Version2.0 2019-11-14T01:56:49Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 14-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1ccc(o1)C[NH+](Cc2ccco2)Cc3ccc(o3)C(c4cccc(c4)F)(c5cccc(c5)F)O C36202462 RHF 6-31G(d) (6D,7F) Cc1ccc(o1)C[NH+](Cc2ccco2)Cc3ccc(o3)C(c4cccc(c4)F)(c5cccc(c5)F)O C01[X(C29H26F2N1O4)] 180 C1 592 Cc1ccc(o1)C[NH+](Cc1ccc(o1)C(c1cccc(c1)F)(c1cccc(c1)F)O)Cc1ccco1 Cc1ccc(o1)C[NH](Cc1ccc(o1)C(c1cccc(c1)F)(c1cccc(c1)F)O)Cc1ccco1 Cc1oc(C[NH](Cc2occc2)Cc3oc(cc3)C(O)(c4cccc(F)c4)c5cccc(F)c5)cc1 InChIKey=ZPOMUOWBVJITIZ-UHFFFAOYSA-N InChI=1S/C29H26F2NO4/c1-20-10-11-26(35-20)18-32(17-25-9-4-14-34-25)19-27-12-13-28(36-27)29(33,21-5-2-7-23(30)15-21)22-6-3-8-24(31)16-22/h2-16,32-33H,17-19H2,1H3 InChI=1/C29H26F2NO4/c1-20-10-11-26(35-20)18-32(17-25-9-4-14-34-25)19-27-12-13-28(36-27)29(33,21-5-2-7-23(30)15-21)22-6-3-8-24(31)16-22/h2-16,32-33H,17-19H2,1H3 Cc1ccc(o1)C[NH+](Cc2ccco2)Cc3ccc(o3)C(c4cccc(c4)F)(c5cccc(c5)F)O C01[X(C29H26F2N1O4)] 180 C01 592 Cc1ccc(o1)C[NH+](Cc1ccc(o1)C(c1cccc(c1)F)(c1cccc(c1)F)O)Cc1ccco1 Cc1ccc(o1)C[NH](Cc1ccc(o1)C(c1cccc(c1)F)(c1cccc(c1)F)O)Cc1ccco1 Cc1oc(C[NH](Cc2occc2)Cc3oc(cc3)C(O)(c4cccc(F)c4)c5cccc(F)c5)cc1 InChIKey=ZPOMUOWBVJITIZ-UHFFFAOYSA-N InChI=1S/C29H26F2NO4/c1-20-10-11-26(35-20)18-32(17-25-9-4-14-34-25)19-27-12-13-28(36-27)29(33,21-5-2-7-23(30)15-21)22-6-3-8-24(31)16-22/h2-16,32-33H,17-19H2,1H3 InChI=1/C29H26F2NO4/c1-20-10-11-26(35-20)18-32(17-25-9-4-14-34-25)19-27-12-13-28(36-27)29(33,21-5-2-7-23(30)15-21)22-6-3-8-24(31)16-22/h2-16,32-33H,17-19H2,1H3 3829.6315468662 -1665.8100306 1-A 19704.8072 128 464 592 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -26.38491 -26.38152 -20.75640 -20.75231 -20.74537 -20.66661 -15.83534 -11.43738 -11.43693 -11.43312 -11.41932 -11.41802 -11.41568 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-0.45041 -0.44357 -0.43117 -0.42886 -0.42202 -0.41717 -0.41188 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.00737 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12.00000 12.00000 12.00000 12.00000 18.99840 15.99491 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 12110.2116 26960.8367 34033.1068 0.99994 0.01081 0.00180 -0.01083 0.99983 0.01520 -0.00163 -0.01521 0.99988 1 0.00715 0.00321 0.00254 0.14903 0.06694 0.05303 13.63 24.10 35.65 38.21 41.58 47.76 51.80 77.11 82.68 95.34 102.00 108.60 156.26 165.11 182.46 213.43 252.89 293.34 307.32 317.56 341.53 358.74 373.09 391.92 393.62 402.13 424.39 435.44 469.26 508.31 510.57 523.45 530.24 576.26 596.32 622.49 668.86 688.81 696.73 709.40 728.53 743.28 811.92 820.87 841.47 941.91 952.34 960.10 963.50 996.25 1002.65 1012.33 1017.68 1033.92 1055.98 1096.88 1123.33 1128.47 1158.85 1180.71 1183.22 1268.48 1269.85 1274.15 1302.45 1310.80 1322.28 