Version2.0 2020-02-03T16:09:38Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 02-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1c(n2ccccc2n1)C(=O)C3=C(C(=O)N([C@H]3c4cc(c(c(c4)OC)OC)OC)CC[NH+](C)C)[O-] C33586506 RHF 6-31G(d) (6D,7F) Cc1c(n2ccccc2n1)C(=O)C3=C(C(=O)N([C@H]3c4cc(c(c(c4)OC)OC)OC)CC[NH+](C)C)[O-] C01[X(C26H30N4O6)] 192 C1 600 COc1cc(cc(c1OC)OC)[C@@H]1N(CC[NH+](C)C)C(=O)C(=C1C(=O)c1c(C)nc2n1cccc2)[O-] COc1cc(cc(c1OC)OC)[C@@H]1N(CC[NH+](C)C)C(=O)C(=C1C(=O)c1c(C)nc2n1cccc2)[O-] COc1cc(cc(OC)c1OC)[C@@H]2N(CC[NH+](C)C)C(=O)C(=C2C(=O)c3n4ccccc4nc3C)[O-] InChIKey=UUZQFDPUXBEISX-QFIPXVFZSA-N InChI=1S/C26H30N4O6/c1-15-21(29-10-8-7-9-19(29)27-15)23(31)20-22(30(12-11-28(2)3)26(33)24(20)32)16-13-17(34-4)25(36-6)18(14-16)35-5/h7-10,13-14,22,32H,11-12H2,1-6H3/t22-/m0/s1 InChI=1/C26H30N4O6/c1-15-21(29-10-8-7-9-19(29)27-15)23(31)20-22(30(12-11-28(2)3)26(33)24(20)32)16-13-17(34-4)25(36-6)18(14-16)35-5/h7-10,13-14,22,32H,11-12H2,1-6H3/t22-/m0/s1/f/h32h,28H Cc1c(n2ccccc2n1)C(=O)C3=C(C(=O)N([C@H]3c4cc(c(c(c4)OC)OC)OC)CC[NH+](C)C)[O-] C01[X(C26H30N4O6)] 192 C01 600 COc1cc(cc(c1OC)OC)[C@@H]1N(CC[NH+](C)C)C(=O)C(=C1C(=O)c1c(C)nc2n1cccc2)[O-] COc1cc(cc(c1OC)OC)[C@H]1[C@@H](C(=O)[C@H]2[C@@H](C)N[C@H]3N2C=CC=C3)C(=O)[C@H](N1CC[NH](C)C)O COc1cc(cc(OC)c1OC)[C@H]2[C@H](C(=O)[C@@H](O)N2CC[NH](C)C)C(=O)[C@H]3[C@@H](C)N[C@@H]4C=CC=CN34 InChIKey=WKPJENUVXNINAE-YIKHYSHPSA-N InChI=1S/C26H37N4O6/c1-15-21(29-10-8-7-9-19(29)27-15)23(31)20-22(30(12-11-28(2)3)26(33)24(20)32)16-13-17(34-4)25(36-6)18(14-16)35-5/h7-10,13-15,19-22,26-28,33H,11-12H2,1-6H3/t15-,19+,20+,21-,22+,26-/m1/s1 InChI=1/C26H37N4O6/c1-15-21(29-10-8-7-9-19(29)27-15)23(31)20-22(30(12-11-28(2)3)26(33)24(20)32)16-13-17(34-4)25(36-6)18(14-16)35-5/h7-10,13-15,19-22,26-28,33H,11-12H2,1-6H3/t15-,19+,20+,21-,22+,26-/m1/s1 4066.6082159690 -1668.9121569 1-A 18414.7756 131 469 600 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.58820 -20.58784 -20.56277 -20.55032 -20.47888 -20.47260 -15.73132 -15.60805 -15.60784 -15.49284 -11.34901 -11.34328 -11.34118 -11.33997 -11.31888 -11.29922 -11.29844 -11.28294 -11.28175 -11.28101 -11.27851 -11.27260 -11.27061 -11.26660 -11.26470 -11.25347 -11.24239 -11.22257 -11.22230 -11.22084 -11.21710 -11.20972 -11.20892 -11.20631 -11.17000 -11.16519 -1.42660 -1.41675 -1.41622 -1.38323 -1.38013 -1.33924 -1.31908 -1.31538 -1.28651 -1.17692 -1.14945 -1.11214 -1.08867 -1.06591 -1.04882 -1.02488 -1.02146 -1.00814 -0.98551 -0.97405 -0.95867 -0.95417 -0.94982 -0.92980 -0.91594 -0.89414 -0.85198 -0.82659 -0.81191 -0.80986 -0.80568 -0.79455 -0.76268 -0.75765 -0.74522 -0.73347 -0.72071 -0.71715 -0.71117 -0.69374 -0.68715 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0.20220 0.20510 0.21528 0.22677 0.23399 0.23600 0.24145 0.24907 0.25755 0.26353 0.26820 0.26980 0.27274 0.28492 0.28918 0.29102 0.30120 0.30691 0.31054 0.31498 0.31935 0.32173 0.32321 0.32373 0.32625 0.33160 0.33381 0.33724 0.34451 0.34662 0.34695 0.35226 0.35570 0.35765 0.36386 0.36817 0.37525 0.38531 0.38857 0.40300 0.41172 0.42070 0.43624 0.43800 0.44554 0.45463 0.46871 0.48216 0.48614 0.49222 0.50336 0.51259 0.51390 0.52859 0.53708 0.53910 0.55735 0.56403 