Version2.0 2020-08-09T12:59:49Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 06-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@@]12CCCC[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@H]3CC[C@]4(C[NH+](CCO)CCO)O)C C16677211 RHF 6-31G(d) (6D,7F) C[C@@]12CCCC[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@H]3CC[C@]4(C[NH+](CCO)CCO)O)C C01[X(C24H44N1O3)] 210 C1 508 OCC[NH+](C[C@]1(O)CC[C@H]2[C@]1(C)CC[C@H]1[C@H]2CC[C@H]2[C@@]1(C)CCCC2)CCO OCC[NH+](C[C@]1(O)CC[C@H]2[C@]1(C)CC[C@H]1[C@H]2CC[C@H]2[C@@]1(C)CCCC2)CCO C[C@@]12CCCC[C@H]1CC[C@@H]3[C@@H]2CC[C@@]4(C)[C@@H]3CC[C@@]4(O)C[NH+](CCO)CCO InChIKey=KGRGAVSLNLMKNR-PKQJRJOWSA-O InChI=1S/C24H43NO3/c1-22-10-4-3-5-18(22)6-7-19-20(22)8-11-23(2)21(19)9-12-24(23,28)17-25(13-15-26)14-16-27/h18-21,26-28H,3-17H2,1-2H3/p+1/t18-,19+,20-,21+,22+,23-,24+/m0/s1 InChI=1/C24H43NO3/c1-22-10-4-3-5-18(22)6-7-19-20(22)8-11-23(2)21(19)9-12-24(23,28)17-25(13-15-26)14-16-27/h18-21,26-28H,3-17H2,1-2H3/p+1/t18-,19+,20-,21+,22+,23-,24+/m0/s1/fC24H44NO3/h25H/q+1 C[C@@]12CCCC[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@H]3CC[C@]4(C[NH+](CCO)CCO)O)C C01[X(C24H44N1O3)] 210 C01 508 OCC[NH+](C[C@]1(O)CC[C@H]2[C@]1(C)CC[C@H]1[C@H]2CC[C@H]2[C@@]1(C)CCCC2)CCO OCC[NH](C[C@]1(O)CC[C@H]2[C@]1(C)CC[C@H]1[C@H]2CC[C@H]2[C@@]1(C)CCCC2)CCO C[C@@]12CCCC[C@H]1CC[C@@H]3[C@@H]2CC[C@@]4(C)[C@@H]3CC[C@@]4(O)C[NH](CCO)CCO InChIKey=KGRRWZHTYQAOPI-PKQJRJOWSA-N InChI=1S/C24H44NO3/c1-22-10-4-3-5-18(22)6-7-19-20(22)8-11-23(2)21(19)9-12-24(23,28)17-25(13-15-26)14-16-27/h18-21,25-28H,3-17H2,1-2H3/t18-,19+,20-,21+,22+,23-,24+/m0/s1 InChI=1/C24H44NO3/c1-22-10-4-3-5-18(22)6-7-19-20(22)8-11-23(2)21(19)9-12-24(23,28)17-25(13-15-26)14-16-27/h18-21,25-28H,3-17H2,1-2H3/t18-,19+,20-,21+,22+,23-,24+/m0/s1 3031.1195848704 -1213.2745717 1-A 15293.5227 109 399 508 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1333.47 1346.94 1361.18 1365.27 1396.67 1420.67 1442.83 1463.69 1472.55 1490.28 1508.53 1510.06 1525.91 1536.13 1553.36 1557.92 1562.94 1576.50 1580.35 1588.51 1599.93 1634.35 1652.83 1660.11 1676.46 1689.64 1706.32 1713.98 1726.35 1741.12 1748.76 1758.36 1760.11 1773.89 1793.89 1805.10 1808.68 1833.61 1849.88 1871.77 1880.54 1895.69 1905.36 1919.06 1929.04 1949.65 1954.12 1974.73 1982.63 1995.73 2005.23 2017.09 2025.59 2037.78 2041.39 2048.48 2053.48 2075.15 2081.54 2090.70 2097.22 2102.24 2113.22 2132.17 2158.17 2160.62 2166.40 2179.66 2185.34 2189.64 2197.12 2198.61 2203.61 2210.29 2216.69 2222.93 2230.14 2235.49 2246.60 2253.18 2263.53 2275.40 2291.62 2306.63 2324.87 2347.77 2350.63 2351.48 2354.07 2357.50 2358.59 2360.98 2369.69 2376.74 2378.31 2381.93 2387.56 2390.11 2393.03 2396.43 2399.35 2402.90 2417.46 2421.74 2432.04 4537.34 4546.88 4582.89 4585.36 4594.11 4599.16 4599.77 4605.97 4606.49 4616.70 4622.90 4626.01 4628.86 4631.52 4631.78 4641.10 4643.19 4649.21 4651.36 4653.96 4660.24 4661.33 4675.93 4679.07 4682.43 4693.69 4695.88 4709.43 4711.61 4714.87 4724.52 4745.52 4749.67 4760.36 4767.49 4773.88 4785.21 4836.02 4854.61 4872.40 5213.72 5902.66 5911.93 5915.28 0.718233 0.744935 0.745880 0.662102 -1212.556339 -1212.529636 -1212.528692 -1212.612470 2.809928D-04 MUNgauss RevisionA2.0 retrievium 09-Aug-2020 DUDE C[C@@]12CCCC[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@H]3CC[C@]4(C[NH+](CCO)CCO)O)C