Version2.0 2020-07-31T07:47:03Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 14-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC1CC[NH+](CC1)[C@@H](CNC(=O)CCCNC(=O)NC2CCCCC2)C(C)C C58775575 RHF 6-31G(d) (6D,7F) CC1CC[NH+](CC1)[C@@H](CNC(=O)CCCNC(=O)NC2CCCCC2)C(C)C C01[X(C22H43N4O2)] 207 C1 506 CC1CC[NH+](CC1)[C@H](C(C)C)CNC(=O)CCCNC(=O)NC1CCCCC1 CC1CC[NH+](CC1)[C@H](C(C)C)CNC(=O)CCCNC(=O)NC1CCCCC1 CC(C)[C@H](CNC(=O)CCCNC(=O)NC1CCCCC1)[NH+]2CCC(C)CC2 InChIKey=GSWRRFYSPMTWQN-FQEVSTJZSA-O InChI=1S/C22H42N4O2/c1-17(2)20(26-14-11-18(3)12-15-26)16-24-21(27)10-7-13-23-22(28)25-19-8-5-4-6-9-19/h17-20H,4-16H2,1-3H3,(H,24,27)(H2,23,25,28)/p+1/t20-/m0/s1 InChI=1/C22H42N4O2/c1-17(2)20(26-14-11-18(3)12-15-26)16-24-21(27)10-7-13-23-22(28)25-19-8-5-4-6-9-19/h17-20H,4-16H2,1-3H3,(H,24,27)(H2,23,25,28)/p+1/t20-/m0/s1/fC22H43N4O2/h23-26H/q+1 CC1CC[NH+](CC1)[C@@H](CNC(=O)CCCNC(=O)NC2CCCCC2)C(C)C C01[X(C22H43N4O2)] 207 C01 506 CC1CC[NH+](CC1)[C@H](C(C)C)CNC(=O)CCCNC(=O)NC1CCCCC1 C[C@@H]1CC[NH](CC1)[C@H](C(C)C)CNC(=O)CCCNC(=O)NC1CCCCC1 CC(C)[C@H](CNC(=O)CCCNC(=O)NC1CCCCC1)[NH]2CC[C@@H](C)CC2 InChIKey=DYUTVKGJKQWWAC-FQEVSTJZSA-N InChI=1S/C22H43N4O2/c1-17(2)20(26-14-11-18(3)12-15-26)16-24-21(27)10-7-13-23-22(28)25-19-8-5-4-6-9-19/h17-20,26H,4-16H2,1-3H3,(H,24,27)(H2,23,25,28)/t20-/m0/s1 InChI=1/C22H43N4O2/c1-17(2)20(26-14-11-18(3)12-15-26)16-24-21(27)10-7-13-23-22(28)25-19-8-5-4-6-9-19/h17-20,26H,4-16H2,1-3H3,(H,24,27)(H2,23,25,28)/t20-/m0/s1/f/h23-25H 2795.7591027420 -1225.5480986 1-A 18720.0491 109 397 506 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.64072 -20.58005 -15.82130 -15.70914 -15.65031 -15.64051 -11.46242 -11.43781 -11.43030 -11.40968 -11.40936 -11.40201 -11.37721 -11.35522 -11.35370 -11.35034 -11.34860 -11.34128 -11.33797 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1638.21 1647.35 1650.16 1681.59 1687.54 1699.30 1704.41 1731.37 1734.21 1771.12 1776.66 1791.37 1821.81 1839.73 1847.01 1864.03 1868.45 1881.41 1884.88 1906.28 1947.88 1969.12 1991.53 1999.01 2006.99 2019.45 2028.75 2031.17 2044.45 2064.05 2080.44 2084.87 2104.45 2114.01 2120.58 2127.12 2128.16 2134.82 2160.88 2165.39 2177.94 2192.45 2196.90 2199.83 2203.70 2208.57 2214.81 2233.67 2236.21 2241.03 2252.95 2263.13 2266.17 2268.73 2279.49 2290.13 2334.55 2343.44 2344.94 2345.63 2347.80 2350.34 2352.24 2353.12 2360.27 2361.33 2363.19 2363.31 2364.77 2370.18 2374.81 2377.54 2380.50 2385.55 2406.40 2407.88 2410.36 2461.18 2487.04 2755.50 2781.28 4563.92 4576.05 4585.12 4585.50 4586.71 4587.04 4595.18 4596.95 4611.19 4618.48 4619.70 4630.86 4634.63 4656.84 4656.99 4662.23 4664.99 4665.82 4669.60 4682.53 4683.44 4692.64 4697.09 4699.31 4701.58 4711.58 4719.59 4721.07 4724.26 4724.53 4734.86 4739.00 4743.43 4748.91 4751.72 4760.68 4820.31 4842.64 4902.83 5362.70 5529.27 5576.76 5582.72 0.702003 0.731209 0.732153 0.636933 -1224.846096 -1224.816889 -1224.815945 -1224.911166 