0.58692 0.59276 0.59939 0.61385 0.61643 0.62687 0.63146 0.63634 0.64404 0.65420 0.66238 0.68621 0.68692 0.69380 0.70682 0.71298 0.71539 0.72603 0.73110 0.73778 0.74628 0.75030 0.75661 0.75762 0.76078 0.76412 0.76486 0.76761 0.77438 0.78587 0.78772 0.79842 0.80235 0.80562 0.81093 0.81312 0.81686 0.81994 0.82697 0.83580 0.83813 0.84044 0.84885 0.85206 0.85421 0.85514 0.86634 0.87223 0.87647 0.88447 0.89199 0.89484 0.90048 0.90926 0.91203 0.91812 0.92579 0.93380 0.93935 0.94039 0.95667 0.96089 0.96753 0.97012 0.97723 0.98538 0.98917 1.00712 1.00777 1.01178 1.01584 1.02499 1.03473 1.03628 1.05285 1.05792 1.07108 1.07427 1.07603 1.07931 1.08458 1.08767 1.09218 1.09801 1.10592 1.10687 1.11022 1.11651 1.12286 1.12686 1.13008 1.13196 1.13324 1.13728 1.13863 1.14320 1.14657 1.14900 1.15533 1.15817 1.16109 1.16153 1.16919 1.17529 1.17641 1.18265 1.18419 1.18600 1.19123 1.20273 1.20303 1.20829 1.21374 1.21621 1.22209 1.22768 1.23159 1.23346 1.23482 1.24544 1.25926 1.26212 1.26927 1.27303 1.27854 1.28305 1.29198 1.30643 1.31055 1.31543 1.32611 1.33384 1.33929 1.34593 1.35597 1.35800 1.36797 1.37201 1.37818 1.38603 1.40192 1.40586 1.41772 1.42600 1.43098 1.44247 1.44680 1.45510 1.46131 1.46995 1.48625 1.50430 1.51040 1.51828 1.52491 1.53600 1.54361 1.55668 1.56435 1.57661 1.58460 1.58789 1.59501 1.59815 1.61111 1.61681 1.62835 1.63229 1.63593 1.64331 1.64491 1.65718 1.66040 1.67331 1.68392 1.69655 1.70286 1.70586 1.71022 1.72008 1.73754 1.74353 1.75030 1.76048 1.76584 1.77404 1.78903 1.79588 1.80278 1.80888 1.81261 1.81892 1.82656 1.83925 1.85126 1.86391 1.88166 1.89498 1.91186 1.92687 1.95449 1.96632 1.98038 1.98115 2.00520 2.00898 2.02162 2.03634 2.04253 2.05422 2.06824 2.07326 2.08129 2.08421 2.09157 2.10201 2.10389 2.11022 2.12029 2.12210 2.13848 2.14945 2.16147 2.17032 2.17489 2.18344 2.18401 2.19581 2.20100 2.20826 2.20927 2.21827 2.22127 2.22395 2.23343 2.24664 2.25208 2.26019 2.27230 2.28018 2.28316 2.28856 2.29345 2.29654 2.31533 2.31791 2.32407 2.33014 2.33678 2.34163 2.35345 2.35500 2.36682 2.36743 2.38639 2.39046 2.39813 2.40489 2.40768 2.41710 2.42299 2.43198 2.43726 2.44049 2.44936 2.45708 2.47156 2.47310 2.47539 2.48339 2.49042 2.49394 2.50741 2.51422 2.51947 2.52941 2.53793 2.54595 2.55377 2.55827 2.56070 2.58155 2.58606 2.59577 2.59746 2.60367 2.62748 2.63252 2.64085 2.64676 2.65435 2.66226 2.66428 2.66819 2.68361 2.69700 2.69782 2.70480 2.70790 2.72170 2.73370 2.73854 2.74530 2.76057 2.79058 2.79358 2.80060 2.81199 2.82311 2.83458 2.84643 2.84951 2.86505 2.88169 2.88449 2.88961 2.90524 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4842.46 4849.71 4884.06 4888.01 4900.89 4908.61 5008.04 0.580886 0.613803 0.614747 0.513303 -1668.331270 -1668.298354 -1668.297410 -1668.398854 3.402448D-04 MUNgauss RevisionA2.0 retrievium 03-Feb-2020 DUDE Cc1c(n2ccccc2n1)C(=O)C3=C(C(=O)N([C@H]3c4cc(c(c(c4)OC)OC)OC)CC[NH+](C)C)[O-] C33586506 RHF 6-31G(d) (6D,10F) C1 494.216535 |X|Y|Z| 74.997309 104.286338 43.752296 69.945211 21 6 7 18 3 |36.858105| |12.735844|36.858105| |7.341336|13.891523|36.858105| |5.201374|8.704143|13.651454|53.358707| |3.817903|5.381905|7.564436|18.965785|36.858105| |3.192439|4.257723|5.155945|11.053616|14.150126|36.858105| |3.218298|4.264382|4.636072|9.472507|7.924355|13.326077|36.858105| |3.902900|5.401058|5.352334|10.793848|6.844788|7.902736|14.119631|36.858105| |5.383256|8.965082|8.617466|18.975177|7.959754|6.898231|7.970891|13.379096|36.858105| |7.751663|14.065363|8.468032|11.707097|5.435989|4.698218|5.234120|7.717876|14.577591|53.358707| |5.660990|7.242956|12.874950|10.387106|6.218674|4.327324|3.684069|3.909657|5.266813|6.989330|36.858105| |4.310759|5.321445|8.201537|9.121705|6.526287|4.515859|3.652138|3.674920|4.627999|5.792563|15.570306|73.516695| |5.438484|5.773091|7.480685|6.917353|4.361247|3.344464|2.960262|3.149830|4.029038|5.685803|13.284449|14.701031|36.858105| |5.733503|5.478256|6.022627|5.892300|3.664635|2.954151|2.718835|2.950444|3.719874|5.498559|7.369964|9.314610|13.597737|36.858105| |4.168979|3.851903|4.133452|4.429829|2.914379|2.436342|2.247066|2.387358|2.867952|4.168729|5.079123|7.417939|8.186313|12.388001|36.858105| |3.625605|3.281011|3.379605|3.772960|2.505410|2.152894|2.019048|2.146688|2.522789|3.688906|3.875560|5.863220|5.420476|7.686389|15.582277|73.516695| |3.659579|3.501494|3.920116|4.277998|2.901838|2.414152|2.185488|2.279572|2.709030|3.839030|5.185225|8.140045|8.204802|8.146621|14.256651|14.994097|53.358707| |3.951677|4.026882|4.892670|5.202449|3.558614|2.847890|2.504805|2.587759|3.129483|4.323674|7.585065|12.307038|12.608443|7.925632|8.137236|9.648833|17.599716|36.858105| |3.832242|3.829981|4.536615|4.895209|3.352965|2.715997|2.405405|2.487593|2.988442|4.151487|6.724359|11.932111|8.804198|6.015253|6.183870|8.073270|12.402972|17.547412|0.500000| |3.136779|3.342448|4.131192|4.805848|3.537210|2.870068|2.456183|2.451532|2.862443|3.793400|5.992245|11.388964|7.339276|5.444508|5.628362|7.659171|10.618667|12.452247|0.248448|36.858105| |2.680616|2.835696|3.412743|4.141160|3.129734|2.617658|2.243683|2.209773|2.517003|3.313188|4.623600|9.509311|5.064959|3.983056|4.186858|6.115526|7.640150|7.558318|0.206278|13.780035|36.858105| |2.287664|2.441306|2.896638|3.673859|2.866939|2.473631|2.112787|2.042460|2.265437|2.939884|3.679270|7.524388|3.858877|3.227357|3.367711|5.166267|5.685593|5.002991|0.133726|7.911591|13.664056|36.858105| |2.205370|2.379773|2.823298|3.651108|2.893791|2.525350|2.146799|2.055571|2.256517|2.900602|3.487892|6.902745|3.652421|3.167901|3.267253|5.101206|5.240341|4.412955|0.111043|6.831231|7.900979|13.732370|36.858105| |2.443803|2.661494|3.198643|4.090035|3.211864|2.752805|2.333130|2.248567|2.499251|3.211826|3.987299|7.548372|4.297962|3.784014|3.843228|5.917334|5.982780|5.002245|0.116719|7.921908|6.874972|7.933586|13.650162|36.858105| |2.937968|3.194179|3.933781|4.762285|3.592825|2.954521|2.512129|2.476514|2.847779|3.714395|5.272187|9.541574|6.182766|5.190642|5.210556|7.469383|8.378035|7.520390|0.155803|13.706542|7.942587|6.862519|7.890584|13.741171|36.858105| |2.237017|2.442386|2.872940|3.780062|2.994917|2.650840|2.269076|2.168398|2.361004|3.017388|3.375094|6.209263|3.567431|3.320489|3.330634|5.346393|4.868551|3.853405|0.091729|5.201837|4.628564|5.295316|8.201983|14.144360|7.899741|73.516695| |2.368722|2.616333|3.063629|4.072327