Version2.0 2020-02-02T20:35:55Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 26-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCOC[C@H](C[NH+](Cc1c(nn(c1Oc2ccccc2OC)c3ccccc3)C)CC4CC4)O C36313910 RHF 6-31G(d) (6D,7F) CCCCOC[C@H](C[NH+](Cc1c(nn(c1Oc2ccccc2OC)c3ccccc3)C)CC4CC4)O C01[X(C29H40N3O4)] 222 C1 620 CCCCOC[C@H](C[NH+](Cc1c(C)nn(c1Oc1ccccc1OC)c1ccccc1)CC1CC1)O CCCCOC[C@H](C[NH+](Cc1c(C)nn(c1Oc1ccccc1OC)c1ccccc1)CC1CC1)O CCCCOC[C@@H](O)C[NH+](CC1CC1)Cc2c(C)nn(c3ccccc3)c2Oc4ccccc4OC InChIKey=GEKJKHWXWRPTMF-VWLOTQADSA-O InChI=1S/C29H39N3O4/c1-4-5-17-35-21-25(33)19-31(18-23-15-16-23)20-26-22(2)30-32(24-11-7-6-8-12-24)29(26)36-28-14-10-9-13-27(28)34-3/h6-14,23,25,33H,4-5,15-21H2,1-3H3/p+1/t25-/m0/s1 InChI=1/C29H39N3O4/c1-4-5-17-35-21-25(33)19-31(18-23-15-16-23)20-26-22(2)30-32(24-11-7-6-8-12-24)29(26)36-28-14-10-9-13-27(28)34-3/h6-14,23,25,33H,4-5,15-21H2,1-3H3/p+1/t25-/m0/s1/fC29H40N3O4/h31H/q+1 CCCCOC[C@H](C[NH+](Cc1c(nn(c1Oc2ccccc2OC)c3ccccc3)C)CC4CC4)O C01[X(C29H40N3O4)] 222 C01 620 CCCCOC[C@H](C[NH+](Cc1c(C)nn(c1Oc1ccccc1OC)c1ccccc1)CC1CC1)O CCCCOC[C@H](C[NH](Cc1c(C)nn(c1Oc1ccccc1OC)c1ccccc1)CC1CC1)O CCCCOC[C@@H](O)C[NH](CC1CC1)Cc2c(C)nn(c3ccccc3)c2Oc4ccccc4OC InChIKey=RCNMYEWRFZCPTH-VWLOTQADSA-N InChI=1S/C29H40N3O4/c1-4-5-17-35-21-25(33)19-31(18-23-15-16-23)20-26-22(2)30-32(24-11-7-6-8-12-24)29(26)36-28-14-10-9-13-27(28)34-3/h6-14,23,25,31,33H,4-5,15-21H2,1-3H3/t25-/m0/s1 InChI=1/C29H40N3O4/c1-4-5-17-35-21-25(33)19-31(18-23-15-16-23)20-26-22(2)30-32(24-11-7-6-8-12-24)29(26)36-28-14-10-9-13-27(28)34-3/h6-14,23,25,31,33H,4-5,15-21H2,1-3H3/t25-/m0/s1 3938.8365341482 -1583.987769 1-A 26125.4682 133 487 620 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 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1644.20 1645.03 1666.38 1671.52 1683.44 1685.30 1707.31 1723.17 1735.31 1750.36 1752.70 1773.61 1775.54 1780.39 1796.92 1801.69 1813.29 1826.20 1855.11 1857.40 1865.52 1872.14 1881.05 1884.97 1898.05 1901.01 1904.48 1918.18 1928.48 1947.40 1952.64 1976.92 1984.97 2009.60 2032.53 2045.17 2046.75 2067.02 2080.89 2086.99 2087.67 2102.08 2122.58 2134.34 2168.28 2184.41 2205.62 2212.76 2234.98 2248.89 2259.39 2262.18 2275.71 2286.47 2294.55 2319.19 2322.25 2325.30 2327.91 2338.55 2342.24 2343.99 2351.69 2354.39 2355.53 2360.75 2364.59 2365.31 2370.52 2380.13 2381.22 2383.59 2389.72 2394.19 2405.30 2412.14 2421.37 2432.08 2466.54 2549.81 2580.93 2588.96 2600.03 2601.12 4571.47 4587.20 4597.89 4609.29 4618.58 4619.27 4627.76 4628.70 4633.36 4636.09 4681.64 4687.96 4693.08 4704.07 4714.00 4715.31 4734.95 4740.00 4743.49 4763.18 4774.64 4776.83 4785.79 4802.26 4804.82 4832.97 4844.48 4851.39 4860.27 4867.25 4872.66 4880.70 4885.95 4893.39 4906.86 4909.49 4910.39 4912.98 5295.00 5848.22 0.707142 0.742184 0.743128 0.633048 -1583.280627 -1583.245585 -1583.244641 -1583.354721 3.692101D-04 MUNgauss RevisionA2.0 retrievium 02-Feb-2020 DUDE CCCCOC[C@H](C[NH+](Cc1c(nn(c1Oc2ccccc2OC)c3ccccc3)C)CC4CC4)O C36313910 RHF 6-31G(d) (6D,10F) C1 494.301882 |X|Y|Z| 66.001146 46.711689 139.954762 75.565155 24 6 7 8 20 3 1 |36.858105| |12.467171|36.858105| |7.489173|12.448504|36.858105| |4.888440|7.518291|12.553513|36.858105| |3.867739|5.072896|7.998457|13.492669|73.516695| |3.076552|3.891105|5.190797|8.047118|24.391136|36.858105| |2.643136|3.137842|4.076486|5.229764|14.619936|12.531219|36.858105| |2.637193|3.076611|4.008631|4.877020|13.218413|8.962962|17.574956|0.500000| |2.211119|2.577439|3.137010|3.902583|9.170208|7.532572|12.500425|0.245574|36.858105| |1.977961|2.234723|2.677473|3.127999|7.080719|4.965565|7.663404|0.186823|12.667781|53.358707| |2.071300|2.322466|2.826421|3.235752|7.488694|4.968463|8.025632|0.199719|9.402050|25.680714|0.500000| |1.801272|2.019509|2.355964|2.718978|5.842219|3.984559|5.226820|0.125005|7.629510|17.008578|0.259650|36.858105| |1.649963|1.812354|2.090759|2.331161|4.906402|3.153532|3.993421|0.101429|4.980042|10.300118|0.200851|12.828952|36.858105| |1.648882|1.788853|2.060888|2.246134|4.689239|2.895347|3.583927|0.091772|4.048784|7.529668|0.168185|7.279226|13.379392|36.858105| |1.498508|1.606289|1.825912|1.960077|4.015814|2.438157|2.934542|0.077382|3.256241|5.786013|0.125659|5.182571|8.503343|14.711895|53.358707| |1.417662|1.523827|1.722198|1.862047|3.797784|2.338393|2.805666|0.074830|3.221801|5.781275|0.118286|5.231502|8.688712|8.972147|19.204193|53.358707| |1.486363|1.616862|1.838154|2.024296|4.173071|2.641497|3.230638|0.085213|3.934278|7.472665|0.142828|7.400836|13.861491|8.672867|11.740938|19.448309|36.858105| |1.410793|1.536006|1.732031|1.913819|3.905053|2.488957|2.987350|0.080125|3.697463|6.657285|0.120884|6.020235|7.750611|5.419889|7.474318|11.154927|14.288192|73.516695| |1.374237|1.504742|1.680789|1.875078|3.773572|2.436496|2.834799|0.074885|3.579019|5.962966|0.105101|5.559148|6.044080|4.381074|5.809379|7.625516|8.089219|24.518423|36.858105| |1.336815|1.462848|1.620580|1.805321|3.586107|2.303070|2.611823|0.067791|3.231427|5.149615|0.093215|5.020420|5.447992|4.239019|5.632724|6.998860|6.597294|14.003981|13.818817|36.858105| |1.284078|1.407802|1.542275|1.722907|3.367484|2.164444|2.380288|0.061724|2.913227|4.368908|0.079206|4.032793|4.037348|3.314202|4.365832|5.097399|4.482447|9.212261|7.952897|13.718870|36.858105| |1.266653|1.391828|1.519346|1.703616|3.314178|2.140468|2.330812|0.061116|2.862178|4.175911|0.074804|3.632248|3.484322|2.857370|3.746427|4.340922|3.821292|8.187910|6.910202|7.963734|13.808248|36.858105| |1.298655|1.428093|1.569067|1.762344|3.461649|2.247088|2.486326|0.066202|3.096851|4.578495|0.080585|3.821957|3.626597|2.899888|3.797269|4.479164|4.056471|9.335990|7.971116|6.881699|7.928522|13.716148|36.858105| |1.353766|1.486271|1.652422|1.851757|3.702200|2.404757|2.755064|0.073904|3.489338|5.501804|0.095456|4.624106|4.535838|3.453649|4.535154|5.592538|5.403458|14.343533|13.652772|7.888588|6.826236|7.909756|13.754075|36.858105| |1.377952|1.509684|1.687049|1.883833|3.794811|2.453580|2.852752|0.078748|3.574203|5.693684|0.098886|4.342075|4.241741|3.282974|4.325074|5.278799|4.982967|12.897538|8.142236|5.270142|4.605012|5.190980|7.876296|14.126802|73.516695| |1.302844|1.421647|1.572525|1.744934|3.462172|2.211318|2.500112|0.070060|3.016416|4.540249|0.081087|3.337911|3.235462|2.648513|3.528871|4.166960|3.663585|8.544995|5.286687|3.997415|3.791571|4.496337|6.657288|8.017306|24.039410|36.858105| |1.291129|1.375264|1.537221|1.643441|3.302137|2.005640|2.350267|0.063771|2.638473|4.497453|0.091803|3.808559|5.301501|5.486276|10.791467|18.145480|7.629208|11.548593|4.784906|4.432745|3.391029|2.946268|3.043375|3.718002|6.345523|2.935229|36.858105| |1.266915|1.336869|1.492725|1.574328|3.154320|1.881808|2.196033|0.060415|2.388046|4.000040|0.083966|3.212723|4.240503|4.676099|9.016232|10.725353|5.308013|8.254378|3.611902|3.356405|2.720684|2.435955|2.529079|3.008251|5.328075|2.563361|13.745664|36.858105| |1.164438|1.221595|1.351207|1.416289|2.804082|1.662004|1.904826|0.052717|2.052882|3.332