3.193728D-04 MUNgauss RevisionA2.0 retrievium 31-Jul-2020 DUDE CC1CC[NH+](CC1)[C@@H](CNC(=O)CCCNC(=O)NC2CCCCC2)C(C)C C58775575 RHF 6-31G(d) (6D,10F) C1 395.338602 |X|Y|Z| 118.185320 56.359172 39.696476 64.183988 22 6 7 18 4 |36.858105| |12.470420|36.858105| |7.522291|12.423717|36.858105| |4.892878|7.506322|12.492533|36.858105| |4.387563|6.462668|7.678390|12.631595|53.358707| |4.449549|6.119638|7.432561|9.395885|25.783415|0.500000| |4.895844|7.516880|6.531990|7.706018|17.185945|0.262993|36.858105| |7.520651|12.424207|7.613282|6.529299|10.459333|0.207855|12.503393|36.858105| |3.249703|4.290172|4.918514|7.414371|17.022757|0.261853|7.446932|4.931635|36.858105| |3.064133|3.928543|4.189575|5.564952|12.539502|0.224435|7.381889|4.834439|17.590648|0.500000| |2.906168|3.779575|4.208755|6.241674|10.146751|0.157402|5.834723|4.075925|12.378260|0.245832|36.858105| |2.823853|3.639657|3.717266|4.983059|8.061352|0.128675|5.849035|4.041493|7.533752|0.198974|13.181529|53.358707| |2.965633|3.835641|3.757701|4.806322|6.966505|0.112475|5.516815|4.070542|5.411585|0.140368|7.749892|19.062181|36.858105| |3.339742|4.443735|4.411701|5.706155|7.305165|0.116371|5.611619|4.362415|5.134479|0.125509|6.867488|11.596737|15.804751|73.516695| |2.603574|3.193191|3.006194|3.544145|5.160403|0.088721|4.296841|3.429431|3.953055|0.109557|5.009606|10.617659|12.602515|14.199859|36.858105| |2.834232|3.424444|3.029040|3.366167|4.872899|0.085514|4.383277|3.713726|3.463504|0.097414|3.966005|7.377450|7.616987|11.470377|12.406965|36.858105| |2.398655|2.761388|2.460728|2.662229|3.864962|0.070311|3.380909|3.000433|2.799374|0.080357|3.117088|5.486129|4.934160|7.631253|7.496039|12.459282|36.858105| |2.428683|2.708345|2.350577|2.451181|3.532181|0.065574|3.133490|2.938250|2.484045|0.071419|2.655512|4.426384|3.827955|6.305943|4.961481|7.657631|13.173700|53.358707| 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|17.564834|8.791216|6.857840|4.524768|5.218729|0.106489|4.058822|5.475857|2.947384|0.076128|2.709709|3.560410|2.777819|5.654025|2.446776|2.637262|2.247001|3.089657|2.353019|4.286888|3.106523|2.212950|2.201588|2.056076|1.798565|1.805012|1.900485|2.661196|2.786440|2.204128|0.500000| |17.565303|8.793395|5.477008|4.056421|5.219714|0.106627|4.528468|6.857620|2.949452|0.079139|2.684107|3.659551|2.859944|5.630994|2.589884|2.908308|2.498471|3.532704|2.790288|5.130792|3.728619|2.705403|2.698175|2.513486|2.143248|2.147263|2.258192|2.578512|2.684836|2.177381|0.302054|0.500000| |17.537918|8.770772|6.793419|4.528274|5.754164|0.126052|4.528728|6.792620|3.168351|0.083815|2.753030|3.579402|2.683440|5.244595|2.364326|2.531442|2.180259|2.998640|2.346305|4.400224|3.089012|2.263433|2.225966|2.128857|1.872525|1.894915|1.961711|2.881114|3.165666|2.377353|0.301505|0.301540|0.500000| |8.910695|17.511025|8.930089|6.863646|7.778426|0.140134|6.878158|8.928495|4.064478|0.103040|3.842657|5.238871|4.313909|9.359840|3