Version2.0 2020-07-29T15:53:09Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 06-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1ccc(cc1)N2C(=O)[C@@H]3[C@H](N[C@@]4([C@@H]3C2=O)c5ccccc5NC4=O)CC6=c7ccccc7=[NH+]C6 C63479827 RHF 6-31G(d) (6D,7F) Cc1ccc(cc1)N2C(=O)[C@@H]3[C@H](N[C@@]4([C@@H]3C2=O)c5ccccc5NC4=O)CC6=c7ccccc7=[NH+]C6 C01[X(C29H25N4O3)] 177 C1 590 Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2c1cccc2 Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2c1cccc2 Cc1ccc(cc1)N2C(=O)[C@@H]3[C@@H](CC4=C5C=CC=CC5=[NH+]C4)N[C@]6([C@@H]3C2=O)C(=O)Nc7ccccc67 InChIKey=TUCSZQQUKJAZMA-GBXYDCMPSA-O InChI=1S/C29H24N4O3/c1-16-10-12-18(13-11-16)33-26(34)24-23(14-17-15-30-21-8-4-2-6-19(17)21)32-29(25(24)27(33)35)20-7-3-5-9-22(20)31-28(29)36/h2-13,23-25,32H,14-15H2,1H3,(H,31,36)/p+1/t23-,24-,25+,29-/m1/s1 InChI=1/C29H24N4O3/c1-16-10-12-18(13-11-16)33-26(34)24-23(14-17-15-30-21-8-4-2-6-19(17)21)32-29(25(24)27(33)35)20-7-3-5-9-22(20)31-28(29)36/h2-13,23-25,32H,14-15H2,1H3,(H,31,36)/p+1/t23-,24-,25+,29-/m1/s1/fC29H25N4O3/h30-31H/q+1 Cc1ccc(cc1)N2C(=O)[C@@H]3[C@H](N[C@@]4([C@@H]3C2=O)c5ccccc5NC4=O)CC6=c7ccccc7=[NH+]C6 C01[X(C29H25N4O3)] 177 C01 590 Cc1ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CC2=c3ccccc3=[NH+]C2)C(=O)Nc2c1cccc2 C[C]1[CH][CH][C]([CH][CH]1)N1C(=O)[C@H]2[C@@H](C1=O)[C@@]1(N[C@@H]2CC2=[C]3[CH]=[CH][CH]=[CH][C]3[NH]C2)C(=O)N[C]2[C]1[CH][CH][CH][CH]2 C[C]1[CH][CH][C]([CH][CH]1)N2C(=O)[C@@H]3[C@@H](CC4=C5C=CC=C[C]5NC4)N[C@]6([C]7[CH][CH][CH][CH][C]7NC6=O)[C@@H]3C2=O InChIKey=PMVBJKFRDOJFBU-GBXYDCMPSA-N InChI=1S/C29H25N4O3/c1-16-10-12-18(13-11-16)33-26(34)24-23(14-17-15-30-21-8-4-2-6-19(17)21)32-29(25(24)27(33)35)20-7-3-5-9-22(20)31-28(29)36/h2-13,23-25,30,32H,14-15H2,1H3,(H,31,36)/t23-,24-,25+,29-/m1/s1 InChI=1/C29H25N4O3/c1-16-10-12-18(13-11-16)33-26(34)24-23(14-17-15-30-21-8-4-2-6-19(17)21)32-29(25(24)27(33)35)20-7-3-5-9-22(20)31-28(29)36/h2-13,23-25,30,32H,14-15H2,1H3,(H,31,36)/t23-,24-,25+,29-/m1/s1/f/h31H 3788.9341630718 -1554.9968033 1-A 18134.2110 125 465 590 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.65199 -20.64670 -20.63757 -15.76167 -15.71598 -15.69749 -15.66814 -11.46979 -11.46750 -11.46246 -11.45399 -11.43667 -11.42134 -11.40783 -11.39751 -11.39430 -11.38820 -11.38665 -11.37498 -11.37041 -11.36647 -11.36018 -11.35871 -11.35656 -11.35311 -11.32532 -11.32405 -11.31897 -11.31518 -11.31502 -11.31499 -11.31285 -11.30497 -11.30283 -11.30151 -11.28449 -1.52770 -1.50662 -1.50408 -1.46656 -1.38617 -1.37982 -1.35369 -1.29127 -1.25451 -1.23969 -1.23136 -1.19055 -1.17772 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1722.62 1726.05 1749.92 1766.20 1774.47 1816.68 1827.58 1859.66 1863.57 1876.39 1881.90 1893.65 1910.68 1912.11 1919.74 1930.14 1954.33 1961.33 1963.50 1998.00 2020.07 2039.33 2054.80 2061.90 2083.13 2100.94 2104.22 2147.81 