|3.203878|2.848342|2.454957|2.353012|2.559208|3.257802|3.471378|6.124458|3.648971|3.533990|3.408346|5.527103|4.696418|3.660790|0.085950|4.521703|3.808814|4.003075|5.286130|8.024135|6.725440|24.161967|36.858105| |1.921967|2.071363|2.410087|3.197063|2.563888|2.312262|1.981880|1.877323|2.016348|2.579871|2.848801|5.589263|2.916960|2.607186|2.673747|4.302899|4.135813|3.357790|0.086807|4.596487|5.215513|7.998411|14.037604|7.983073|5.217003|12.709514|4.731028|73.516695| |1.751176|1.853569|2.108637|2.775985|2.181129|1.990500|1.743989|1.668904|1.786045|2.316070|2.451001|4.677275|2.567868|2.367879|2.497489|4.126530|3.833887|2.960400|0.077011|3.844286|4.286164|5.958212|8.152518|5.938867|4.282584|10.359868|4.109927|24.153258|36.858105| |2.019454|2.137561|2.481034|3.200910|2.505575|2.218469|1.916828|1.845352|2.014372|2.617192|3.030784|6.186162|3.107395|2.662711|2.779442|4.380991|4.570988|3.858717|0.108577|5.201370|7.880855|14.145185|8.213236|5.288807|4.622723|7.297025|3.226211|12.694849|5.846504|73.516695| |2.010462|2.112069|2.429042|3.125154|2.423531|2.151475|1.874016|1.813459|1.980665|2.587594|2.947905|6.094449|2.972319|2.524649|2.616518|4.121435|4.303792|3.668916|0.109534|4.523282|6.711354|8.021205|5.293353|4.001586|3.805483|5.737409|2.688098|8.407291|4.120292|24.175274|36.858105| |2.937216|2.791375|3.047625|3.484298|2.418905|2.070031|1.888158|1.950753|2.256725|3.180014|3.809835|6.377421|5.123015|5.103278|7.785625|11.995578|17.999694|7.416372|0.188683|6.128408|5.286354|4.116919|3.704361|3.972912|4.978958|5.828197|3.053261|5.314988|2.882527|6.119913|3.260714|36.858105| |2.498467|2.423205|2.642474|3.124496|2.214414|1.928144|1.758936|1.796993|2.039452|2.836096|3.195069|5.427170|4.069840|4.196127|5.989348|10.574900|10.413774|5.310547|0.130323|5.307744|4.713388|4.074722|3.902780|4.233311|4.953027|6.405692|3.298987|5.703004|3.232102|6.084377|3.091041|12.453853|36.858105| |2.463696|2.353336|2.501147|2.968083|2.079606|1.830416|1.695074|1.746369|1.974941|2.777026|2.903797|4.794397|3.675646|4.119114|5.983972|12.764847|8.312264|4.283551|0.104361|4.100117|3.556960|3.185437|3.192026|3.577065|4.121451|5.792054|3.153355|4.855626|2.774677|4.867893|2.496779|7.575447|12.659824|53.358707| |2.798015|2.633841|2.775986|3.232379|2.226100|1.943032|1.806750|1.880816|2.153310|3.063929|3.215296|5.153489|4.219239|5.052437|8.146119|20.686659|9.819274|4.728140|0.112220|4.240609|3.524861|3.076560|3.077088|3.530169|4.251013|5.706681|3.206437|4.640313|2.585378|4.654701|2.412324|7.728249|9.321111|24.992182|0.500000| |2.233238|2.182744|2.331466|2.834580|2.017065|1.796299|1.661547|1.695647|1.891458|2.624867|2.656938|4.428333|3.238221|3.600032|4.680571|9.552991|6.277702|3.618353|0.087526|3.705902|3.237778|3.056027|3.231374|3.706969|4.039215|6.361332|3.512815|5.046589|2.951083|4.681688|2.343980|5.070510|7.679940|17.503348|0.257090|36.858105| |2.233838|2.095727|2.178037|2.607007|1.820707|1.623506|1.522279|1.574578|1.765613|2.503205|2.466140|4.100386|3.018846|3.354734|4.575347|9.949024|6.265322|3.429331|0.088168|3.221048|2.933648|2.663276|2.621524|2.826016|3.151329|4.649298|2.537962|4.111021|2.378432|4.233332|2.228583|5.851638|7.670832|17.503