.588370|3.944128|3.083399|4.102348|3.079291|5.699897|3.847807|2.624193|2.483564|2.230609|1.964495|2.032365|2.217317|3.307559|3.218445|2.671340|0.213383|0.213401|0.173381|0.500000| |6.804865|8.793966|17.567920|8.978957|7.613293|0.148618|4.903883|5.520135|4.081280|0.097032|3.730495|4.522020|3.445218|7.357931|2.801052|2.815426|2.311909|3.015189|2.230861|4.134711|2.828252|1.972675|1.893065|1.757619|1.586863|1.633120|1.739488|3.730052|3.808237|2.869844|0.202976|0.139888|0.166215|0.216160|0.500000| |6.955951|8.805950|17.488834|8.841700|9.384134|0.218068|5.669084|6.774689|4.639832|0.112446|3.777920|4.483455|3.219229|6.421830|2.643693|2.654547|2.215545|2.903115|2.204349|4.190993|2.793670|1.994452|1.898861|1.794849|1.629311|1.688724|1.773841|4.357632|4.957776|3.247322|0.173048|0.141155|0.206094|0.174116|0.303861|0.500000| |4.503660|6.793605|8.799332|17.671800|12.392608|0.182938|7.146420|5.818314|6.632943|0.142167|6.802273|7.798141|6.000365|14.297136|4.161167|3.881766|2.961690|3.643621|2.629334|4.964534|3.175539|2.151488|1.987206|1.808973|1.657520|1.749641|1.908666|5.071562|4.353245|3.729183|0.118801|0.107877|0.110894|0.203075|0.213967|0.173077|0.500000| |4.059750|5.471120|8.786361|17.635909|12.317257|0.220716|5.611806|4.890168|7.091186|0.143628|6.038708|6.116854|4.185920|8.557522|3.155890|2.925504|2.376901|2.971739|2.180174|4.144644|2.685007|1.867104|1.741643|1.622612|1.501478|1.579882|1.688540|6.832085|6.194232|4.441950|0.108183|0.094650|0.108507|0.140328|0.213417|0.214239|0.300333|0.500000| |4.519765|6.830270|5.836735|7.147592|12.374836|0.183601|17.734093|8.836608|6.633989|0.176475|6.271324|9.640608|7.498582|13.809379|5.490329|5.659418|4.017748|4.914209|3.705935|7.457472|4.245518|2.852339|2.515268|2.249539|2.049870|2.220992|2.474400|4.393147|3.872917|3.550167|0.108229|0.119227|0.111187|0.204472|0.130821|0.133284|0.219977|0.145705|0.500000| |4.056982|5.470960|4.887806|5.615102|12.330625|0.222756|17.631546|8.774514|7.159626|0.237474|5.461622|7.778463|5.049304|8.400838|4.185214|4.249704|3.409457|4.298564|3.423183|7.280179|3.991310|2.827231|2.464605|2.278408|2.108681|2.323192|2.520229|4.793982|4.470386|3.985664|0.094615|0.108145|0.108354|0.140499|0.107773|0.126868|0.145917|0.126395|0.300774|0.500000| |6.942877|8.800407|6.779098|5.678692|9.411804|0.220468|8.848730|17.486072|4.659327|0.130013|3.678360|4.810691|3.427030|6.373592|2.942792|3.120260|2.620182|3.515496|2.818645|5.611502|3.544386|2.599982|2.412463|2.290206|2.055295|2.167962|2.269713|3.875248|4.235068|3.124977|0.140981|0.172702|0.205683|0.174027|0.138742|0.197178|0.133150|0.127213|0.173537|0.213754|0.500000| |6.801978|8.786795|5.518036|4.898669|7.616750|0.149529|8.985599|17.568148|4.093347|0.115699|3.572996|5.087855|3.880585|7.228469|3.457774|3.961568|3.252709|4.483059|3.694313|7.394657|4.590475|3.304897|3.011825|2.751625|2.402711|2.544507|2.744554|3.254193|3.274464|2.732828|0.139816|0.202917|0.166