C16677211 RHF 6-31G(d) (6D,10F) C1 394.332120 |X|Y|Z| 37.373975 38.314115 111.483529 54.247484 17 6 17 |36.858105| |12.339104|36.858105| |7.590310|12.302449|36.858105| |6.133677|7.364798|12.425134|36.858105| |5.113774|6.292986|7.537688|12.468021|36.858105| |6.061629|7.375739|6.487004|7.565523|12.465776|36.858105| |7.451595|12.262107|7.583685|6.445776|7.493615|12.406931|36.858105| |5.497539|8.943040|7.029327|5.823889|6.971413|9.024560|17.483419|0.500000| |6.214207|7.392905|4.872871|4.328491|4.888835|7.539630|12.384006|0.247772|36.858105| |5.648541|6.510544|4.324496|3.591539|3.727733|4.870890|7.402538|0.181484|12.353832|36.858105| |5.425503|7.299876|4.975341|3.775469|3.737110|4.461205|6.960818|0.196702|7.531617|12.457669|36.858105| |4.611765|6.523853|4.911020|3.805127|3.926597|4.612919|7.141286|0.240511|7.126216|9.002788|17.520505|0.500000| |7.561958|12.004586|7.321785|4.776762|4.273977|4.808793|7.420601|0.194086|6.270920|7.495069|12.334332|0.247371|36.858105| |7.988600|8.857852|5.982167|4.209285|3.683782|4.119703|5.731037|0.142925|5.354761|6.691048|8.918243|0.175510|17.525860|0.500000| |5.079981|7.144570|6.608414|4.327644|3.776592|3.857612|5.212813|0.154085|4.351497|4.928048|7.652188|0.198879|12.395886|0.251335|36.858105| |3.927918|4.769886|4.337609|3.217745|2.908267|3.016330|3.876303|0.113100|3.592591|4.347762|6.494470|0.163403|7.530186|0.199137|12.410269|36.858105| |3.474415|4.156790|3.591219|2.813215|2.680002|2.880295|3.730638|0.110729|3.725933|4.824156|7.352947|0.189249|6.255550|0.161911|7.363813|12.305147|36.858105| |4.051848|4.787070|3.742511|2.959996|2.886698|3.279140|4.454732|0.127415|4.877817|7.467215|12.373020|0.250738|7.428411|0.193934|6.445275|7.518289|12.277443|36.858105| |3.469086|4.035548|3.243975|2.672210|2.687461|3.077536|4.057151|0.118419|4.654414|6.941821|9.010176|0.226511|5.501885|0.141655|4.923598|5.525569|8.869880|17.475256|0.500000| |3.917993|4.130921|3.271997|2.658988|2.542490|2.875316|3.702003|0.099975|4.137391|6.105305|7.266148|0.151200|5.887828|0.186784|5.023731|6.072883|7.727684|12.310939|0.246591|36.858105| |3.161189|3.329014|2.839359|2.334923|2.205907|2.402756|2.963845|0.081958|3.143852|4.136962|4.983191|0.116561|4.528447|0.140694|4.480611|6.185021|7.786654|7.688311|0.177003|12.319635|36.858105| |2.904720|3.230905|2.848960|2.329282|2.218867|2.375759|2.934239|0.084492|3.021968|3.851479|4.967892|0.125728|4.415457|0.125456|4.848472|7.437360|12.180793|7.882454|0.191828|7.720211|12.355253|36.858105| |2.536309|2.792167|2.592322|2.146111|2.017899|2.099740|2.511354|0.072556|2.504008|3.006401|3.745271|0.098490|3.623420|0.103009|4.249412|6.440885|7.389372|4.981217|0.125011|4.950648|7.276577|12.357576|36.858105| |2.141315|2.307274|2.155043|1.837816|1.749313|1.821147|2.128064|0.061190|2.154506|2.544454|2.998905|0.079880|2.853129|0.081249|3.188980|4.278069|4.917516|3.845001|0.102927|3.965446|5.594535|7.488068|12.682026|53.358707| |2.091440|2.268293|2.100263|1.801757|1.738033|1.823189|2.133928|0.061749|2.187895|2.597068|3.036670|0.081929|2.792338|0.078362|3.064847|4.005326|4.930694|3.950137|0.110412|3.968847|5.364620|7.450769|9.437383|25.587123|0.500000| |2.056887|2.152009|1.992481|1.718864|1.633289|1.711420|1.981014|0.055939|2.033958|2.404756|2.732