252|0.260917|7.768153|36.858105| |6.371429|5.902520|5.814449|5.887686|3.561968|2.942996|2.794407|3.108489|3.933004|6.038986|5.897513|7.691981|7.864202|15.735737|8.009510|11.778738|7.504652|5.286014|0.121874|4.133252|3.212365|2.726407|2.734512|3.248354|4.172583|5.316575|3.298825|4.126497|2.128934|4.095799|2.188572|3.985901|3.488899|4.920684|0.122521|3.289231|3.047139|73.516695| |17.612199|8.879634|6.832093|6.379795|3.605524|2.975332|2.905079|3.375003|4.485328|7.767282|6.213579|8.319475|6.462164|6.624661|4.871658|7.269047|5.891075|4.685572|0.129236|3.503389|2.977153|2.477730|2.345849|2.583873|3.161849|4.121621|2.411597|3.589443|1.840969|3.869647|2.181902|3.402278|2.786558|3.682089|0.085869|2.391216|2.448286|11.685240|0.500000| |17.573584|9.030527|5.700153|6.168522|3.434094|2.978145|3.088480|3.793558|4.994856|9.948139|4.510124|6.568160|4.242570|4.350751|3.432275|5.472724|4.221397|3.320984|0.092036|2.715573|2.391333|2.068607|1.986372|2.164190|2.539702|3.546625|2.096731|3.118052|1.606518|3.301633|1.868611|2.588758|2.223122|2.984387|0.068177|1.996135|2.026365|8.393127|0.299945|0.500000| |17.612325|8.945305|5.978851|6.154317|3.447276|2.945550|2.992437|3.596986|4.740798|8.907879|4.859315|6.663600|5.027185|5.954893|4.339853|6.962801|4.919969|3.709596|0.097042|2.987395|2.530310|2.184499|2.137583|2.397161|2.874655|3.959295|2.393930|3.326939|1.720681|3.421633|1.894065|2.910735|2.521760|3.479426|0.081780|2.331438|2.320439|13.467160|0.302334|0.300249|0.500000| |3.560118|4.742475|6.901656|12.523386|17.841211|8.905030|5.596721|4.950159|5.732161|6.053309|6.940771|14.818838|4.779973|3.822689|3.090735|4.652736|4.312815|4.032622|0.104749|4.194977|3.707209|3.391738|3.420594|3.799318|4.256713|6.127419|3.600216|5.285087|2.465356|5.168311|2.782650|2.631393|2.408552|3.020778|0.065540|2.151439|1.921306|6.329843|0.097207|0.088013|0.089696|0.500000| |2.731269|3.470739|4.144421|7.815558|9.100172|17.750837|8.732764|5.636814|4.967821|5.058353|3.745578|7.196726|2.997099|2.651623|2.248340|3.557710|3.071771|2.648570|0.070405|2.750607|2.562959|2.483416|2.561166|2.750722|2.859603|4.766160|2.849399|4.247642|2.042679|4.003330|2.173609|1.966075|1.853539|2.384225|0.051133|1.733178|1.555677|4.644914|0.072041|0.071206|0.070776|0.213665|0.500000| |2.755675|3.471424|3.675292|6.801762|5.658011|8.781724|17.718434|9.038777|5.643513|5.690995|3.056751|5.443493|2.540946|2.365241|2.000146|3.235969|2.654727|2.202858|0.059044|2.181775|2.021209|1.930191|1.969251|2.118622|2.240154|3.707412|2.248841|3.281928|1.636508|3.151675|1.734855|1.710822|1.608703|2.117848|0.045785|1.534441|1.407268|4.326807|0.069707|0.074567|0.072175|0.123301|0.211392|0.500000| |3.661717|4.731394|4.372276|7.718014|4.941592|5.592987|8.933753|17.758031|8.870570|9.408602|3.310300|5.504318|2.777222|2.667737|2.195397|3.564314|2.833918|2.314812|0.062161|2.181268|1.980739|1.838112|1.848024|2.009882|2.199615|3.468095|2.113787|3.023727|1.529492|2.978405|1.652072|1.802460|1.666490|2.223836|0.048849|1.587539|1.488083|5.067822|0.087016|0.102392|0.095493|0.107573|0.123108|0.213674|0.500000| |2.682889|2.790701|3.299283|3.973199|2.956533|2.488870|2.160027|2.144411|2.445694|3.254707|4.412