256|0.215786|0.123307|0.138711|0.130336|0.107747|0.214550|0.213425|0.303831|0.500000| |3.018685|3.954377|4.596226|7.181792|9.467315|0.147121|5.341273|3.977574|8.774572|0.174114|17.667965|12.592338|7.512692|14.119359|4.756665|3.830575|2.985729|3.493773|2.471509|4.722028|2.926849|1.976274|1.792937|1.639935|1.540384|1.652340|1.808579|6.503042|4.524540|5.019973|0.079821|0.076395|0.078372|0.114185|0.117073|0.110837|0.241179|0.200278|0.164006|0.130081|0.098404|0.096080|0.500000| |2.514510|3.136454|3.494023|4.826521|7.540513|0.129067|4.483400|3.356143|8.989324|0.205889|17.648749|12.633800|5.966673|9.293814|4.362196|3.431388|2.823319|3.278842|2.342189|4.554920|2.763208|1.888410|1.695056|1.567092|1.496955|1.625431|1.769003|7.391311|4.648390|7.093128|0.065817|0.064948|0.067099|0.087842|0.088255|0.090042|0.140688|0.138378|0.129642|0.122251|0.086835|0.083410|0.305920|0.500000| |2.520564|3.140215|3.164415|4.029077|6.586184|0.111730|4.902972|3.543585|6.261237|0.184371|9.081884|26.058682|9.402481|10.908310|7.476637|5.129609|4.081122|4.415169|3.110787|6.228174|3.485228|2.322853|2.012750|1.824232|1.751020|1.944364|2.176920|4.482627|3.432505|4.386919|0.064864|0.067525|0.066008|0.091019|0.079173|0.080004|0.122983|0.103622|0.155714|0.142959|0.088431|0.093379|0.182984|0.230531|0.500000| |2.381632|2.857800|2.739358|3.192556|4.458694|0.077914|3.557280|2.960346|3.424551|0.092951|4.373369|8.307582|9.035248|12.487181|17.552220|8.780526|6.589741|6.134058|3.703292|6.607341|4.076602|2.517132|2.201480|1.912485|1.814569|1.980115|2.305907|2.768020|2.342630|2.601752|0.063336|0.065668|0.060129|0.089496|0.072654|0.067133|0.104550|0.080862|0.121539|0.095039|0.071593|0.082457|0.120903|0.110154|0.163706|0.500000| |2.379971|2.872470|2.728393|3.207413|4.847650|0.085003|3.993565|3.169970|3.879678|0.112063|4.831273|10.338183|8.861752|10.408998|17.552542|8.795545|7.077017|6.392603|4.120568|7.975084|4.345491|2.735316|2.311402|2.027608|1.949711|2.185284|2.552870|3.030596|2.542420|2.925622|0.061781|0.065882|0.061101|0.086866|0.070098|0.068192|0.100588|0.080792|0.134063|0.113851|0.077510|0.088984|0.120557|0.122413|0.242988|0.302342|0.500000| |3.165636|3.898441|3.327162|3.662969|5.529750|0.096813|5.395423|4.481386|3.805584|0.109546|4.137923|7.598645|7.161539|10.937655|8.832737|17.592631|8.977183|9.663874|6.739223|13.473831|6.453854|3.850122|3.151728|2.644918|2.431067|2.712888|3.267162|2.904939|2.586532|2.634524|0.079685|0.091025|0.078463|0.123308|0.083603|0.081081|0.114729|0.086398|0.198558|0.148033|0.102232|0.137231|0.108255|0.097345|0.145256|0.173415|0.205399|0.500000| |2.999266|3.604459|3.153212|3.428174|4.715744|0.082883|4.169346|3.704411|3.245083|0.088629|3.697536|6.442583|6.814323|12.098554|8.849107|17.573306|8.811354|9.367823|5.399463|8.981457|5.749605|3.326004|2.893799|2.402140|2.193163|2.365274|2.829216|2.590003|2.305163|2.339829|0.078787|0.085765|0.072941|0.120153|0.083106|0.075486