138|0.069315|2.632203|3.275566|3.500126|6.146062|7.033251|3.970389|6.664506|3.093333|2.913243|2.448179|2.226949|2.304804|2.674596|4.758984|2.369952|7.968565|13.772038|36.858105| |1.098776|1.155144|1.269374|1.336249|2.626497|1.566259|1.775229|0.048957|1.933855|3.093144|0.063110|2.470285|3.003890|3.085031|5.200328|6.184990|3.697066|6.564366|3.169053|3.024619|2.574809|2.345439|2.411097|2.762098|4.838978|2.441221|6.893289|7.929243|13.743521|36.858105| |1.115106|1.180341|1.297229|1.378622|2.711903|1.636652|1.855211|0.050730|2.061373|3.309460|0.066305|2.714698|3.322215|3.290847|5.490140|6.994745|4.273746|7.901747|3.875178|3.741308|3.119716|2.789370|2.843315|3.280356|5.562791|2.755251|7.969536|6.871714|7.949464|13.761782|36.858105| |1.203780|1.283029|1.420461|1.522696|3.023785|1.844755|2.120075|0.057440|2.400715|3.959078|0.078723|3.366813|4.344312|4.210373|7.257158|10.598216|6.110161|11.059086|5.087598|4.871246|3.761776|3.242359|3.303389|3.965710|6.535419|3.071367|13.764139|7.910597|6.870247|7.927753|13.752026|36.858105| |1.797535|1.947058|2.260550|2.439926|5.102853|3.069288|3.735818|0.093662|3.926127|6.671644|0.159097|5.822698|7.241270|12.704385|10.661463|7.283976|5.193241|6.825630|3.346472|3.332271|2.778888|2.441222|2.446876|2.796160|4.770195|2.245751|3.956141|3.658679|2.906879|2.571681|2.671853|3.220901|36.858105| |1.809471|2.014152|2.372916|2.703757|5.922524|3.961781|5.532875|0.158127|7.539417|17.209052|0.257514|7.575758|6.262324|4.649329|5.384559|5.788402|5.543239|9.809083|4.699242|3.743840|3.162173|3.127460|3.626825|4.595170|9.420992|4.126493|3.453822|3.086892|2.592960|2.416363|2.582652|3.066532|3.905268|36.858105| |1.911675|2.117609|2.521714|2.831912|6.269672|4.030569|5.591077|0.186195|6.230221|10.292144|0.197219|4.926615|4.356135|3.661370|4.407706|4.588594|3.992662|7.083048|3.488380|2.901676|2.548002|2.562986|2.943696|3.534300|7.393271|3.588194|2.896429|2.719795|2.347120|2.173907|2.262625|2.587615|3.294506|12.645346|36.858105| |1.736205|1.899144|2.205240|2.430636|5.140388|3.212970|4.006180|0.129933|4.375411|6.674838|0.127505|3.746984|3.480540|2.989145|3.776432|4.040146|3.424516|6.430828|3.223369|2.658519|2.378763|2.453084|2.879028|3.424601|7.574847|3.944676|2.679887|2.547775|2.263214|2.125905|2.202100|2.458174|2.677405|7.407484|12.704776|36.858105| |1.951105|2.178549|2.570141|2.917569|6.312682|4.079081|5.132495|0.176755|5.500212|7.368348|0.137482|3.895448|3.373024|2.891207|3.539542|3.689216|3.153916|5.780699|3.021688|2.565259|2.339228|2.420388|2.795252|3.211020|6.743525|3.509871|2.401249|2.263526|2.009776|1.896972|1.977027|2.214810|2.677607|7.224886|12.657617|12.770794|36.858105| |2.644867|3.062090|3.988349|4.741168|12.526144|7.926061|13.576329|0.258933|8.169182|9.762153|0.254214|5.412644|4.368219|4.195113|4.519986|4.123130|3.393144|5.320143|2.776721|2.606033|2.336401|2.228565|2.333355|2.601933|4.706132|2.296968|2.495670|2.352841|2.014750|1.851251|1.920102|2.204993|4.741143|4.942676|4.773381|3.489875|4.061505|73.516695| |17.566339|8.789064|5.464934|4.057605|5.793203|2.703510|2.336421|0.064520|2.001127|2.447652|0.051896|1.655778|1.522323|1.519462|1.890834|1.795873|1.380847|2.340606|1.289111|1.258967|1.216341|1.202305|1.228732|1.273177|2.297584|1.227963|1.208003|1.184856|1.094313|1.036842|1.052825|1.132439|1.647122|1.655633|1.738307|1.594810|1.780752|4.135107|0.500000| |17.544479|8.775597|6.785731|4.516952|6.657150|2.980084|2.614994|0.071915|2.186382|2.696173|0.058170|1.816441|1.676897|1.695163|2.096501|1