2162.64 2185.14 2204.83 2222.99 2237.67 2249.35 2256.79 2257.96 2261.52 2275.60 2299.43 2303.48 2334.82 2348.31 2356.87 2368.42 2379.53 2391.32 2440.42 2501.71 2542.44 2561.97 2588.16 2618.67 2629.57 2657.29 2827.24 2838.20 2964.00 4619.22 4635.70 4647.89 4656.51 4700.66 4702.85 4731.33 4734.66 4782.16 4832.51 4843.21 4845.07 4854.95 4870.11 4871.44 4874.95 4877.79 4886.11 4895.85 4902.66 4905.53 4918.76 5489.25 5575.76 5579.97 0.528081 0.555453 0.556397 0.465453 -1554.468722 -1554.441350 -1554.440406 -1554.531350 3.050277D-04 MUNgauss RevisionA2.0 retrievium 29-Jul-2020 DUDE Cc1ccc(cc1)N2C(=O)[C@@H]3[C@H](N[C@@]4([C@@H]3C2=O)c5ccccc5NC4=O)CC6=c7ccccc7=[NH+]C6 C63479827 RHF 6-31G(d) (6D,10F) C1 477.192666 |X|Y|Z| 87.172559 97.402778 32.369815 65.017528 32 6 7 28 4 |36.858105| |12.612910|36.858105| |7.539953|13.717523|36.858105| |5.008595|7.890198|13.756602|36.858105| |4.435015|6.839855|7.965904|13.798194|36.858105| |5.015844|7.886406|6.892069|7.947202|13.765481|36.858105| |7.556640|13.684303|7.981282|6.897086|7.969889|13.789808|36.858105| |3.324675|4.514539|5.140905|7.812810|13.279371|7.814303|5.145892|53.358707| |2.887200|3.726060|4.255000|5.980431|7.695760|5.501049|4.073470|18.909467|36.858105| |2.928852|3.730603|4.301542|5.784687|6.604357|4.991334|3.944197|11.325488|15.954464|73.516695| |2.385349|2.939100|3.266017|4.250097|5.110556|4.099892|3.197899|11.085467|12.599839|14.063314|36.858105| |2.205006|2.663984|2.885568|3.593734|4.273736|3.660501|2.920288|8.273287|8.919346|12.486217|17.660337|0.500000| |2.192677|2.640664|3.017719|3.857598|4.169297|3.327526|2.744857|7.857827|7.583210|10.881583|12.217538|0.239732|36.858105| |2.348848|2.848513|3.370824|4.408092|4.490611|3.447400|2.881107|8.080056|7.715121|11.988527|8.742554|0.179924|17.561701|0.500000| |2.079194|2.474860|2.797073|3.495951|3.761883|3.081874|2.573338|6.834660|5.477533|7.825883|7.895345|0.168290|13.087948|0.254474|53.358707| |2.093238|2.499248|2.737622|3.385503|3.860939|3.281293|2.683780|7.189347|5.301557|7.252728|7.836130|0.172825|7.932275|0.166341|17.731291|36.858105| |2.383177|2.932959|3.180386|4.068671|5.084500|4.253909|3.268605|10.969883|7.882805|9.478402|12.463806|0.241465|7.727039|0.169186|10.829942|12.297149|36.858105| |2.269053|2.752543|2.883474|3.544725|4.477675|4.058846|3.141512|8.743266|6.263657|8.193140|8.705428|0.221146|5.684529|0.128740|7.864540|8.703666|17.581879|0.500000| |2.891827|3.725684|4.065904|5.485118|7.662178|5.978204|4.259231|18.590025|8.248850|9.801119|7.928969|0.163211|5.760844|0.150159|7.912753|7.199508|12.484444|0.251927|36.858105| |2.960556|3.766455|3.985291|5.053657|6.672858|5.826567|4.338320|11.357680|5.550849|7.486128|5.356067|0.121027|4.400526|0.117554|6.466746|5.938357|7.829479|0.190506|16.111948|73.516695| |2.022173|2.376442|2.575670|3.087193|3.432183|3.009619|2.532466|5.853953|3.984366