384|0.071221|2.616835|0.076577|2.806514|3.612343|4.017999|3.450637|0.092344|3.854921|5.562767|5.906145|7.475816|17.255636|0.263452|36.858105| |2.088276|2.144187|2.005700|1.730618|1.619266|1.683297|1.933472|0.053968|1.961222|2.290383|2.588180|0.066624|2.582833|0.077319|2.776627|3.530994|3.615091|3.150983|0.081582|3.611726|5.078569|4.882765|6.175658|10.158299|0.157609|12.555102|36.858105| |1.944946|2.012860|1.928878|1.672878|1.558187|1.595862|1.813772|0.050985|1.807946|2.066701|2.348818|0.061553|2.387269|0.070359|2.636713|3.303856|3.255601|2.771748|0.071857|3.022348|3.973221|4.108151|5.557252|9.036046|0.138901|8.042621|13.638262|73.516695| |1.910429|2.062893|1.980073|1.710269|1.626521|1.665909|1.911911|0.055324|1.903697|2.180956|2.544974|0.069319|2.476403|0.069561|2.819266|3.610188|3.880281|3.078782|0.082886|3.071869|3.941898|4.969506|7.647818|17.178403|0.261244|7.562859|5.894856|11.840086|36.858105| |1.819944|1.995744|1.926426|1.676403|1.616113|1.651310|1.888085|0.055438|1.877082|2.127437|2.480758|0.069449|2.368053|0.064894|2.700920|3.347727|3.714228|2.957223|0.081950|2.815013|3.407929|4.420429|5.915035|10.481913|0.221326|5.125003|4.070430|7.742029|12.554449|36.858105| |1.756105|1.914309|1.818913|1.595509|1.556856|1.610526|1.840660|0.053906|1.865667|2.129768|2.435655|0.068165|2.260457|0.062002|2.495004|3.037337|3.532152|2.940611|0.084234|2.822293|3.385506|4.302643|5.126743|9.575443|0.248092|5.149788|3.825753|6.797852|8.188753|13.607463|73.516695| |2.514266|2.780913|2.464767|2.077259|2.028052|2.185215|2.649839|0.077009|2.798898|3.519041|4.245541|0.112833|3.581377|0.099117|3.777082|5.011406|7.728588|6.354116|0.189609|6.012683|7.853980|13.443521|8.214884|10.042104|0.259502|5.819357|4.330178|6.526669|4.939757|4.754153|9.176654|73.516695| |2.986604|3.662110|3.328296|2.685405|2.634259|2.781837|3.512595|0.110198|3.439929|4.140404|5.865521|0.182726|4.917424|0.119650|5.964324|7.544441|12.410707|7.436787|0.200790|4.986342|4.986451|7.402927|5.924475|6.025541|0.129724|3.479870|3.059103|5.108401|3.783158|3.973068|6.723444|11.928518|36.858105| |17.532005|8.776914|7.012995|5.525428|4.321184|4.653872|5.446787|0.123648|4.677590|4.608089|4.741898|0.112176|6.885151|0.226918|5.133769|4.060095|3.427709|3.822789|0.089662|3.841762|3.221000|2.925528|2.610727|2.985032|0.058695|2.119928|2.194789|3.648987|1.962246|1.844726|3.134670|4.418510|2.894183|0.500000| |17.574475|8.683221|5.482310|4.640079|4.234320|5.294520|6.665533|0.138848|6.848104|6.710906|5.727542|0.128733|6.991116|0.221542|4.585173|3.799554|3.526763|4.346815|0.103948|4.402046|3.392585|3.011305|2.567515|2.974514|0.059641|2.126256|2.147254|3.498962|1.922905|1.825039|3.166638|4.671062|2.973778|0.302720|0.500000| |17.613084|8.653497|6.817051|6.774752|5.709078|6.747043|6.785831|0.139238|5.611448|4.676974|4.324296|0.107943|5.449661|0.152810|4.084051|3.247385|2.928176|3.346539|0.082507|3.235285|2.685572|2.499074|2.220688|2.600193|0.052009|1.842013|1.870140|3.122058|1.726639|1.656190|2.848814|3.932580|2.605370|0.303065|0.303541|0.500000| |5.517260|8.791401|17.534496|8.952419|6.858938|5.724133|6.828243|0.208331|4.515099|4.105279|4.988815|0.146831|6.855099|0.147572|7.308868|4.619851|3.814914|3.811500|0.092724|3.198126|2.829161|2.948327|2.707155|3.042856|0.060743|2.028487|2.019690