.966982|1.505548|2.521474|1.375830|1.342830|1.284750|1.259139|1.286502|1.345203|2.426312|1.284037|1.314731|1.294297|1.187820|1.116893|1.130623|1.220963|1.870823|1.799702|1.888674|1.704481|1.896496|4.790835|0.301828|0.500000| |17.544976|8.776000|6.787423|4.516816|6.660685|2.979719|2.611586|0.074028|2.177650|2.669668|0.057172|1.768089|1.626813|1.623301|2.016954|1.914269|1.473056|2.493437|1.359970|1.314431|1.259239|1.245892|1.284826|1.344125|2.449762|1.307583|1.285427|1.266592|1.166235|1.098725|1.111592|1.197045|1.756867|1.817697|1.949099|1.783426|2.002764|4.607014|0.301818|0.301567|0.500000| |8.864639|17.514952|8.846016|6.901813|8.353426|3.775053|3.021487|0.080164|2.531976|2.984205|0.062991|2.016678|1.806030|1.786089|2.178222|2.061703|1.606800|2.707561|1.501267|1.472242|1.423176|1.402243|1.427495|1.477578|2.644522|1.397155|1.364693|1.321266|1.207065|1.144371|1.172925|1.276675|1.955073|1.955158|2.018088|1.805179|2.058422|5.307549|0.213173|0.210858|0.173013|0.500000| |8.865028|17.515564|8.847815|6.900109|8.359286|3.773946|3.016022|0.083093|2.518372|2.948466|0.061734|1.951466|1.744251|1.703098|2.089925|2.001582|1.567687|2.673073|1.480818|1.435261|1.388926|1.384101|1.425174|1.476104|2.674637|1.427362|1.332184|1.291994|1.184554|1.124955|1.151831|1.249556|1.826845|1.978013|2.091622|1.898928|2.195170|5.062073|0.213195|0.173013|0.210858|0.303779|0.500000| |6.849238|8.822543|17.536595|8.945116|13.039843|4.864234|4.034718|0.116301|3.082223|3.627862|0.078491|2.303451|2.060178|2.026398|2.460326|2.331319|1.825621|3.072166|1.665175|1.590297|1.507774|1.491706|1.553516|1.644984|3.018451|1.590092|1.536112|1.500105|1.360436|1.275004|1.297720|1.416669|2.197853|2.414780|2.637222|2.324860|2.720347|6.888685|0.140156|0.168554|0.203108|0.173326|0.211206|0.500000| |6.855171|8.826826|17.529599|8.940777|13.006992|4.863542|4.045952|0.108594|3.106087|3.694052|0.081105|2.412421|2.163912|2.170554|2.607956|2.427677|1.887983|3.124327|1.694111|1.640814|1.551647|1.514214|1.556194|1.646673|2.974655|1.548262|1.586441|1.546387|1.394775|1.303396|1.328005|1.456432|2.432609|2.372844|2.493349|2.158101|2.471164|7.547567|0.140229|0.203268|0.168738|0.211198|0.173377|0.303154|0.500000| |4.522548|6.822131|8.822638|17.512550|16.534668|7.260385|4.788513|0.117836|3.782296|4.133008|0.086515|2.729924|2.330744|2.252596|2.665365|2.523013|2.014311|3.372962|1.876555|1.830900|1.758299|1.729316|1.767950|1.842591|3.286622|1.706176|1.631765|1.554582|1.398272|1.323745|1.371299|1.517583|2.469559|2.580349|2.619525|2.251429|2.658302|8.029608|0.108307|0.119490|0.111049|0.205491|0.169854|0.173943|0.212784|0.500000| |4.525586|6.832996|8.827310|17.516594|16.548512|7.243229|4.760556|0.127708|3.733744|4.035458|0.083239|2.571424|2.199868|2.090004|2.505557|2.412941|1.937093|3.304706|1.835923|1.759940|1.693861|1.694876|1.762951|1.838964|3.344000|1.761914|1.575774|1.506331|1.362673|1.293137|1.337076|1.471583|2.221781|2.632040|2.785925|2.441867|2.975461|7.233431|0.108398|0.111111|0.119505|0.170259|0.205816|0.212698|0.173936|0.301045|0.500000| |2.953950|3.744666|4.733971|7.202158|16.546426|17.498420|8.848482|0.174478|6.945635|6.393447|0.128404|4.077942|3.185084|2.932883|3.335972|3.182799|2.642321|4.398343|2.461581|2.376974|2.253938|2.209663|2.277586|2.405856|4.262756|2.149850|1.996535|1.857922|1.640579|1.553402|1.632839|1.846555|3.150949|3.644033|3.512328|2.850283|3.476735|12.610015|0.073178|0.080338|0.077615|0.105792|0.099827|0.117121|0.127042|0.217629|0.176104|0.500000| |2.940200