|5.732018|4.953864|0.116626|5.099483|0.122563|10.440503|12.561801|7.125519|0.169434|5.922736|10.486294|36.858105| |2.140028|2.507974|2.735613|3.242324|3.501038|3.067305|2.631110|5.634055|3.635130|5.337273|4.104857|0.096266|4.252945|0.110755|7.951226|7.208446|5.475467|0.131075|5.557323|11.041998|13.820112|36.858105| |1.946267|2.221205|2.377678|2.707670|2.870399|2.612473|2.314937|4.390286|2.879850|4.383134|3.176189|0.077736|3.279497|0.086540|5.754289|4.936093|3.996641|0.102247|4.062092|8.215552|7.980196|13.694900|36.858105| |1.727928|1.947435|2.056384|2.313745|2.470267|2.292585|2.043269|3.788403|2.562940|3.949576|2.887894|0.072908|2.968732|0.076703|5.141093|4.479402|3.581444|0.095569|3.436901|6.703215|6.901173|7.912427|13.764306|36.858105| |1.660531|1.879339|1.980778|2.248926|2.438148|2.261694|1.990947|3.839788|2.669199|4.092209|3.132193|0.080456|3.207701|0.080098|5.639143|5.171891|3.925501|0.107311|3.501959|6.537742|7.859563|6.783780|7.878845|13.695904|36.858105| |1.778726|2.047064|2.178009|2.533644|2.795818|2.541801|2.184792|4.600091|3.239596|4.837733|4.013222|0.101500|4.104789|0.098288|7.687363|8.066761|5.309023|0.142380|4.345784|7.756625|13.708870|7.965563|6.954054|8.064544|13.854460|36.858105| |1.697502|1.951517|2.068413|2.408300|2.680945|2.448256|2.094727|4.482760|3.318277|4.989723|4.334456|0.115364|4.374314|0.100088|7.789720|8.118804|5.480778|0.154981|4.085855|6.864515|8.353283|5.325648|4.615228|5.137561|7.633954|13.587539|53.358707| |1.824011|2.128389|2.279241|2.715459|3.068918|2.738500|2.294034|5.387567|4.175938|6.107173|6.070063|0.161790|6.016476|0.126814|10.645208|12.293540|7.649924|0.207890|4.896036|7.600701|8.019269|5.088019|4.076213|4.128757|5.279324|8.354598|19.269694|36.858105| |1.756397|2.040040|2.174253|2.572591|2.905221|2.616751|2.201507|5.058053|4.152595|6.262131|6.161102|0.186872|5.910934|0.122893|8.689632|7.779837|6.512650|0.187465|4.284841|6.515198|5.372611|3.891654|3.244537|3.287989|4.036381|5.537742|11.388754|15.855606|73.516695| |1.905214|2.230339|2.498854|3.034132|3.207665|2.700707|2.303725|5.536704|5.230135|8.652089|7.309854|0.200902|12.317821|0.246766|10.554120|5.555565|5.182885|0.122413|4.009636|5.839205|3.981705|3.339189|2.743275|2.590052|2.852510|3.540944|5.440063|5.340555|10.633739|36.858105| |1.903508|2.216374|2.461999|2.941836|3.103242|2.658903|2.289572|5.173550|5.111752|9.464154|6.231496|0.194671|7.441609|0.184482|6.810726|4.123506|4.285878|0.106938|3.523698|5.167559|3.137460|2.727942|2.301138|2.182384|2.372398|2.846558|4.337766|4.056530|8.343631|12.725705|36.858105| |1.776199|2.044086|2.214413|2.583503|2.772425|2.466507|2.139590|4.522508|4.309507|8.016689|5.136015|0.177170|5.244553|0.128821|5.407762|3.572279|3.790681|0.100515|3.122187|4.665290|2.791281|2.421024|2.084183|2.012239|2.207785|2.617189|4.075480|3.740927|8.079881|7.438177|14.044114|36.858