|3.482520|2.072065|2.043324|3.407020|4.555187|3.701284|0.143836|0.122711|0.138651|0.500000| |7.059542|8.767485|17.532103|8.859431|5.504361|4.849741|5.499019|0.142512|4.028403|3.806439|4.420731|0.117037|6.667764|0.168311|6.617932|4.477057|3.519567|3.550135|0.084365|3.226473|2.878342|2.858053|2.659838|2.994597|0.058751|2.045032|2.095517|3.606052|2.029731|1.947153|3.235707|4.320073|3.179364|0.215945|0.143076|0.172455|0.303714|0.500000| |4.682342|5.433744|8.877473|17.536093|8.828341|5.505891|4.847960|0.130443|3.513459|3.032777|3.246113|0.092067|4.017007|0.100009|3.923649|2.994515|2.597116|2.649913|0.066943|2.391806|2.155108|2.176551|2.047890|2.400530|0.047869|1.644130|1.661417|2.888259|1.663487|1.635762|2.748880|3.462950|2.521157|0.125130|0.103581|0.139589|0.219530|0.215064|0.500000| |6.721535|6.579084|8.785443|17.540656|8.847502|6.746900|5.613058|0.133003|4.101453|3.426965|3.469214|0.093975|4.356336|0.112922|3.825716|2.959939|2.602069|2.773920|0.069580|2.576279|2.259187|2.205509|2.033510|2.389957|0.047684|1.664616|1.690242|2.894121|1.629893|1.584255|2.690334|3.498890|2.436373|0.171359|0.138227|0.235242|0.174323|0.214212|0.304766|0.500000| |4.276689|5.552762|6.781709|8.864692|17.496376|8.861374|6.739943|0.205609|4.525875|3.568968|3.712279|0.113325|4.123649|0.096438|3.840205|2.956371|2.745395|2.896335|0.075686|2.490139|2.185609|2.248259|2.055141|2.422960|0.049323|1.643093|1.616330|2.780055|1.665967|1.673625|2.859616|3.678195|2.786314|0.103565|0.101640|0.124422|0.202036|0.139798|0.216221|0.173911|0.500000| |4.263547|4.748741|5.488296|8.814972|17.542835|8.822927|5.472455|0.141925|4.069334|3.170692|3.108865|0.089877|3.464345|0.086004|3.118627|2.499610|2.325754|2.492053|0.065262|2.241610|1.968966|1.971566|1.810620|2.165598|0.043932|1.496044|1.487110|2.552093|1.489250|1.481091|2.543758|3.236820|2.294659|0.103157|0.101349|0.137100|0.140423|0.123446|0.210599|0.215523|0.303562|0.500000| |4.625003|5.435393|4.870722|5.507088|8.835168|17.523925|8.872789|0.218640|7.036504|4.533417|4.042967|0.119956|4.045140|0.097295|3.359552|2.727616|2.686095|3.062004|0.082353|2.670885|2.246121|2.240402|1.979276|2.365328|0.048736|1.632220|1.591000|2.682030|1.594805|1.595808|2.789114|3.740664|2.658482|0.103394|0.119913|0.139025|0.128437|0.106989|0.123516|0.138660|0.216188|0.211227|0.500000| |6.622898|6.588581|5.638182|6.750133|8.848590|17.527456|8.797385|0.174985|6.879500|4.599543|4.023547|0.110021|4.382517|0.110530|3.468866|2.790592|2.658674|3.052340|0.079369|2.787133|2.324996|2.247670|1.991190|2.368725|0.048234|1.657365|1.643084|2.759145|1.588709|1.561512|2.714631|3.673041|2.512872|0.137818|0.163589|0.233797|0.131373|0.125890|0.138653|0.196292|0.173876|0.215735|0.304688|0.500000| |4.636914|5.481755|4.106772|3.814893|4.545804|6.775964|8.902922|0.225680|17.541264|8.799058|6.115126|0.180082|4.902621|0.117065|3.758845|3.200837|3.417950|4.347358|0.122513|3.634500|2.853003|2.810239|2.347129|2.791751|0.058491|1.927634|1.837862|3.025739|1.826720|1.826794|3.255357|4.774313|3.313870|0.103154|0.137319|0.122133|0.110749|0.095218|0.088822|0.099085|0.122245|0.108280|0.206962|0.165004|0.500000| |6.455453|6.344763|4.395102|4.135912|4.617610|7.173479|8.806628|0.175216|17.551644|8.800268|5.639135|0.142900|5.169279|0.133373|3.707405|3.140198|3.199929|