1332.49 1360.07 1382.37 1389.42 1398.33 1420.07 1451.53 1455.42 1459.99 1463.08 1468.44 1471.63 1481.99 1491.21 1500.32 1508.44 1531.52 1543.34 1552.22 1567.67 1572.01 1576.48 1579.39 1590.94 1595.56 1597.75 1601.44 1605.13 1633.15 1639.71 1646.56 1689.59 1691.06 1712.66 1736.20 1754.14 1756.36 1764.95 1818.80 1840.18 1846.52 1896.44 1905.86 1911.65 1920.00 1928.28 1934.14 1939.35 1950.27 1955.16 1966.39 2005.14 2012.74 2022.70 2033.55 2074.47 2081.76 2085.10 2119.45 2185.10 2195.38 2209.55 2214.23 2230.78 2246.78 2258.36 2275.90 2278.35 2304.69 2315.77 2325.48 2343.27 2345.12 2352.86 2353.43 2391.37 2400.73 2428.67 2494.70 2513.70 2581.31 2584.62 2608.39 2609.17 2614.97 2621.96 2631.07 4629.79 4715.23 4717.03 4722.87 4730.55 4771.07 4850.73 4853.69 4855.34 4857.36 4863.34 4883.78 4898.70 4900.00 4900.47 4907.95 4941.21 4943.94 4948.55 4952.21 4973.69 4977.32 5004.99 5023.84 5317.60 5903.96 0.532835 0.562456 0.563400 0.466372 -1665.277195 -1665.247575 -1665.246631 -1665.343659 3.254335D-04 MUNgauss RevisionA1.9 retrievium 14-Nov-2019 DUDE Cc1ccc(o1)C[NH+](Cc2ccco2)Cc3ccc(o3)C(c4cccc(c4)F)(c5cccc(c5)F)O C36202462 RHF 6-31G(d) (6D,10F) C1 490.182961 |X|Y|Z| 72.440862 113.746974 38.969689 68.477853 32 6 7 8 28 1 3 |36.858105| |12.792166|36.858105| |7.322042|14.179036|36.858105| |5.141247|8.558791|13.265563|36.858105| |5.326949|8.720236|8.585853|14.208311|36.858105| |7.874594|14.107337|8.638255|8.619192|14.047976|73.516695| |3.930509|5.324204|5.165140|7.390959|12.848934|13.903491|36.858105| |3.473334|4.389162|4.198349|5.423918|7.617740|10.619227|12.537560|53.358707| |3.490499|4.471169|4.464011|5.847320|7.437718|10.150882|9.288692|25.703316|0.500000| |3.689194|4.359363|3.838778|4.423757|6.081624|10.665177|7.581404|17.114850|0.257917|36.858105| |3.203319|3.603772|3.264080|3.611643|4.440369|7.894680|4.993363|10.367483|0.205945|12.828724|36.858105| |3.245672|3.536878|3.212366|3.396433|3.945255|7.259013|4.042700|7.402933|0.162890|7.378239|14.192703|36.858105| |2.620559|2.795260|2.606290|2.749966|3.085800|5.561234|3.227155|5.715367|0.123852|5.157540|8.574566|13.256821|36.858105| |2.397777|2.586301|2.426771|2.622317|2.984781|5.256196|3.285051|5.981041|0.123972|5.342032|8.778151|8.608624|14.222040|36.858105| |2.619314|2.893036|2.688456|2.982007|3.536682|6.137417|4.110110|8.108770|0.157497|7.836581|14.097374|8.622047|8.617620|14.161982|73.516695| |2.731057|3.281739|3.227869|4.037299|4.994005|7.314658|7.564442|17.097677|0.257974|7.584395|6.081333|4.435943|3.841531|4.360760|10.619501|36.858105| |2.471320|2.984153|3.089631|3.945402|4.446677|6.297713|6.081082|10.390678|0.206893|5.002399|4.443396|3.627231|3.268662|3.599203|7.852933|12.839961|36.858105| |2.235272|2.650515|2.786864|3.444532|3.661834|5.364987|4.468