105| |1.644192|1.877388|1.997092|2.301876|2.511206|2.292530|1.991022|4.088343|3.701065|6.537987|4.568463|0.162175|4.439105|0.105355|5.008665|3.518849|3.669823|0.102273|2.946979|4.481045|2.780762|2.367287|2.064371|2.035813|2.279319|2.702978|4.370743|3.988151|9.218932|5.871778|7.436577|13.191840|36.858105| |1.544496|1.741959|1.826724|2.064415|2.246190|2.100433|1.851308|3.546783|3.115575|5.614145|3.609387|0.123677|3.418223|0.084435|3.997974|2.878735|3.039957|0.086747|2.542157|3.948472|2.369288|2.057202|1.827032|1.813116|2.014806|2.332064|3.711578|3.232047|7.149392|4.172251|5.141055|7.964175|14.191851|36.858105| |1.544062|1.728974|1.809054|2.020033|2.170663|2.041968|1.824357|3.340805|2.934783|5.511804|3.201458|0.106303|3.037508|0.078053|3.513612|2.496175|2.676559|0.075440|2.329436|3.639252|2.091152|1.858319|1.658435|1.630845|1.780357|2.031219|3.136139|2.683137|5.650376|3.605268|4.652699|6.894491|7.862417|13.179639|36.858105| |1.639734|1.840904|1.946158|2.177038|2.307352|2.143337|1.921578|3.521965|3.159086|6.188010|3.325137|0.108305|3.203782|0.084680|3.596063|2.489702|2.693179|0.074097|2.388806|3.704974|2.078929|1.869384|1.657883|1.609808|1.736523|1.981464|3.003186|2.582539|5.309368|3.807083|5.288269|7.659186|6.599076|7.703995|14.049628|36.858105| |1.771486|2.017798|2.175760|2.488031|2.624552|2.367185|2.093446|4.100149|3.841584|7.663681|4.102369|0.134044|4.080942|0.108131|4.338275|2.899764|3.136738|0.083799|2.742436|4.167226|2.358898|2.108531|1.840252|1.768699|1.906935|2.207816|3.341866|2.947188|6.064571|5.106045|8.410107|13.198500|7.628762|6.813804|8.080212|13.456637|36.858105| |1.886458|2.153849|2.365949|2.712237|2.781645|2.460103|2.193054|4.271222|4.040437|8.525369|4.063374|0.124416|4.207666|0.118786|4.378724|2.838795|3.069827|0.079774|2.774184|4.211912|2.329372|2.121453|1.844497|1.748999|1.858030|2.140439|3.162285|2.767496|5.483620|5.073528|8.267192|8.448096|5.289039|4.656063|5.259399|7.717808|14.501151|53.358707| |1.889091|2.134290|2.336485|2.626572|2.652026|2.372407|2.152068|3.943550|3.621684|7.783376|3.491190|0.104450|3.563333|0.102955|3.832728|2.516079|2.728395|0.071337|2.538687|3.909629|2.111029|1.952518|1.713159|1.621716|1.707314|1.942600|2.834247|2.434656|4.742933|4.068601|5.825943|5.923681|4.232269|3.950115|4.641032|6.810942|9.279559|26.021377|0.500000| |2.005112|2.326276|2.624101|3.105275|3.147178|2.675624|2.349845|4.985108|4.890423|10.195479|5.023743|0.145451|5.763489|0.170445|5.544710|3.383624|3.602463|0.089716|3.218512|4.793018|2.708802|2.457907|2.096227|1.962564|2.080489|2.431706|3.564626|3.182778|6.196118|7.204443|12.706301|8.214556|5.080374|4.104697|4.154324|5.195350|8.363174|17.900403|0.244161|36.858105| |17.543118|8.862730|6.074632|4.379057|3.986740|4.525665|6.483791|4.191903|2.645877|4.669944|2.240209|0.057454|2.071133|0.061132|2.723452|2.033393|2.286788|0.060766|2.