4.082972|0.108211|3.747245|2.890501|2.706639|2.278399|2.706737|0.055829|1.909196|1.860744|3.045697|1.763805|1.726332|3.056055|4.470279|2.920677|0.132423|0.212709|0.173682|0.109000|0.104192|0.093178|0.114920|0.113447|0.111636|0.185114|0.215407|0.305319|0.500000| |4.290324|4.795508|3.522764|3.036497|3.215467|4.090821|5.583773|0.148031|8.783605|17.527342|8.827577|0.212451|5.470505|0.139751|4.102174|3.852667|4.556345|7.037658|0.215103|5.798676|4.023996|3.797860|2.932124|3.459040|0.073439|2.407811|2.247353|3.585445|2.169238|2.139105|3.879046|6.518411|4.075691|0.101706|0.138118|0.103946|0.095550|0.087549|0.073089|0.080564|0.087323|0.077962|0.111809|0.107527|0.229354|0.193243|0.500000| |6.119016|6.026271|4.051132|3.400460|3.403451|4.337686|6.010082|0.141276|8.767980|17.542788|8.857574|0.175228|6.879743|0.199861|4.540081|4.147768|4.447035|6.681272|0.164992|6.685589|4.348167|3.770675|2.960944|3.434882|0.070767|2.445441|2.367215|3.752983|2.147755|2.057291|3.660151|6.022460|3.650706|0.140964|0.229492|0.137339|0.103176|0.103137|0.080053|0.093381|0.088367|0.082067|0.109960|0.120904|0.178161|0.228583|0.304844|0.500000| |5.054522|6.607492|7.228725|4.619972|3.767811|3.661877|4.616829|0.131739|3.772161|4.057059|5.521047|0.144217|8.758236|0.214012|17.592455|8.956360|5.456186|4.827613|0.107738|4.176160|3.891888|4.082702|3.829015|4.004481|0.077216|2.630443|2.679620|4.613188|2.668670|2.527348|4.098922|5.749020|4.626562|0.152152|0.121153|0.114986|0.215128|0.234262|0.119914|0.114165|0.104948|0.087336|0.087416|0.093173|0.090962|0.092961|0.095030|0.108028|0.500000| |4.402020|6.407761|6.457040|4.389077|3.990717|3.972486|5.299450|0.172544|4.275682|4.598791|6.918422|0.214139|8.763754|0.174999|17.550959|8.803928|6.621473|5.700345|0.130979|4.247304|3.841401|4.364950|3.902939|4.095300|0.081785|2.603086|2.526530|4.325938|2.724148|2.697782|4.430630|6.405008|6.511474|0.118737|0.110264|0.103380|0.230338|0.165609|0.112735|0.103509|0.118530|0.090603|0.097991|0.095677|0.106836|0.099037|0.109823|0.112406|0.304868|0.500000| |4.030635|4.529146|4.066982|3.070455|2.728675|2.843796|3.579546|0.100004|3.388905|4.128878|5.678855|0.134510|6.885911|0.216441|8.945765|17.521963|8.746201|6.658170|0.136613|6.575167|7.111864|7.169319|6.399651|5.874703|0.108729|3.845521|3.951477|6.427567|3.572847|3.166708|5.132625|8.366915|5.507482|0.120761|0.110015|0.091601|0.114008|0.121301|0.079216|0.080733|0.075318|0.065957|0.070993|0.074991|0.082726|0.084875|0.101094|0.115869|0.220777|0.174466|0.500000| |3.327627|3.971100|3.881013|2.971111|2.681605|2.700948|3.328400|0.098580|3.048028|3.523961|4.866041|0.131191|5.499114|0.145030|8.866213|17.515308|8.772007|5.479125|0.124060|4.648581|5.089703|6.507419|6.874839|6.124849|0.114245|3.641919|3.580188|6.235899|4.000234|3.721350|5.737795|8.267239|7.136611|0.096413|0.088246|0.078990|0.118087|0.113081|0.079079|0.075588|0.076810|0.064830|0.068570|0.069330|0.077318|0.075016|0.089163|0.093314|0.218351|0.214490|0.304126|0.500000| |3.559978|3.647545|2.901578|2.439498|2.382154|2.734926|3.440353|0.092121|4.048863|5.997502|6.056235|0.132887|4.748475|0.145639|4.003167|4.549366|5.718322|8.725801|0.228973|17.586278|8.704699|6.002554|4.128139|4.848479|0.101703|3.578086|3.299703|4.888856|2.796823|2.597592|4.754649|9.741509|4.227333|0.095076|0