|0.112275|0.082332|0.149717|0.107300|0.085456|0.109504|0.103742|0.088555|0.119586|0.217028|0.173650|0.302466|0.500000| |2.189615|2.492086|2.265278|2.452735|3.482274|0.063608|2.938066|2.634215|2.551059|0.072189|2.888849|4.979608|4.489927|7.101774|6.773938|8.804437|17.568236|12.641870|5.764603|8.954393|5.972819|3.349121|2.821424|2.339967|2.237563|2.475978|3.069567|2.128332|1.903193|2.027928|0.057865|0.062922|0.055408|0.077361|0.060048|0.056757|0.076171|0.061750|0.095779|0.081275|0.064581|0.077912|0.078169|0.073956|0.103032|0.193057|0.175691|0.174570|0.211361|0.500000| |2.252629|2.589283|2.337711|2.552785|3.803504|0.069731|3.304067|2.880241|2.827107|0.083065|3.127113|5.556316|4.668375|6.930890|6.944232|8.863703|17.606083|12.600896|7.155960|12.908492|6.570061|3.799010|3.005842|2.526556|2.456260|2.837183|3.573768|2.314227|2.067142|2.232410|0.058252|0.064817|0.057745|0.078359|0.060493|0.059263|0.077555|0.063893|0.106315|0.095811|0.071103|0.086175|0.081056|0.079950|0.120503|0.164052|0.216098|0.213817|0.173523|0.303099|0.500000| |2.361791|2.589089|2.251197|2.317700|3.264337|0.060879|2.843561|2.728368|2.279401|0.064646|2.439513|3.973281|3.457675|5.896570|4.336811|6.292086|9.049914|26.079593|9.337391|10.879328|10.552707|4.866313|4.063560|3.089027|2.847263|3.087665|4.060599|1.923433|1.780329|1.804476|0.062158|0.070417|0.059216|0.080707|0.059763|0.056667|0.070507|0.057644|0.090413|0.078171|0.066836|0.084453|0.066613|0.061732|0.079912|0.115048|0.111240|0.157182|0.178112|0.229989|0.182630|0.500000| |2.270639|2.385793|2.046134|2.044403|2.917286|0.055948|2.552921|2.562904|2.012806|0.057911|2.064972|3.238371|2.656164|4.569791|3.072669|4.015119|4.916059|10.651718|9.446042|10.906364|26.016006|9.096620|7.181053|4.645730|4.192238|4.495215|6.664067|1.730735|1.645874|1.632347|0.059150|0.069468|0.057929|0.071862|0.054000|0.052702|0.060181|0.051102|0.077217|0.071701|0.064589|0.081485|0.055868|0.052701|0.065624|0.079871|0.082493|0.114380|0.110146|0.121766|0.123867|0.236477|0.500000| |2.677786|2.783059|2.314712|2.269864|3.378669|0.066353|3.087818|3.219395|2.277116|0.067330|2.215764|3.407598|2.660185|4.546589|2.881189|3.606802|3.842675|6.628197|7.384930|13.605363|12.685703|17.609188|8.896140|6.821937|5.685800|6.828167|8.902134|1.943861|1.894625|1.822695|0.066787|0.083807|0.069874|0.080094|0.059191|0.060856|0.064573|0.056070|0.088697|0.090412|0.083119|0.108389|0.058661|0.056034|0.069020|0.071385|0.079157|0.115857|0.094710|0.090057|0.105553|0.122113|0.181205|0.500000| |2.658701|2.617917|2.168648|2.061218|2.919715|0.057481|2.571992|2.799197|1.939379|0.055547|1.908435|2.864991|2.288716|4.078050|2.440105|3.021710|3.159597|5.489925|4.998173|7.795860|9.744126|8.853444|17.543193|8.789972|5.478196|4.836304|5.500651|1.692359|1.663600|1.570253|0.068435|0.085628|0.068270|0.076770|0.057114|0.056763|0.059028|0.051266|0.074453|0.071459|0.072101|0.092161|0.052003|0.048394|0.056912|0.062840