778772|5.198064|2.000951|2.144998|1.976715|1.751137|1.666453|1.766606|2.273297|1.774182|3.014121|1.800122|1.778134|1.662057|1.553009|1.459336|1.449418|1.526602|1.644099|2.364201|0.048064|1.850094|0.500000| |17.568962|8.844393|5.727134|4.232020|3.970189|4.665171|6.947216|4.176449|2.722608|4.964286|2.263883|0.059049|2.061124|0.060709|2.643905|1.966406|2.248929|0.060326|2.677151|4.827819|1.888132|1.971393|1.800862|1.618820|1.568647|1.679555|2.202784|1.739206|3.003902|1.814866|1.834324|1.733359|1.612095|1.528491|1.537747|1.630910|1.743338|2.513081|0.051631|1.932134|0.302205|0.500000| |17.586684|8.837084|7.189972|4.730180|3.965890|4.176161|5.590860|4.172161|2.732239|5.008705|2.270415|0.058324|2.131022|0.064128|2.741625|1.994107|2.235347|0.058642|2.662920|4.787607|1.924343|2.038038|1.858685|1.651907|1.586397|1.696117|2.206137|1.741448|2.988562|1.867447|1.871639|1.737837|1.597352|1.500159|1.507245|1.611043|1.744537|2.554333|0.052560|1.997367|0.301936|0.301642|0.500000| |6.981862|8.914816|17.717698|8.953202|5.667706|4.961982|5.660210|5.681338|3.651377|6.691197|2.909421|0.072005|2.790931|0.087613|3.543284|2.498173|2.806846|0.070655|3.443551|6.018887|2.373700|2.537011|2.237132|1.940665|1.860212|2.026090|2.615999|2.101338|3.570295|2.356988|2.324779|2.084253|1.872842|1.717716|1.710012|1.847654|2.063358|3.084098|0.062704|2.513380|0.159752|0.146288|0.218946|0.500000| |4.085637|5.626196|8.913151|17.723356|8.929209|5.650454|4.964961|9.761386|6.111309|10.646164|4.461155|0.102577|4.339968|0.146412|5.286586|3.567659|4.120954|0.096696|5.262854|8.371675|3.219677|3.384346|2.792486|2.372472|2.307045|2.614690|3.379296|2.818848|4.734150|3.352538|3.199569|2.726366|2.387550|2.113640|2.063105|2.240939|2.607989|3.940195|0.077419|3.430306|0.101751|0.097692|0.112489|0.216035|0.500000| |4.091634|5.622738|4.962884|5.652744|8.921315|17.730028|8.919906|9.774132|5.286208|8.279121|4.169056|0.106272|3.260091|0.090603|4.144281|3.362407|4.487429|0.125625|6.120968|10.668000|3.070808|3.057395|2.616941|2.333846|2.333072|2.632311|3.489413|2.866663|4.894504|2.677369|2.638227|2.497050|2.369261|2.183904|2.105020|2.176653|2.376196|3.287565|0.064247|2.591400|0.106031|0.110375|0.096140|0.107694|0.124273|0.500000| |7.012998|8.905126|5.661659|4.964214|5.667874|8.965130|17.713187|5.685369|3.449198|5.961483|2.823564|0.073237|2.429784|0.069763|3.130434|2.425520|2.915883|0.079909|3.656189|6.732016|2.313607|2.392184|2.145654|1.920845|1.875004|2.035447|2.667219|2.121577|3.638124|2.082439|2.079841|1.975495|1.863420|1.754172|1.732817|1.810078|1.941637|2.737842|0.055030|2.120237|0.178315|0.203806|0.141344|0.124216|0.107722|0.216109|0.500000| |2.148200|2.555222|2.939139|3.680245|3.812388|3.078914|2.607380|6.637491|4.998516|7.315352|6.198671|0.133866|9.235871|0.240120|25.975048|9.295381|6.462298|0.134349|5.578974|8.534476|7.493534|6.591959|4.641