.114046|0.083963|0.078424|0.078553|0.060954|0.066245|0.064596|0.059059|0.071846|0.074491|0.101060|0.104300|0.173480|0.188556|0.095094|0.098359|0.133007|0.102973|0.500000| |4.677678|4.650046|3.583092|2.880435|2.692277|3.053246|3.933605|0.102179|4.329060|6.219196|7.029693|0.141286|6.634355|0.244542|5.241922|5.881200|6.210568|8.687125|0.176610|17.618794|8.782476|5.861392|4.294745|4.717462|0.093813|3.435436|3.399711|5.135104|2.783140|2.530442|4.435046|8.134374|4.232005|0.130422|0.150530|0.103766|0.094038|0.099883|0.071197|0.078810|0.071834|0.065790|0.077082|0.083742|0.101523|0.112103|0.150556|0.210081|0.125320|0.117795|0.191510|0.124301|0.305680|0.500000| |2.764454|2.851742|2.461409|2.078783|1.985707|2.165278|2.608799|0.071940|2.813177|3.622768|4.073327|0.098285|3.661277|0.112067|3.576423|4.601159|5.664330|5.817820|0.150448|8.683490|17.589430|8.756310|6.176599|7.631742|0.154134|6.269613|5.428753|7.145480|3.891541|3.340682|6.124547|13.487273|4.159435|0.077846|0.083089|0.066663|0.067964|0.069063|0.053573|0.056283|0.054609|0.049825|0.056900|0.058668|0.072171|0.073078|0.101380|0.106634|0.088550|0.088122|0.141909|0.111809|0.225300|0.185142|0.500000| |3.227343|3.317281|2.886888|2.363452|2.184951|2.344387|2.852936|0.077994|2.943800|3.728480|4.455117|0.104469|4.456999|0.145173|4.526123|6.288392|6.471376|6.021898|0.136136|8.764770|17.584206|8.752889|7.005529|7.226550|0.131962|5.499233|5.712731|7.869043|3.897410|3.252790|5.556744|10.234234|4.329819|0.094527|0.094919|0.075897|0.078992|0.083522|0.060940|0.064056|0.059711|0.054315|0.060185|0.063530|0.073395|0.076344|0.097557|0.111036|0.114358|0.104561|0.231164|0.146773|0.180395|0.230526|0.303569|0.500000| |2.609798|2.822614|2.652524|2.186392|2.018463|2.082182|2.472463|0.070453|2.433213|2.886109|3.561009|0.091890|3.642592|0.106792|4.320106|6.556407|6.256480|4.506994|0.109304|4.717381|6.880533|8.664997|17.687030|12.327986|0.182855|6.983770|7.099803|11.688992|6.653062|4.900715|7.425174|10.394543|4.861441|0.076297|0.072861|0.063275|0.076033|0.077340|0.058171|0.057976|0.056629|0.050392|0.053975|0.055275|0.062583|0.062196|0.076615|0.080479|0.112867|0.106461|0.202961|0.198979|0.107986|0.120764|0.159722|0.217693|0.500000| |2.467925|2.782112|2.643849|2.186704|2.061697|2.117538|2.523365|0.074320|2.467412|2.897102|3.662022|0.100137|3.567077|0.097725|4.392138|6.532038|7.238528|4.646187|0.118534|4.246816|5.466999|8.867732|17.683726|12.565649|0.220092|5.590160|4.792641|8.403618|7.678896|6.825659|9.607095|12.343207|6.853556|0.070142|0.068298|0.060443|0.078448|0.074959|0.058487|0.056852|0.059092|0.051277|0.055611|0.055160|0.064851|0.061801|0.078352|0.077511|0.109866|0.117089|0.162603|0.218401|0.099864|0.104279|0.130610|0.145947|0.303846|0.500000| |1.845145|1.926105|1.797824|1.571782|1.503429|1.570588|1.796098|0.050825|1.846169|2.150130|2.401334|0.063462|2.291986|0.066382|2.444206|3.037496|3.363034|2.953290|0.080796|3.223987|4.303813|4.591389|5.561950|12.495961|0.226807|17.642555|8.883325|12.638396|7.325405|5.181243|9.789129|8.620799|3.054427|0.052584|0.052890|0.046399|0.050937|0.051059|0.041955|0.042323|0.042109|0.038497|0.041884|0.042291|0.049070|0.048349|0.060314|0.060463|0.064057|0.064014|0.088084|0.085883|0.085391|0.080638|0.134881|0.116886|0.143723|0.128202|0.500000| |2.154769|2.