481|9.145936|4.756425|3.737260|3.940229|5.800303|7.222060|7.053003|0.230690|8.960137|17.755774|8.880572|5.630582|4.956552|5.656326|6.527697|3.148829|7.489482|3.622440|12.589907|7.453013|5.206422|4.351747|4.500977|0.091334|2.932805|2.828467|5.388378|0.083990|0.067271|0.069426|0.095518|0.067363|0.054164|0.053702|0.500000| |3.206378|3.506192|4.307256|5.133686|3.768992|3.080303|2.647930|2.644461|3.078204|4.043098|5.593876|9.233017|6.849372|6.254148|5.915169|8.414366|8.437096|7.018240|0.141531|8.947038|5.662877|4.951420|5.620522|8.890977|17.766387|12.580206|7.454291|7.486434|3.614109|6.522305|3.148125|4.713730|4.691295|5.754759|0.126643|4.219896|3.197408|9.024758|0.094511|0.075622|0.088978|0.120541|0.081366|0.065143|0.065185|0.124682|0.500000| |2.471423|2.677747|3.079329|3.978299|3.015036|2.663447|2.347218|2.299760|2.533558|3.295705|3.480578|5.914512|3.837265|3.911296|3.861676|6.377793|5.147984|3.819780|0.087957|4.517779|3.677099|3.706966|4.638102|6.865659|6.667142|16.396004|17.548083|7.208392|3.706758|5.326133|2.536856|3.318159|3.666477|4.948722|0.103940|4.183919|2.850036|6.542760|0.070103|0.060287|0.070523|0.092106|0.072558|0.059568|0.057868|0.085421|0.229063|0.500000| |2.589604|2.947728|3.548154|4.817151|3.882579|3.394260|2.852058|2.703572|2.953672|3.679105|3.988723|7.041137|4.014258|3.788549|3.454179|5.468172|4.715092|3.838618|0.089897|4.658000|3.844714|3.919507|4.939531|7.221816|6.774681|16.438626|17.585564|7.692982|3.620828|5.607440|2.684259|2.969431|3.071918|3.974851|0.084241|3.128967|2.380592|6.324468|0.072493|0.063256|0.072153|0.122999|0.093993|0.071607|0.066363|0.088972|0.218021|0.299495|0.500000| |2.124564|2.336955|2.680244|3.638914|2.883742|2.650803|2.314742|2.199677|2.339701|2.971023|2.941980|5.217733|3.037936|2.979872|2.887790|4.800763|3.946117|3.032102|0.073203|3.623886|3.199160|3.431108|4.448285|5.895975|4.905609|16.992829|17.643917|7.699766|3.908814|5.139726|2.431524|2.632052|2.861524|3.790360|0.077890|3.148918|2.302186|5.067988|0.059547|0.052915|0.059848|0.088200|0.074766|0.059851|0.055410|0.075423|0.145804|0.300250|0.299535|0.500000| |1.727417|1.808400|2.044179|2.662767|2.068273|1.880955|1.659179|1.599621|1.719591|2.248555|2.389885|4.564892|2.528715|2.326846|2.497646|4.135998|3.905441|2.984519|0.079099|3.829856|4.472722|6.252043|7.205912|5.161391|4.020844|8.371399|3.509208|16.453885|17.559296|11.951825|4.655792|3.032129|3.410208|3.879547|0.072787|2.962778|2.474210|3.691647|0.050857|0.044158|0.047011|0.064664|0.053263|0.043214|0.040859|0.107635|0.093734|0.090989|0.087751|0.091444|0.500000| |1.773397|1.868378|2.113927|2.766419|2.152279|1.961750|1.730353|1.665868|1.787577|2.330301|2.445512|4.565242|2.608935|2.458212|2.624272|4.390845|3.973007|2.983378|0.076059|3.829391|4.026240|5.176652|7.200232|6.225357|4.467063|11.869660|4.632246|16.453471|17.553250|8.397388|3.518119|2.989265|3.480180|4.144748|0.078024|3.363982|2.569494|3.948818|0.051679|0.044993|0.048863|0.067014|0.055524|0.045058|0.042510|0.093989|0.107246|0.118328|0.107816|0.123258|0.298384|0.500000| |1.612675|1.710354|1.931329|2.576849|2.037688|1.889926|1.663337|1.582015|1.673314|2.161959|2.202775|4.203710|2.271505|2.107938