907|3.940335|4.091799|5.277916|6.634229|5.865620|8.596648|6.030488|4.254308|3.408229|3.125059|2.569788|2.311200|2.389065|2.851625|4.011926|0.073108|3.718931|0.057697|0.055126|0.058147|0.076819|0.116648|0.082696|0.064277|0.500000| |2.394168|2.852495|3.181573|3.848688|4.081637|3.458423|2.954502|6.467139|3.990713|5.824510|4.265486|0.097309|4.415747|0.120653|7.839374|6.446641|5.504639|0.126637|6.305474|12.907329|8.892149|17.750594|8.919672|5.643916|4.908342|5.644574|5.862574|4.406388|6.295155|3.348153|2.771848|2.426878|2.322240|2.020799|1.849938|1.885305|2.140415|2.977996|0.056236|2.557545|0.066611|0.060391|0.063355|0.081614|0.112862|0.093097|0.073193|0.192392|0.500000| |1.979481|2.235004|2.389005|2.668852|2.769893|2.541676|2.299165|4.085639|2.653373|4.103787|2.826802|0.069470|2.914972|0.078986|4.903219|3.999817|3.436788|0.088192|3.650420|7.513315|5.669165|8.913331|17.740235|8.928412|5.625008|4.995795|4.985982|3.342246|4.914960|2.459927|2.103031|1.907546|1.874768|1.674893|1.538088|1.546220|1.709256|2.350591|0.044933|1.953024|0.056439|0.050556|0.052651|0.063016|0.076230|0.069848|0.059322|0.111553|0.215723|0.500000| |1.620158|1.800883|1.886954|2.086295|2.204689|2.074295|1.879613|3.306175|2.245996|3.518613|2.484086|0.063566|2.547911|0.066679|4.258671|3.577208|2.988556|0.080783|2.914278|5.687077|4.967429|5.639349|8.939846|17.727170|8.935130|5.706423|5.625858|3.392207|4.998075|2.270386|1.947712|1.811784|1.836749|1.655569|1.499243|1.478387|1.610352|2.168856|0.041303|1.770395|0.045875|0.042273|0.043128|0.049829|0.059170|0.058578|0.049512|0.090649|0.124310|0.215872|0.500000| |1.525973|1.709519|1.788045|2.006134|2.167362|2.036304|1.810443|3.372419|2.379777|3.707373|2.776932|0.073099|2.832423|0.070867|4.789131|4.233633|3.362502|0.094200|2.989992|5.516782|5.602231|4.906392|5.612770|8.849574|17.728723|8.889047|9.239398|4.648172|6.669883|2.608177|2.205258|2.086226|2.186106|1.955255|1.723154|1.665776|1.809143|2.380783|0.044749|1.933578|0.042545|0.040304|0.040569|0.046845|0.056958|0.058610|0.047780|0.095158|0.106780|0.123729|0.214267|0.500000| |1.567247|1.781635|1.872973|2.148020|2.373685|2.202244|1.909476|3.876743|2.895605|4.462646|3.676506|0.101363|3.698423|0.086358|6.172458|5.764018|4.385823|0.127861|3.412872|5.792575|5.885474|4.256642|3.926938|4.543315|6.709628|8.901652|26.031610|9.255322|13.034115|3.563438|2.933822|2.831778|3.119426|2.699957|2.264373|2.136779|2.338391|2.978452|0.054685|2.420546|0.042887|0.041750|0.041645|0.048602|0.061238|0.064261|0.050091|0.109841|0.098488|0.089383|0.106841|0.191417|0.500000| |1.778258|2.064657|2.270375|2.713255|2.918824|2.524853|2.157491|5.012946|4.514589|7.284797|6.541462|0.193446|8.882497|0.175537|10.008128|5.867113|5.162627|0.127805|3.810433|5.654186|4.168453|3.357374|2.792043|2.707759|3.077962|3.888206|6.371933|6.519431|14.411352|17.690181|8.994090|7.077985