241465|2.035032|1.754766|1.677749|1.781147|2.076575|0.058301|2.171899|2.617582|2.937161|0.075520|2.744335|0.080902|2.856875|3.648824|4.236772|3.814884|0.103451|4.463479|6.712691|6.487402|6.762901|12.412432|0.238215|17.668933|8.893474|10.261208|5.608410|4.344291|8.201441|11.962638|3.566809|0.061216|0.062771|0.053385|0.057168|0.057575|0.046222|0.047338|0.046692|0.042625|0.047272|0.048056|0.057107|0.056694|0.073632|0.074563|0.073263|0.073168|0.108340|0.098127|0.118030|0.107218|0.241212|0.171309|0.169672|0.140081|0.302773|0.500000| |1.958690|1.981145|1.848238|1.614899|1.517196|1.582463|1.800538|0.049911|1.842354|2.138733|2.357226|0.060599|2.342085|0.070388|2.457762|3.013547|3.100951|2.821886|0.074039|3.283291|4.396484|4.031303|4.654158|7.535919|0.128920|9.061838|17.546577|16.414078|4.640634|3.447144|5.979052|6.639689|2.660650|0.057091|0.056341|0.049108|0.051311|0.053512|0.043035|0.044125|0.041883|0.038944|0.041684|0.043208|0.048085|0.049043|0.058640|0.061952|0.066154|0.062400|0.093270|0.083557|0.085986|0.086886|0.136624|0.134825|0.141930|0.105396|0.221571|0.215064|0.500000| |2.345159|2.391439|2.218076|1.889910|1.750885|1.825356|2.116275|0.058622|2.141331|2.526957|2.884137|0.072813|2.930777|0.089798|3.142560|4.078411|4.042378|3.532225|0.088660|4.199817|6.162803|5.451945|6.589773|8.928158|0.142501|8.817536|17.570606|16.488157|5.023620|3.675864|6.093540|7.902895|3.253884|0.069230|0.067125|0.057660|0.061541|0.064925|0.050122|0.051416|0.048269|0.044434|0.047514|0.049615|0.055043|0.056451|0.067893|0.073405|0.084499|0.077439|0.133616|0.112211|0.103325|0.112161|0.174037|0.216124|0.233438|0.137552|0.173728|0.216632|0.302635|0.500000| |1.901740|1.945513|1.877353|1.637829|1.516658|1.546622|1.743919|0.048724|1.731068|1.960215|2.206283|0.057658|2.276508|0.067574|2.498471|3.054486|2.933212|2.549029|0.065768|2.795246|3.559238|3.556781|4.543925|6.838300|0.111565|5.940159|9.791537|35.706916|5.083927|3.630623|5.729915|5.622882|2.588977|0.056203|0.053305|0.047908|0.052613|0.055263|0.044323|0.044530|0.042102|0.038961|0.040510|0.041992|0.045144|0.045884|0.052830|0.055976|0.069409|0.063807|0.094000|0.089663|0.070949|0.075843|0.099449|0.112362|0.151370|0.110568|0.151221|0.130804|0.230196|0.223352|0.500000| |1.759344|1.873103|1.797574|1.571418|1.497774|1.535620|1.744467|0.050112|1.748097|1.990241|2.271204|0.061593|2.211597|0.062615|2.461976|3.056370|3.259419|2.709841|0.073571|2.767244|3.504969|4.117010|5.669014|12.339060|0.207853|7.629477|6.057892|12.690046|17.694637|8.937601|13.056264|7.460871|3.152428|0.050248|0.049400|0.044473|0.051823|0.051231|0.042504|0.041884|0.042434|0.038348|0.040954|0.040942|0.046707|0.045406|0.055235|0.054892|0.065348|0.065929|0.085595|0.091856|0.071427|0.070347|0.099560|0.097070|0.146332|0.150292|0.244610|0.152489|0.139144|0.133702|0.150384|0.500000| |1.958743|2.115845|2.060557|1.771517|1.665357|1.688501|1.932919|0.055862|1.896284|2.153272|2.533497|0.068859|2.536225|0.071456|2.954521|3.800859|3.834083|3.001840|0.078937|2.988238|3.789994|4.673763|7.445387|12.231719|0.184319|6.256862|5.797888|13.105854|17.688900|8.755675|10.293246|7.640264|3.688238|0.056458|0.054229|0.049132|0.059997|0.059366|0.048151|0.046865|0.047361|0.042317|0.044605|0.044727|0.050215|0.048865|0.058648|0.059044|0.079256|0.078822|0.105