|2.195915|3.659651|3.311796|2.556672|0.067220|3.201949|3.529383|4.668566|5.906392|4.658921|3.528313|8.594472|3.639756|16.911254|17.624113|8.608377|3.644993|2.477734|2.739435|3.286696|0.062945|2.575867|2.113251|3.417734|0.046758|0.041387|0.044034|0.063428|0.054373|0.043727|0.040431|0.085648|0.085526|0.090592|0.090393|0.100184|0.299820|0.299888|0.500000| |2.147110|2.284687|2.662413|3.444100|2.695574|2.372916|2.044472|1.969932|2.158064|2.796472|3.256737|6.997023|3.172197|2.626716|2.648122|4.114915|4.324521|3.847180|0.117173|4.659827|6.760562|7.222054|4.948049|3.919852|3.842118|5.611682|2.685066|7.695231|3.629318|16.444983|17.579676|3.154115|2.904688|3.245201|0.065145|2.230211|2.123966|4.041315|0.064722|0.055488|0.055515|0.087028|0.066607|0.052295|0.049508|0.217302|0.089003|0.069982|0.076256|0.067170|0.108282|0.087928|0.090535|0.500000| |2.041971|2.106503|2.392512|3.022258|2.293440|2.028585|1.789770|1.754491|1.930871|2.559025|2.912831|5.883745|3.017568|2.583184|2.741646|4.330271|4.600028|3.829117|0.117762|4.518486|6.651717|6.857704|4.642999|3.705962|3.672920|5.327117|2.536649|7.205835|3.715167|16.408571|17.549778|3.619736|3.362303|3.618836|0.070914|2.438661|2.398612|3.951874|0.062276|0.052765|0.053477|0.072169|0.056248|0.045953|0.044639|0.229280|0.085369|0.067917|0.069960|0.063561|0.118835|0.091236|0.090710|0.299008|0.500000| |1.812249|1.900974|2.158324|2.817359|2.194860|1.985935|1.743167|1.679072|1.810017|2.361054|2.548148|5.195469|2.548062|2.210097|2.283129|3.658106|3.661466|3.037597|0.089713|3.624725|4.898008|5.896126|4.452947|3.429283|3.196851|5.140874|2.431386|7.695615|3.919003|16.999201|17.642951|2.789550|2.697230|3.038090|0.059684|2.122725|2.024620|3.465287|0.054135|0.047208|0.047609|0.069115|0.056219|0.045259|0.042747|0.145790|0.075404|0.063562|0.067146|0.062275|0.123929|0.091680|0.100342|0.299610|0.300387|0.500000| |2.767926|2.671966|2.955095|3.421489|2.409793|2.063983|1.868460|1.913999|2.201068|3.067736|3.743623|6.561801|4.765899|4.376644|5.782614|8.790147|12.642528|7.311167|0.211118|6.502279|6.327673|4.710661|3.962289|4.013323|4.870194|5.737458|2.918742|5.633412|3.035008|7.088450|3.868288|17.629345|9.005127|7.600437|0.150695|4.183002|4.682110|6.165952|0.088996|0.068686|0.074576|0.073629|0.054834|0.047114|0.048990|0.185757|0.120864|0.085483|0.079291|0.070279|0.090710|0.085207|0.072110|0.102625|0.124182|0.089834|0.500000| |2.917775|2.685232|2.839402|3.246125|2.225541|1.924576|1.781983|1.858501|2.145606|3.071484|3.418306|5.650936|4.475233|4.671636|7.030576|12.147006|12.497132|5.770369|0.157189|4.641259|4.160806|3.371110|3.061889|3.246074|3.924852|4.939347|2.642058|4.549532|2.494008|5.222452|2.858222|17.555927|8.796943|9.566977|0.206037|4.595079|6.410619|6.762016|0.094625|0.072299|0.080911|0.066111|0.050597|0.045025|0.048165|0.118178|0.106549|0.079725|0.071816|0.064504|0.072882|0.071655|0.060717|0.077263|0.088507|0.069346|0.303416|0.500000| |2.472696|2.462470|2.745355|3.281847|2.364243|2.050894|1.847319|1.867680|2.113240|2.893913|3.365207|5.802299|4.233304|4.231301|5.638843|9.393059|9.778607|5.577605|0.131018|6.338802|5.472467|4.867097|4.862473|5.463136|6.347343|8.005886|3.970116|6.849075