684|7.469765|0.165617|4.064032|3.960311|3.429028|3.226119|3.526289|7.205986|7.375646|14.204757|36.858105| |2.071574|2.450587|2.641116|3.259299|3.305274|4.828709|3.873261|5.759608|0.125525|3.243544|3.096339|2.772937|2.615994|2.788643|5.532105|5.159343|8.578214|13.263124|36.858105| |2.162480|2.589239|2.804727|3.550057|3.617496|5.156138|4.374931|5.994442|0.124574|3.290494|2.985097|2.631578|2.428080|2.579268|5.228785|5.333232|8.740901|8.579738|14.189161|36.858105| |2.411705|2.931483|3.104232|4.039843|4.400013|6.094141|5.944397|8.088894|0.157189|4.108692|3.532869|2.985966|2.687799|2.889487|6.114203|7.838617|14.075695|8.629253|8.634387|14.139599|73.516695| |2.016905|2.389974|2.620537|3.245239|3.195172|4.640693|3.671537|4.704554|0.096557|2.720866|2.459859|2.213413|2.048756|2.147567|4.278147|3.900446|5.276803|5.116951|7.309389|12.554337|13.749255|36.858105| |1.837227|2.132215|2.279842|2.738741|2.772695|4.158537|3.223289|4.129558|0.081984|2.479429|2.239544|2.002865|1.874473|1.989156|3.965039|3.501232|4.394376|4.126590|5.237032|7.469959|10.805128|12.412166|36.858105| |1.780214|2.044758|2.137071|2.540588|2.656059|4.048268|3.177610|4.201991|0.081573|2.558860|2.319274|2.044008|1.932158|2.089832|4.200654|3.746341|4.591682|4.218858|4.976581|6.549241|10.722934|7.407144|13.747209|36.858105| |1.618783|1.827104|1.888859|2.191079|2.293891|3.589208|2.689617|3.551271|0.068580|2.247674|2.053339|1.823485|1.739527|1.882846|3.746032|3.089921|3.533325|3.286027|3.688204|4.430948|7.598394|4.960365|7.912256|13.694438|36.858105| |1.526421|1.711387|1.779440|2.038240|2.097947|3.310929|2.390217|3.099133|0.060421|1.986619|1.819183|1.638717|1.561656|1.668879|3.282292|2.593113|2.919710|2.755056|3.116867|3.691356|6.216059|4.402538|6.815934|7.908917|13.811381|36.858105| |1.563730|1.764203|1.862238|2.140598|2.158385|3.375944|2.415410|3.077632|0.060745|1.952811|1.783538|1.620278|1.533512|1.619397|3.172782|2.515334|2.878353|2.739757|3.193522|3.857970|6.262921|5.050210|7.976690|6.944910|8.042427|13.781484|36.858105| |1.704454|1.953237|2.093932|2.455564|2.443731|3.739149|2.739034|3.457783|0.068933|2.138939|1.942905|1.763625|1.655617|1.739853|3.422904|2.818786|3.348998|3.194592|3.896459|4.979626|7.637064|7.611582|13.656863|7.941064|6.882606|7.891145|13.872424|36.858105| |1.460401|1.631374|1.723549|1.947802|1.943789|3.081119|2.126309|2.699639|0.053569|1.740900|1.598777|1.467954|1.392098|1.459100|2.832535|2.157616|2.419058|2.323760|2.666409|3.113655|5.110333|3.949346|5.302742|4.683402|5.327693|8.173799|14.382243|8.203122|97.533100| |2.243277|2.711190|3.063128|3.888489|3.663813|5.193320|4.034575|4.788940|0.098575|2.761801|2.438469|2.212665|2.005464|2.061856|4.113995|3.671354|4.602158|4.234728|5.288997|7.698920|11.548802|12.389372|7.470808