|6.661694|4.542185|3.688472|3.689264|4.681423|5.891104|0.098352|5.421796|0.047035|0.047289|0.048146|0.059315|0.081382|0.070834|0.054833|0.152982|0.090370|0.068564|0.065732|0.079077|0.117301|0.500000| |1.821677|2.107894|2.380646|2.848332|2.911866|2.457291|2.139185|4.827202|4.321905|7.354348|5.422855|0.143425|8.884702|0.222215|9.462277|4.783872|4.254155|0.101257|3.500514|5.275188|3.700433|3.203906|2.677934|2.526321|2.745077|3.321268|4.951117|4.544393|8.570136|17.538827|9.020567|5.846503|4.742134|3.589027|3.196291|3.407659|4.452072|6.307731|0.106482|6.603544|0.047970|0.048002|0.050072|0.063475|0.088922|0.066832|0.053784|0.165859|0.089548|0.067343|0.062001|0.069974|0.091213|0.303004|0.500000| |1.623526|1.857255|1.975149|2.287184|2.512306|2.290047|1.977206|4.152718|3.677031|6.214728|4.804505|0.168772|4.728311|0.107608|5.586359|4.014592|4.025056|0.113344|3.104885|4.732350|3.122886|2.587019|2.249549|2.243916|2.565160|3.096053|5.217371|4.885581|12.320340|6.240884|6.582515|8.707294|17.740753|9.006244|5.582265|4.810168|5.491083|5.837126|0.098132|4.432830|0.042894|0.044017|0.043669|0.051342|0.065946|0.066113|0.051412|0.094400|0.069290|0.056044|0.055828|0.068518|0.104228|0.225316|0.137882|0.500000| |1.457751|1.633815|1.698431|1.904115|2.078157|1.968857|1.743645|3.257698|2.781297|4.922676|3.221366|0.108186|3.033691|0.074854|3.684384|2.719025|2.838092|0.082638|2.379573|3.751690|2.281713|1.978112|1.776962|1.784819|1.997477|2.291476|3.681019|3.129703|6.922952|3.585778|4.106751|5.629921|9.046003|17.756551|8.774634|5.585046|4.926864|5.020914|0.089933|3.356974|0.038486|0.040160|0.039223|0.044367|0.053800|0.057316|0.046265|0.066119|0.053472|0.045199|0.045485|0.054462|0.075894|0.110977|0.087282|0.215083|0.500000| |1.456022|1.614399|1.673070|1.844185|1.977043|1.887073|1.704407|2.993568|2.566573|4.800702|2.753090|0.089467|2.602936|0.067516|3.084672|2.218969|2.372345|0.067507|2.098282|3.324775|1.896138|1.699168|1.532656|1.514315|1.647937|1.857101|2.848552|2.386885|4.947569|3.001328|3.685476|4.964372|5.655647|8.803546|17.720685|9.095451|5.705421|5.715874|0.108460|3.399380|0.038061|0.040500|0.039472|0.044041|0.051948|0.054215|0.045375|0.056996|0.046913|0.039661|0.038929|0.044596|0.057640|0.085622|0.075374|0.123940|0.215781|0.500000| |1.611113|1.790915|1.884731|2.077368|2.176988|2.040845|1.856826|3.245639|2.857731|5.682031|2.907378|0.091953|2.806731|0.075870|3.197001|2.217514|2.400373|0.065974|2.183552|3.424399|1.884891|1.718799|1.535427|1.487657|1.590281|1.794480|2.681623|2.269082|4.563000|3.228434|4.289471|5.495919|4.811097|5.519229|8.943532|17.753909|8.754447|9.228084|0.192310|4.538450|0.041543|0.044757|0.044169|0.050011|0.059162|0.057252|0.048810|0.059965|0.048401|0.040076|0.038167|0.042432|0.053062|0.085974|0.082351|0.105135|0.123152|0.216850|0.500000| 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