|3.864166|6.920057|3.353036|8.892712|17.662986|12.328114|0.206645|7.667095|5.685763|6.231413|0.075664|0.060837|0.069067|0.072430|0.055100|0.046871|0.047768|0.130630|0.159855|0.122981|0.100182|0.093424|0.111697|0.118146|0.088324|0.087030|0.098785|0.080527|0.210628|0.173958|0.500000| |2.222495|2.155086|2.331860|2.801857|2.002658|1.765440|1.616418|1.644059|1.844813|2.558069|2.772660|4.808620|3.381984|3.417605|4.540008|8.151199|7.603791|4.316119|0.112322|4.426225|4.278124|3.861419|3.637367|3.734667|4.102010|5.749778|2.914425|5.494523|3.215255|6.046726|3.103967|8.770650|17.594982|12.342926|0.183415|6.461506|7.520640|5.197865|0.068452|0.055817|0.061979|0.060349|0.047481|0.041361|0.042560|0.113242|0.105850|0.087935|0.075175|0.071874|0.097155|0.095301|0.076147|0.079227|0.095572|0.076264|0.221515|0.205614|0.300891|0.500000| |2.009819|1.977039|2.117281|2.608490|1.878457|1.686696|1.557435|1.577428|1.742603|2.401104|2.409310|4.100234|2.860954|3.067335|3.837760|7.490629|5.395586|3.247082|0.080518|3.433902|3.135718|3.054119|3.238133|3.577924|3.706730|6.189134|3.299266|5.177033|3.138189|4.775962|2.373434|4.538128|6.997590|12.321140|0.179293|17.619593|6.938661|4.984772|0.059652|0.050441|0.057686|0.055850|0.045589|0.040183|0.041081|0.079174|0.103364|0.105556|0.080767|0.083795|0.088786|0.100680|0.076030|0.061776|0.068712|0.060244|0.109836|0.114564|0.198821|0.188128|0.500000| |2.169852|2.102700|2.207422|2.696841|1.906401|1.712744|1.602283|1.643980|1.825528|2.550550|2.454076|4.051442|2.950988|3.364304|4.244888|9.105116|5.383757|3.163332|0.077458|3.155729|2.770411|2.621467|2.769307|3.161916|3.429152|5.565909|3.181919|4.412721|2.569837|4.081699|2.072946|4.195106|5.591843|12.355789|0.220623|17.642190|7.230380|5.680854|0.063861|0.054136|0.063785|0.055775|0.045791|0.041255|0.043063|0.070742|0.101861|0.105436|0.079698|0.081005|0.071132|0.080639|0.063631|0.055259|0.059673|0.052664|0.097383|0.111211|0.150063|0.137153|0.298861|0.500000| |2.352448|2.342943|2.544613|3.100257|2.220745|1.964873|1.800615|1.828370|2.044785|2.810781|2.925797|4.864039|3.578691|3.965595|4.998793|9.618336|6.659638|3.958277|0.092731|4.203283|3.540462|3.360870|3.681977|4.463578|4.901892|7.788063|4.373012|5.653311|3.248543|5.007286|2.460095|4.962918|7.052193|12.377409|0.224553|17.651505|5.647008|6.398061|0.069532|0.057844|0.068162|0.066282|0.052689|0.046002|0.047208|0.086483|0.146764|0.152317|0.105310|0.105940|0.088332|0.104686|0.077867|0.065438|0.070006|0.061474|0.115311|0.119267|0.229380|0.156475|0.299051|0.300017|0.500000| |2.003055|1.902015|1.987046|2.411644|1.704058|1.530637|1.432483|1.470688|1.633642|2.296189|2.245609|3.800994|2.682907|2.891996|3.754712|7.668122|5.331866|3.074057|0.080209|2.996000|2.817631|2.624529|2.587664|2.728141|2.943891|4.521110|2.426053|4.125598|2.440165|4.247114|2.228108|5.015664|6.864291|12.324681|0.180623|7.070979|17.621298|4.688076|0.060563|0.050922|0.057313|0.050105|0.041042|0.036973|0.038639|0.075556|0.081288|0.074695|0.062626|0.061825|0.071381|0.073420|0.060369|0.058214|0.066789|0.056739|0.119808|0.146478|0.148761|0.218959|0.208176|0.178575|0.143141|0.500000| 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