|5.161728|3.937716|3.720345|4.383130|6.266499|8.280598|36.858105| |2.405278|2.922210|3.252670|4.144787|4.020261|5.683962|4.492216|4.955076|0.098002|2.882776|2.465323|2.210887|1.979795|2.037563|4.118983|3.710241|4.307750|3.708916|4.207302|5.840664|10.715570|7.464727|6.375789|4.896443|3.925454|3.742631|4.311330|5.685058|8.246377|13.686859|36.858105| |2.616554|3.199092|3.648271|4.556557|4.199466|6.025227|4.296709|4.569260|0.091043|2.746801|2.339507|2.131978|1.891000|1.914680|3.838362|3.222347|3.532106|3.093826|3.372463|4.260387|7.941781|4.979701|4.399348|3.629461|3.109317|3.053383|3.479666|4.251810|7.093242|7.909647|13.752108|36.858105| |2.631280|3.215256|3.852944|4.673616|3.955693|5.760695|3.764852|4.153658|0.085728|2.536216|2.210920|2.062287|1.832281|1.827790|3.603325|2.866022|3.160612|2.888702|3.175158|3.810124|6.758898|4.397346|3.712938|3.064494|2.652190|2.630042|3.012998|3.659041|6.321393|6.816094|7.909939|13.746097|36.858105| |2.427506|2.947664|3.557566|4.335016|3.631614|5.269223|3.501900|4.071638|0.086451|2.460720|2.197261|2.068052|1.855957|1.849097|3.609151|2.860480|3.287902|3.129919|3.586480|4.236997|7.001016|5.022830|3.921224|3.142333|2.667060|2.632337|3.049810|3.821748|6.357668|7.991963|6.954233|8.044473|13.831769|36.858105| |2.253430|2.722881|3.184464|3.967510|3.503484|5.025174|3.590582|4.324165|0.092122|2.550953|2.296590|2.137460|1.937939|1.956671|3.832876|3.174281|3.870229|3.762304|4.634616|5.745682|8.630091|7.538800|5.095206|3.840104|3.116380|3.023896|3.547943|4.733517|7.122850|13.730295|7.936984|6.871201|7.875138|13.805816|36.858105| |2.336346|2.783197|3.400916|3.901234|3.202725|4.811230|2.989238|3.585094|0.077304|2.226712|2.030575|1.950923|1.762138|1.735161|3.332173|2.492334|2.817924|2.763166|3.120516|3.466825|5.704002|3.925772|3.172249|2.627442|2.282297|2.268054|2.596703|3.140136|5.544936|5.310165|4.684744|5.321886|8.179279|14.354888|8.190410|97.533100| |1.840096|2.149146|2.372160|2.850707|2.738965|4.075508|3.013930|3.977637|0.083775|2.375666|2.214194|2.039255|1.916934|1.992693|3.873993|3.227004|4.236961|4.532212|6.756667|8.144843|9.428485|13.560973|7.954086|5.509707|4.146764|3.877095|4.531731|6.469078|8.442210|8.024163|5.202349|4.000494|3.858105|4.699693|7.094376|8.893761|73.516695| |17.566212|8.946619|5.803562|4.486496|4.829200|12.446200|3.760268|4.438993|0.088375|3.493661|2.985431|2.951675|2.425659|2.261979|4.424415|2.620057|2.354046|2.110305|1.964912|2.071962|4.129587|1.950558|1.803950|1.757495|1.612189|1.524917|1.556582|1.683124|3.280133|2.168227|2.364321|2.585992|2.554915|2.316773|2.150290|4.969761|3.144912|0.500000| |17.558321|8.931163|5.791747|4.473664|4.815212|12.419953|3.740660|4.763976|0.098228|3.911642|3.503521|3.664825|2.910945|2.606682|5.008217|2.743960|2.445913|2.