|3.721121|4.703102|7.122256|16.492456|17.497566|8.823481|0.215863|6.759679|6.109350|0.119401|3.624883|2.889497|2.610225|3.049876|2.983036|2.487730|4.272789|2.383964|2.237094|2.130786|2.147477|2.277289|2.410399|4.415573|2.276548|1.904016|1.783697|1.589191|1.509466|1.581308|1.772054|2.689043|3.829517|3.985539|3.295564|4.340473|10.128254|0.072852|0.077304|0.079994|0.099221|0.105054|0.126410|0.116526|0.174476|0.214073|0.299709|0.500000| |2.178569|2.556436|3.054663|3.847581|8.608520|7.101117|8.895869|0.174331|17.647934|12.373367|0.201477|7.893122|4.932609|4.034037|4.373112|4.293082|3.841111|6.363550|3.599470|3.389023|3.106339|3.010888|3.156214|3.455080|6.005996|2.853311|2.574466|2.305038|1.987641|1.887608|2.028712|2.369796|3.989881|5.743683|4.667385|3.560782|4.252696|12.706273|0.055159|0.060045|0.058762|0.071242|0.069137|0.081126|0.084559|0.108655|0.101472|0.216211|0.173872|0.500000| |2.116296|2.464403|2.942088|3.651651|8.202050|6.581477|8.771540|0.215821|17.673825|12.266252|0.187235|6.112962|4.292374|3.469759|3.960595|4.040524|3.632346|6.404872|3.573273|3.159939|2.908862|2.957983|3.290801|3.671970|6.878855|3.328165|2.494421|2.257727|1.968003|1.874458|2.004742|2.312833|3.276941|7.539512|6.588057|4.867664|6.613456|10.316877|0.053606|0.057416|0.058305|0.066828|0.068227|0.081398|0.079019|0.097056|0.101462|0.163841|0.191421|0.301839|0.500000| |1.900903|2.147597|2.511786|2.927829|6.278875|4.306471|5.444284|0.122997|7.425270|12.446411|0.225644|17.640576|8.986430|6.791493|6.454765|6.080038|5.641281|8.232738|4.475267|4.385789|3.705823|3.306278|3.343911|3.814318|6.291452|2.850325|3.356008|2.897646|2.407394|2.260250|2.460738|2.993237|6.382633|5.602136|4.143979|3.216733|3.438633|10.673334|0.048462|0.053529|0.051307|0.060241|0.057143|0.067027|0.072178|0.083436|0.075630|0.128685|0.105140|0.249187|0.156087|0.500000| |1.709457|1.921302|2.208123|2.565243|5.382442|3.719306|4.599760|0.112112|6.955659|12.362652|0.182480|17.635124|8.869142|5.504053|5.949525|6.419562|6.813966|11.465596|6.799605|6.014490|4.878924|4.460688|4.754074|5.776286|9.106732|3.815240|3.606071|2.994619|2.510370|2.415976|2.706444|3.346642|4.476977|7.018134|4.592355|3.685607|3.845941|7.861984|0.043969|0.047526|0.046600|0.053434|0.052135|0.059953|0.061940|0.071848|0.068715|0.106671|0.097830|0.209351|0.174496|0.301570|0.500000| |1.338073|1.458233|1.616492|1.788177|3.552249|2.255791|2.562680|0.066167|3.100775|4.999649|0.093334|5.002372|5.910253|4.853627|6.605962|8.151064|7.144731|12.714316|8.951725|17.728579|8.895146|5.655837|4.957481|5.627863|7.581659|3.345672|5.008567|3.686479|3.139746|3.229215|4.010705|5.420392|3.736968|3.516372|2.758784|2.493644|2.406875|4.674181|0.034978|0.037551|0.036469|0.040871|0.039494|0.043933|0.045846|0.050566|0.047986|0.065005|0.060016|0.090842|0.082016|0.125505|0.153673|0.500000| |1.248501|1.365656|1.485981|1.653136|3.199231|2.038572|2.207374|0.056986|2.643724|3.892035|0.071926|3.567393|3.589584|3.084290|4.081888|4.609151|3.861410|7.445923|5.659525|8.921087|17.740338|8.911832|5.636725|4.929484|6.499977|3.134243|3.103850|2.534157|2.304130|2.428587|2.915007|3.437995|2.659131|2.755585|2.270780|2.115913|2.097722|3.895142|0.032959|0.034778|0.033886|0.038553|0.037356|0.040155|0.041649|0.047209|0.045030|0.059535|0.055512|0.079266|0.072534|0.094816|0.115245|0.214894|0.500000| |1.220392|1.340077|1.450015|1.623270|3.119076|2.003468|2.138163|0.056140|2.576674|3.654361|0.066245|3.098271|2.945543|2.488915|3.267290|3.695605|3.152525|6.500350|4.972