|0.064877|0.091364|0.085455|0.078696|0.081945|0.114582|0.181898|0.215724|0.500000| |2.153816|2.155695|1.847404|1.792802|2.544533|0.050022|2.190122|2.297950|1.735307|0.049885|1.730909|2.612820|2.076624|3.643110|2.267738|2.759390|3.052216|5.381638|4.733112|7.127524|9.719039|8.856168|17.474448|8.854043|6.775886|5.663578|6.797354|1.528654|1.491306|1.441900|0.056242|0.067100|0.055985|0.063111|0.048974|0.048570|0.051541|0.045223|0.063678|0.061571|0.059761|0.073176|0.047005|0.044504|0.052710|0.059300|0.061316|0.080730|0.076828|0.077916|0.080538|0.114505|0.214928|0.174265|0.302898|0.500000| |2.414034|2.349206|1.986964|1.888143|2.742061|0.055347|2.385055|2.604189|1.839154|0.053618|1.762518|2.598850|1.995482|3.500635|2.084702|2.453009|2.538940|4.098683|3.743986|6.611644|6.275308|6.780277|8.855506|17.496980|8.852981|6.786560|5.661433|1.631237|1.634548|1.533005|0.061193|0.076470|0.064754|0.065857|0.051663|0.053531|0.052697|0.047519|0.066284|0.068475|0.070360|0.084674|0.047329|0.045208|0.052325|0.053295|0.057028|0.075318|0.066942|0.063307|0.069366|0.081235|0.114092|0.200807|0.214519|0.173805|0.500000| |2.136474|2.062521|1.771058|1.683589|2.395659|0.048119|2.038602|2.206039|1.619133|0.046643|1.575115|2.316234|1.796167|3.176153|1.890276|2.211948|2.323460|3.777619|3.278401|5.493924|5.651687|5.494503|8.837825|17.546497|8.806947|5.491216|4.840523|1.450587|1.447159|1.367179|0.055510|0.067161|0.056931|0.058580|0.046840|0.047532|0.047371|0.042734|0.057391|0.057579|0.059205|0.070018|0.042732|0.040652|0.046592|0.049234|0.051408|0.065928|0.061415|0.059409|0.062668|0.077636|0.111658|0.140006|0.211710|0.215316|0.303635|0.500000| |1.847936|1.824776|1.603000|1.553943|2.257654|0.045644|1.902875|2.001273|1.559976|0.045653|1.510126|2.222269|1.685510|2.919196|1.782924|2.036007|2.173451|3.433657|3.000332|5.281633|4.855584|4.828147|5.485098|8.822208|17.543593|8.813362|5.486469|1.407183|1.404192|1.350877|0.047703|0.056535|0.050145|0.051103|0.042028|0.043488|0.043411|0.039809|0.052983|0.055180|0.054635|0.062479|0.040400|0.039429|0.045481|0.046241|0.049704|0.060783|0.054907|0.055492|0.060824|0.068290|0.094154|0.127276|0.123044|0.139253|0.215104|0.211522|0.500000| |1.798641|1.794335|1.577068|1.540211|2.218523|0.044317|1.870877|1.943343|1.539987|0.044812|1.516177|2.257090|1.737152|3.005777|1.873146|2.168337|2.382143|3.879870|3.360559|5.619393|5.745138|5.642694|6.764511|8.851802|17.500398|8.851310|6.775370|1.381203|1.361197|1.325794|0.046842|0.054950|0.048099|0.051110|0.041619|0.042302|0.043564|0.039414|0.053057|0.053785|0.052118|0.060600|0.040737|0.039577|0.046236|0.048982|0.052042|0.063676|0.058750|0.061365|0.066063|0.078642|0.117283|0.131492|0.138977|0.199225|0.173777|0.214707|0.303505|0.500000| |2.075145|2.114778|1.842409|1.815873|2.714233|0.054608|2.349254|2.417379|1.885685|0.056313|1.815005|2.719136|2.043211|3.464801|2.183028|2.521855|2.714350|4.291639|4.024461|7.618314|6.232730