523|0.121574|0.074399|0.076908|0.100682|0.108430|0.205406|0.218709|0.159891|0.133054|0.124560|0.143295|0.159017|0.303009|0.500000| |1.674643|1.826928|1.786000|1.571181|1.514181|1.534485|1.732216|0.050795|1.711537|1.909683|2.198978|0.061791|2.126959|0.058271|2.419854|2.909135|3.116809|2.548824|0.070474|2.437176|2.879927|3.559300|4.573996|7.621661|0.154798|4.227825|3.579257|7.095408|8.978235|17.561701|16.380630|6.651649|3.339817|0.047259|0.046425|0.042673|0.052621|0.050288|0.042899|0.041308|0.043608|0.038780|0.041269|0.040380|0.046402|0.043980|0.053190|0.051398|0.063936|0.067536|0.076984|0.090215|0.062949|0.061935|0.078668|0.077750|0.112793|0.144264|0.122605|0.100195|0.086388|0.089558|0.095082|0.219542|0.210095|0.500000| |1.940331|2.166036|2.101420|1.812812|1.749048|1.780393|2.050551|0.060944|2.018025|2.283707|2.719441|0.077343|2.592010|0.069861|3.029464|3.783352|4.223903|3.231274|0.089236|2.958810|3.508495|4.762465|6.290331|9.254760|0.196431|4.489535|3.697989|6.913063|8.776204|17.543101|16.455309|8.893062|4.805059|0.054420|0.053681|0.048888|0.062741|0.058725|0.049180|0.047155|0.050707|0.044255|0.047750|0.046361|0.054613|0.051030|0.063499|0.060560|0.077916|0.085591|0.095841|0.119977|0.074780|0.073669|0.092444|0.092328|0.140864|0.231085|0.119438|0.110322|0.086817|0.097040|0.092124|0.173713|0.210690|0.301376|0.500000| |1.691412|1.853549|1.767253|1.560751|1.535508|1.586620|1.804331|0.053185|1.828553|2.067573|2.349752|0.066720|2.164934|0.058749|2.380207|2.828895|3.295834|2.788885|0.081083|2.623713|3.038742|3.818132|4.311141|7.252306|0.181755|4.131846|3.220317|5.727281|5.982111|9.737678|35.714690|8.197723|3.672092|0.046875|0.047563|0.043097|0.051980|0.048780|0.042091|0.040991|0.044301|0.039282|0.043205|0.041640|0.050311|0.046702|0.059203|0.055041|0.060983|0.067050|0.073713|0.083248|0.069658|0.064616|0.085300|0.077612|0.099402|0.129486|0.121166|0.106766|0.080177|0.081927|0.077397|0.152083|0.130173|0.222376|0.228151|0.500000| |2.594283|2.869809|2.490070|2.110127|2.088017|2.288632|2.797505|0.081151|3.043032|3.926929|4.615524|0.122380|3.675145|0.100859|3.696652|4.634757|7.235765|7.128048|0.243071|6.552326|7.309710|9.659003|5.979892|7.390727|0.181601|4.714237|3.703314|5.606123|3.974337|3.920441|7.677163|35.715476|6.398948|0.070088|0.076369|0.063435|0.071518|0.067249|0.054487|0.055594|0.059048|0.052025|0.061665|0.060100|0.081791|0.075500|0.117936|0.103858|0.086884|0.098595|0.120493|0.115402|0.177533|0.133051|0.201133|0.145494|0.130426|0.147739|0.113346|0.154916|0.091973|0.106771|0.077266|0.097196|0.098368|0.089124|0.114731|0.111786|0.500000| |3.197600|4.116750|3.784754|3.020812|3.006634|3.157663|4.056424|0.134107|3.821143|4.410879|6.408431|0.227596|5.393999|0.122912|6.622031|6.886320|8.777212|6.720673|0.179888|4.445755|4.157510|5.420068|4.551424|4.843335|0.102573|2.923190|2.650366|4.479807|3.162211|3.326062|5.623934|8.787468|17.612187|0.084509|0.086775|0.077801|0.121445|0.097347|0.078501|0.074443|0.090284|0.071615|0.083904|0.077250|0.103199|0.087854|0.118092|0.104110|0.138809|0.230373|0.139011|0.178810|0.106565|0.109797|0.097655|0.103686|0.111079|0.143254|0.072440|0.083096|0.065105|0.078579|0.064217|0.075003|0.087254|0.080552|0.109898|0.086827|0.137399|0.500000| 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