612|5.653569|8.928773|17.733425|8.937838|5.644750|7.453687|3.895451|2.544334|2.153072|1.996606|2.107483|2.469322|2.789547|2.182246|2.714339|2.289513|2.210960|2.204773|3.623103|0.032324|0.033628|0.033293|0.037610|0.037145|0.039463|0.040014|0.045939|0.045084|0.057692|0.056214|0.075692|0.074333|0.080461|0.102927|0.124160|0.214267|0.500000| |1.272370|1.398929|1.528934|1.716212|3.345283|2.164954|2.361542|0.063565|2.896923|4.157614|0.073682|3.312403|3.100911|2.539861|3.328214|3.848943|3.390756|7.538733|5.656393|4.959785|5.654925|8.935824|17.758099|8.924144|12.583734|7.330164|2.656591|2.269045|2.097671|2.192788|2.535840|2.858753|2.190317|3.342298|2.818497|2.835199|2.768327|3.884415|0.033530|0.034852|0.035049|0.038753|0.039021|0.042188|0.041840|0.047645|0.048137|0.060553|0.061845|0.081189|0.087444|0.081759|0.111419|0.107655|0.124244|0.216705|0.500000| |1.327047|1.456206|1.605067|1.795212|3.539772|2.280771|2.534316|0.070814|3.071828|4.429916|0.078456|3.217091|3.000334|2.467507|3.231991|3.718014|3.259794|7.239692|4.604125|3.678584|3.644205|4.480640|6.594649|6.821171|16.382096|17.574943|2.581581|2.276561|2.106552|2.157320|2.411261|2.675368|2.136123|3.920152|3.473534|3.800063|3.562176|4.062840|0.034808|0.036154|0.036955|0.039785|0.040850|0.045010|0.043585|0.048803|0.050811|0.061679|0.066236|0.081246|0.096604|0.077624|0.103536|0.085746|0.084716|0.111617|0.228414|0.500000| |1.307614|1.420497|1.575142|1.735121|3.453425|2.182103|2.483956|0.070999|2.930750|4.436658|0.080566|3.141114|3.081284|2.568469|3.444226|4.033098|3.468855|7.834167|4.448847|3.430178|3.189663|3.609998|4.873177|5.896980|16.937690|17.652471|2.874240|2.573497|2.392877|2.437623|2.688158|2.949215|2.191284|4.179118|3.824477|4.488970|3.773864|4.053534|0.034178|0.035773|0.036654|0.038546|0.039645|0.044597|0.043039|0.046719|0.048715|0.058149|0.062469|0.075416|0.089842|0.074663|0.096300|0.082707|0.075189|0.088731|0.144155|0.300152|0.500000| |1.216779|1.320689|1.449883|1.597105|3.138010|1.983008|2.213792|0.061674|2.623505|3.933278|0.071569|2.969532|2.953811|2.471714|3.356228|3.985339|3.403221|7.907509|5.011859|3.954662|3.851587|4.638709|6.700244|7.288077|16.428734|17.592461|2.893476|2.523334|2.379429|2.510433|2.872634|3.135783|2.100779|3.432267|3.017231|3.268386|2.932175|3.674736|0.031980|0.033381|0.033875|0.036169|0.036794|0.040617|0.039772|0.043600|0.044703|0.054005|0.056402|0.070104|0.078785|0.071705|0.093334|0.091931|0.088940|0.113253|0.209108|0.298861|0.299898|0.500000| |1.331943|1.401605|1.574597|1.651132|3.329108|1.968401|2.317714|0.064023|2.475903|4.176585|0.090139|3.281332|4.337689|5.078132|9.881371|9.906694|5.051371|7.516946|3.303123|3.064452|2.511350|2.264752|2.356813|2.790385|5.006158|2.415593|8.934792|17.761138|8.895396|5.637635|4.954849|5.643958|4.068207|3.182744|2.849494|2.624165|2.337975|4.492950|0.034466|0.037942|0.037046|0.038379|0.037457|0.044059|0.045579|0.045130|0.043615|0.053711|0.051398|0.065854|0.064266|0.082925|0.082699|0.093111|0.065237|0.055933|0.059184|0.060290|0.067928|0.065072|0.500000| |1.141819|1.190525|1.314083|1.366136|2.695423|1.581700|1.803362|0.050220|1.912750|3.066228|0.064426|2.374303|2.885548|3.120909|5.310058|5.705615|3.352161|5.618389|2.658950|2.511605|2.154195|1.982853|2.053472|2.351931|4.232274|2.144197|5.664073|8.948831|17.728704|8.908957|5.649944|4.951480|2.691282|2.379865|2.206405|2.140569|1.903565|3.400172|0.029822|0.032410|0.031845|0.032608|0.032036|0.036863|0.037741|0.037368|0.036489|0.043218|0.042006|0.051274|0