|6.779334|5.660308|6.785569|8.849657|17.496876|8.851792|1.667653|1.649693|1.606268|0.052511|0.063168|0.056159|0.059092|0.047446|0.049778|0.050726|0.046075|0.065308|0.070154|0.065655|0.076735|0.047743|0.047134|0.056238|0.055303|0.061856|0.077483|0.065874|0.066985|0.078172|0.081224|0.111069|0.201144|0.126752|0.131155|0.199652|0.139294|0.214779|0.173729|0.500000| |1.774762|1.813842|1.609690|1.601499|2.365149|0.047326|2.001988|2.024578|1.670740|0.049559|1.636240|2.456393|1.852599|3.131940|2.011215|2.293836|2.548639|4.026817|3.590000|6.453954|5.597170|5.489533|4.835420|5.491538|8.809594|17.547165|8.832400|1.492225|1.464046|1.452996|0.045657|0.053384|0.047888|0.051158|0.041930|0.043383|0.045078|0.041047|0.056352|0.059192|0.054716|0.062830|0.043217|0.042959|0.051208|0.051838|0.057369|0.068276|0.060063|0.064498|0.073882|0.077572|0.107081|0.140112|0.106565|0.126785|0.139341|0.123131|0.211342|0.214671|0.303719|0.500000| |1.903709|1.970844|1.729766|1.730519|2.521648|0.049463|2.161795|2.166647|1.773458|0.052003|1.779743|2.733596|2.129730|3.602252|2.394655|2.857389|3.369688|5.840268|5.338425|8.427873|9.573091|8.866973|6.810510|5.676599|6.785584|8.839991|17.481530|1.557877|1.502290|1.501539|0.049308|0.057607|0.050168|0.057104|0.045349|0.045719|0.049692|0.043970|0.062799|0.062754|0.056797|0.067877|0.047397|0.046314|0.056674|0.062077|0.067384|0.083377|0.075227|0.085054|0.095226|0.114511|0.196955|0.174515|0.139899|0.200967|0.131315|0.127095|0.139288|0.199666|0.173615|0.214547|0.500000| |2.043375|2.158962|1.891366|1.916057|2.864539|0.056131|2.499313|2.454259|2.029046|0.060635|2.019429|3.142360|2.408630|3.986399|2.717778|3.241541|3.809555|6.357626|6.381840|11.659472|9.499693|8.860617|5.506311|4.841930|5.484330|8.796434|17.562449|1.758764|1.688767|1.703257|0.052122|0.061421|0.054101|0.062019|0.048845|0.050071|0.054770|0.048430|0.072227|0.074575|0.064411|0.077398|0.052876|0.052406|0.065963|0.068536|0.078251|0.097939|0.081973|0.091857|0.113460|0.114542|0.164407|0.216372|0.123723|0.139789|0.126822|0.106681|0.123059|0.139154|0.214572|0.211614|0.302448|0.500000| |2.791629|3.442085|4.319615|6.106344|8.741807|0.170074|4.323797|3.524713|8.828627|0.175110|7.242613|6.381117|3.832102|6.920457|2.976541|2.618967|2.202827|2.702280|1.979563|3.815059|2.418444|1.693833|1.559596|1.467999|1.389338|1.481908|1.575777|17.527761|8.903018|8.894791|0.073627|0.069193|0.077099|0.090487|0.108445|0.119174|0.148596|0.219351|0.112390|0.112394|0.096419|0.083093|0.201297|0.205054|0.115317|0.076631|0.080597|0.076308|0.070635|0.057673|0.061209|0.051835|0.046166|0.050614|0.044976|0.040733|0.042808|0.038489|0.037020|0.036563|0.043284|0.039046|0.041129|0.045857|0.500000| |3.036184|3.587110|4.148093|4.780253|8.596200|0.232019|4.737919|4.125988|6.727575|0.188573|4.416645|4.894575|3.031898|5.314407|2.538490|2.394280|2.075137|2.639219|2.021549|4.002741|2.504397|1.817782|1.671302|1.611207|1.526864|1.636295