0.038906|1.307741|1.202604|1.114886|1.036606|1.465068|1.568661|1.498985|1.558516|1.720316|1.836535|1.738399|3.199441|1.991290|2.153599|2.062482|3.813773|4.202338|2.841095|3.030825|3.806991|4.758186|4.089726|3.165130|7.269110|12.932307|16.516923|17.612646|8.803319|6.827887|1.972624|2.437456|0.043253|0.045494|0.040163|0.045477|0.050079|0.041939|0.039120|0.043161|0.046925|0.036174|0.036424|0.033304|0.033198|0.030866|0.030958|0.028587|0.027505|0.028660|0.037846|0.041849|0.041191|0.048970|0.074274|0.106471|0.121625|0.079209|0.302393|0.500000| |1.864358|1.930173|1.735667|1.745175|2.132288|0.042701|1.424390|1.298824|1.199412|1.108403|1.572306|1.678888|1.605578|1.657685|1.809508|1.924398|1.841653|3.372306|2.055986|2.181205|2.107255|3.822143|4.086069|2.712465|2.684667|3.134429|4.010478|4.080950|3.211215|4.944330|7.510847|13.056044|8.932366|17.541166|8.828697|2.021433|2.622429|0.051406|0.055216|0.047156|0.053220|0.059519|0.047828|0.044370|0.048126|0.052550|0.039833|0.039336|0.035612|0.036082|0.033463|0.033094|0.030707|0.029350|0.030419|0.040222|0.044719|0.043795|0.050978|0.065294|0.082066|0.137254|0.085187|0.173753|0.212164|0.500000| |1.853359|1.905572|1.733404|1.733657|2.136165|0.043235|1.415805|1.301438|1.194601|1.110162|1.578692|1.711802|1.662837|1.746702|1.916577|2.001844|1.876474|3.363118|2.034348|2.199549|2.193341|4.067069|4.083159|2.714036|2.686852|3.137070|4.012432|4.080152|3.210738|4.946305|7.512503|13.058011|8.933027|17.542052|8.828550|1.946530|2.707471|0.052025|0.054377|0.046711|0.051600|0.058989|0.048519|0.044149|0.047101|0.052465|0.039416|0.038809|0.035822|0.036388|0.033214|0.032789|0.030897|0.029296|0.030551|0.040468|0.044378|0.046531|0.054862|0.065364|0.082157|0.137041|0.085112|0.212177|0.173756|0.303152|0.500000| |1.504396|1.530246|1.412564|1.412066|1.770379|0.035865|1.193824|1.110769|1.032284|0.968255|1.310112|1.402493|1.370443|1.434048|1.553160|1.606331|1.517180|2.722415|1.637574|1.753636|1.744635|3.242309|3.282222|2.122750|2.179462|2.536260|2.990982|2.838866|2.361326|3.762066|6.567604|8.288845|6.834777|8.764610|17.545131|1.591441|2.261369|0.042137|0.043933|0.038645|0.041772|0.046251|0.039468|0.036573|0.038612|0.042032|0.033239|0.032845|0.030633|0.031019|0.028708|0.028407|0.026938|0.025719|0.026686|0.034047|0.036831|0.038591|0.044542|0.054895|0.070104|0.086972|0.062136|0.202044|0.167915|0.172589|0.210196|0.500000| 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