.050956|0.060991|0.062598|0.074535|0.056712|0.049915|0.052550|0.053450|0.060711|0.059599|0.214870|0.500000| |1.037794|1.086812|1.187814|1.244922|2.430601|1.442086|1.618622|0.044784|1.749032|2.751580|0.056139|2.171072|2.569624|2.631873|4.297416|4.923160|3.067179|5.512062|2.745375|2.640877|2.312284|2.136687|2.191081|2.459657|4.333179|2.239958|4.963415|5.643554|8.910344|17.728737|8.917934|5.642630|2.255831|2.148410|1.965223|1.944172|1.740997|2.987151|0.027280|0.029284|0.028858|0.029900|0.029449|0.033179|0.033825|0.034246|0.033554|0.039708|0.038757|0.047465|0.047349|0.055701|0.059302|0.077328|0.061133|0.054063|0.056105|0.055393|0.062416|0.064526|0.123986|0.214657|0.500000| |1.062610|1.124878|1.229191|1.307529|2.554209|1.543358|1.730122|0.047262|1.924959|3.034846|0.060269|2.484478|2.943047|2.866823|4.594895|5.670138|3.687693|7.048853|3.675813|3.627615|3.139685|2.836540|2.858767|3.203088|5.360901|2.719233|5.665619|4.952213|5.649013|8.914065|17.728298|8.944208|2.379259|2.365363|2.084840|2.050158|1.854405|3.154444|0.027961|0.029862|0.029401|0.031101|0.030584|0.034115|0.034833|0.036204|0.035376|0.042894|0.041670|0.052928|0.052445|0.063030|0.069997|0.105761|0.082221|0.070510|0.071285|0.066345|0.072952|0.080617|0.107571|0.124131|0.214783|0.500000| |1.209208|1.295999|1.432168|1.547944|3.067384|1.891643|2.162318|0.058050|2.494354|4.082015|0.079420|3.576837|4.518348|4.148532|6.705910|9.665937|6.434788|12.591770|6.355390|6.411316|4.718591|3.907341|3.892665|4.670354|7.226921|3.330807|8.898066|5.632475|4.954371|5.648681|8.930807|17.763559|3.173273|3.133283|2.590911|2.453063|2.240730|3.957911|0.031644|0.033982|0.033304|0.035939|0.035143|0.039514|0.040651|0.043053|0.041676|0.052981|0.050668|0.069264|0.067101|0.088002|0.102033|0.199833|0.117584|0.091205|0.090789|0.080646|0.086151|0.095470|0.124134|0.107564|0.124255|0.216180|0.500000| |1.810721|1.975353|2.274519|2.480127|5.110247|3.104572|3.643880|0.088957|3.871475|6.189974|0.140091|5.684026|6.365654|8.889771|8.316241|6.265241|4.636370|6.334823|3.262024|3.374485|2.870934|2.494181|2.447419|2.734218|4.565801|2.162148|3.510946|3.186905|2.608839|2.369162|2.496108|2.989563|17.546052|3.549502|2.989566|2.458455|2.506513|8.116417|0.046272|0.052387|0.048682|0.055785|0.051399|0.060504|0.068047|0.071139|0.062551|0.091433|0.075279|0.114905|0.089569|0.191532|0.125288|0.106052|0.077677|0.062361|0.060742|0.057760|0.057928|0.056437|0.095067|0.067038|0.058271|0.062786|0.083876|0.500000| |1.717999|1.833523|2.106077|2.224601|4.567427|2.677005|3.168018|0.081495|3.240786|5.319865|0.124911|4.423708|5.482612|8.988066|10.271028|6.753142|4.449228|6.035400|2.958891|2.965289|2.505243|2.208837|2.206260|2.498209|4.286962|2.052732|3.899700|3.781482|3.019179|2.623099|2.664617|3.146211|17.621226|3.312928|2.901833|2.427704|2.395952|6.994090|0.043876|0.049978|0.046741|0.051100|0.047676|0.057106|0.063294|0.062401|0.056372|0.075824|0.065886|0.090633|0.077364|0.130318|0.100350|0.092842|0.067321|0.055340|0.055268|0.054057|0.056010|0.053906|0.120057|0.078801|0.064128|0.065553|0.084138|0.301329|0.500000| |1.979392|2.154087|2.556172|2.759960|5.939986|3.531693|4.460253|0.111130|4.444444|7.517880|0.196538|5.842293|6.426886|8.838750|8.146582|6.171265|4.612066|6.343019|3.118013|3.021424|2.566131|2.311853|2.354667|2.689131|4.695308|2.228605|3.476999|3.291334|2.664397|2.358520|2.426721|2.871371|17.549829|4.226765|3.668993|2.890269|2.942115|10.961310|0.049855|0.057363|0.053859|0.059651|0.055763|0.069243|0.077152|0.076749|