|1.698686|8.712383|17.510425|6.772934|0.076045|0.075923|0.089433|0.087484|0.096839|0.129130|0.108851|0.138924|0.108147|0.136701|0.128416|0.096243|0.110484|0.116429|0.094041|0.063493|0.070507|0.073106|0.063513|0.053022|0.058603|0.050134|0.047044|0.055607|0.047975|0.042910|0.047976|0.041997|0.041151|0.039545|0.048887|0.042989|0.043541|0.049445|0.173052|0.500000| |2.644867|3.052913|3.694739|4.303548|6.589292|0.156745|3.621303|3.234383|5.419304|0.137143|4.058925|4.347929|2.732837|4.873039|2.289040|2.121624|1.851843|2.344518|1.762984|3.419967|2.199191|1.583596|1.472098|1.417376|1.347501|1.431571|1.487510|8.840956|17.598526|7.236149|0.068831|0.065748|0.077163|0.076468|0.091574|0.114056|0.100232|0.138612|0.088462|0.099579|0.096366|0.076962|0.106990|0.113234|0.083441|0.058763|0.063206|0.062990|0.057053|0.048196|0.051973|0.045048|0.041855|0.047675|0.042267|0.038226|0.041773|0.037274|0.036366|0.035231|0.042274|0.037848|0.038595|0.043093|0.211327|0.303554|0.500000| |3.463076|4.154428|5.498826|6.405824|9.543773|0.257260|4.710080|4.307377|6.416286|0.150443|4.492611|4.782698|3.085934|5.702779|2.516735|2.376063|2.026385|2.581145|1.948305|3.776355|2.430164|1.743558|1.626468|1.555483|1.456901|1.539429|1.607559|8.626460|17.540776|5.500926|0.088833|0.082871|0.101938|0.099518|0.128503|0.181987|0.133455|0.211506|0.110231|0.121439|0.130204|0.096764|0.122951|0.114815|0.088045|0.063953|0.067812|0.071534|0.064749|0.052294|0.056034|0.049673|0.046001|0.052886|0.047261|0.041964|0.046088|0.040909|0.039149|0.037950|0.045527|0.040270|0.041531|0.046276|0.214101|0.299365|0.305469|0.500000| |2.220136|2.651940|2.967818|3.786142|6.091331|0.118083|3.620936|2.886839|6.870563|0.185027|6.672301|6.749561|3.712361|6.027881|3.070666|2.605714|2.266519|2.726542|1.995813|3.904697|2.405843|1.687939|1.526155|1.440589|1.390911|1.510280|1.609232|8.640279|5.495043|17.597223|0.057959|0.057398|0.061210|0.071474|0.074883|0.081296|0.101022|0.113123|0.096834|0.104176|0.079068|0.072035|0.149561|0.255070|0.139980|0.078594|0.088961|0.075285|0.067444|0.059421|0.065295|0.051538|0.045919|0.050228|0.043225|0.040017|0.041784|0.037468|0.037062|0.036674|0.044127|0.040273|0.042036|0.047669|0.209046|0.138712|0.144786|0.121657|0.500000| |2.182430|2.543232|2.920795|3.571329|5.561671|0.116575|3.234658|2.727664|5.492276|0.145046|4.676462|4.918295|2.930438|4.988486|2.472631|2.193192|1.931818|2.386216|1.766896|3.433843|2.171925|1.545834|1.417752|1.354823|1.305599|1.403706|1.473580|8.822488|7.034413|17.590099|0.057223|0.055817|0.061545|0.066832|0.074079|0.083476|0.090779|0.111166|0.083506|0.091910|0.077368|0.067359|0.116199|0.150349|0.098735|0.063943|0.070229|0.063847|0.057860|0.050735|0.055114|0.045555|0.041536|0.046080|0.040267|0.037121|0.039495|0.035462|0.035072|0.034363|0.041161|0.037451|0.038475|0.043227|0.215929|0.167487|0.220881|0.144373|0.303943|0.500000| 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