0.068844|0.098986|0.083881|0.121784|0.100069|0.179120|0.122293|0.090847|0.067686|0.057732|0.059296|0.059315|0.060995|0.057279|0.102564|0.069516|0.058063|0.060459|0.078496|0.301967|0.300923|0.500000| |1.689227|1.854834|2.163274|2.410993|5.180170|3.338777|4.462359|0.126395|5.583449|12.473199|0.223637|7.267833|7.403961|5.393153|6.450589|7.245256|7.126327|12.308118|5.204451|4.017370|3.259401|3.149716|3.636754|4.793779|9.843038|4.167944|4.217178|3.721824|3.035049|2.785873|2.978846|3.614814|4.207204|17.685517|8.938394|6.449957|5.514886|7.704167|0.043088|0.047001|0.047150|0.050166|0.050343|0.061096|0.060765|0.064401|0.064734|0.087113|0.088605|0.129623|0.148754|0.146689|0.180603|0.106567|0.078572|0.075050|0.091287|0.104958|0.118278|0.098303|0.106722|0.076348|0.067676|0.074297|0.100772|0.102745|0.100090|0.122773|0.500000| |1.719060|1.920149|2.226151|2.558279|5.457277|3.711248|4.813915|0.134268|6.900783|12.373276|0.181225|6.941618|5.552921|4.058950|4.827625|5.367010|5.247129|10.283475|5.341999|4.092983|3.517625|3.603542|4.375647|5.673113|12.183585|5.104037|3.285856|2.880314|2.467332|2.357158|2.566001|3.038478|3.408249|17.625800|8.823389|6.873437|6.872285|7.396881|0.044031|0.047205|0.047836|0.052046|0.052886|0.062572|0.061175|0.068454|0.070371|0.096732|0.103315|0.156108|0.218747|0.144242|0.211804|0.102147|0.083218|0.085876|0.112501|0.137155|0.139017|0.112584|0.080332|0.062525|0.058517|0.066327|0.088457|0.088938|0.081273|0.099243|0.303142|0.500000| |2.015965|2.214448|2.677290|2.943840|6.633853|4.068668|5.770356|0.202223|5.650065|9.303759|0.208332|4.563060|4.200681|3.744805|4.497086|4.511043|3.766770|6.382590|3.103257|2.654545|2.327950|2.303142|2.580413|3.049844|6.162042|3.027348|2.848692|2.744435|2.357753|2.145965|2.196476|2.495718|3.485117|8.722945|17.670149|8.693863|8.623042|9.381692|0.050498|0.055722|0.057404|0.058195|0.060101|0.078649|0.074492|0.074806|0.078956|0.097237|0.107844|0.120185|0.152106|0.110802|0.112797|0.071720|0.058486|0.057573|0.068337|0.081023|0.089251|0.072846|0.081840|0.062303|0.053954|0.055827|0.068360|0.086063|0.086088|0.111369|0.207133|0.171845|0.500000| |1.707164|1.842962|2.131355|2.297080|4.803909|2.899969|3.531962|0.115506|3.655027|5.518070|0.110572|3.211981|3.084324|2.751994|3.542834|3.745415|3.061050|5.656729|2.817660|2.369810|2.129552|2.181243|2.517957|2.947160|6.366229|3.403474|2.539358|2.478697|2.229279|2.077981|2.114497|2.320257|2.502127|5.534502|8.608331|17.734009|8.590774|5.651302|0.043564|0.046623|0.049108|0.048365|0.051132|0.063110|0.058097|0.058775|0.063963|0.071480|0.082012|0.084718|0.109043|0.078389|0.086484|0.062563|0.053215|0.055105|0.069064|0.090379|0.108588|0.080946|0.071574|0.059396|0.053188|0.054605|0.063390|0.063443|0.064183|0.075147|0.145173|0.139698|0.214932|0.500000| |1.601189|1.749037|2.001589|2.210652|4.587415|2.894524|3.513469|0.108465|4.014883|6.196826|0.114429|3.700771|3.483042|2.930452|3.762610|4.152562|3.570602|7.064447|3.573693|2.865956|2.566652|2.693000|3.258576|3.952757|9.360148|4.984526|2.793801|2.613919|2.339169|2.232441|2.342444|2.614841|2.565433|6.982493|8.598381|17.707662|8.620629|5.513909|0.041165|0.043686|0.045440|0.046571|0.048696|0.057967|0.054459|0.057707|0.061910|0.073130|0.082903|0.093895|0.125743|0.086966|0.104856|0.073287|0.062581|0.066936|0.089987|0.130372|0.166498|0.110191|0.073245|0.060846|0.056671|0.060959|0.073122|0.065934|0.064729|0.075168|0.178226|0.205302|0.172216|0.293146|0.500000| 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