228249|2.034741|2.093062|4.151698|1.927267|1.759721|1.721601|1.567860|1.470425|1.495756|1.624144|3.136236|2.102881|2.225485|2.366305|2.364732|2.222817|2.102742|4.823080|3.141463|0.301525|0.500000| |17.614418|8.993713|6.851050|4.625570|4.427956|10.201244|3.353441|4.082933|0.085157|3.108304|2.786748|2.869543|2.378178|2.170235|4.140619|2.427681|2.250966|2.071178|1.946908|2.023529|3.935950|1.910591|1.737300|1.670631|1.524172|1.448589|1.493009|1.627055|3.159888|2.133788|2.265862|2.488979|2.563811|2.379943|2.181112|5.262973|3.138180|0.300732|0.300848|0.500000| |6.328357|8.825264|17.808459|8.467885|5.851794|10.458402|4.052368|4.691116|0.102488|3.186377|2.818028|2.831298|2.359653|2.188782|4.223088|2.776466|2.720360|2.518526|2.433560|2.561792|4.893719|2.441890|2.127579|1.978559|1.761402|1.677114|1.767486|1.983338|3.718842|2.860281|2.986951|3.393549|3.746823|3.510703|3.065075|7.899980|4.014153|0.141516|0.141195|0.190152|0.500000| |4.033921|5.836653|8.456412|17.787698|8.826923|10.437260|6.398655|6.719814|0.151105|3.871100|3.271426|3.077232|2.569333|2.479093|4.965070|3.953963|4.145693|3.694484|3.641812|4.029861|7.858936|3.744143|3.036113|2.735978|2.323340|2.169482|2.315429|2.714543|4.724175|4.700712|4.828640|5.317612|5.769223|5.589899|5.019102|11.029470|5.853703|0.100441|0.100040|0.105199|0.193739|0.500000| |3.824113|4.877454|4.458667|5.681943|8.907153|12.817738|17.609239|12.371078|0.182403|7.282182|4.677336|3.737263|3.037319|3.143076|7.048109|6.689506|5.122291|3.830636|3.368712|3.822728|9.103925|3.321601|3.065230|3.098576|2.690946|2.392746|2.382516|2.641691|4.734866|3.600493|4.158278|4.019538|3.428274|3.110456|3.160365|6.006581|4.853321|0.106338|0.101214|0.089591|0.099602|0.137242|0.500000| |3.377141|4.462199|4.671909|6.928226|9.061652|10.254732|17.687209|12.322494|0.214868|5.593126|4.149069|3.459259|2.885227|2.971281|6.447098|7.420839|7.112798|5.007947|4.547497|5.532314|14.343296|4.594932|3.901759|3.749488|3.065942|2.705975|2.769812|3.227165|5.397611|5.200292|5.913453|5.310923|4.442431|4.144393|4.387516|7.609549|6.377027|0.090149|0.088285|0.082948|0.106169|0.192029|0.300774|0.500000| |4.622851|5.510693|4.502751|4.959331|7.129999|14.587559|7.456529|12.360240|0.215064|17.694718|9.042268|6.897052|4.660068|4.474184|10.274380|5.597476|4.159011|3.483530|2.905745|2.980669|6.446478|2.542377|2.311659|2.344005|2.077176|1.866508|1.853469|2.029104|3.757255|2.654533|2.804608|2.759217|2.580753|2.469981|2.496943|5.074490|3.977434|0.119911|0.139008|0.103670|0.100995|0.114103|0.201004|0.147249|0.500000| |3.338719|3.811611|3.351727|3.810430|5.121785|9.139468|6.695120|12.371515|0.182211|17.613942|8.917805|5.672891|4.456195|4.901703|12.902298|7.270244|4.676398|3.740169|3.041443|3.142132|7.043635|2.636344|2.473564|2.606802|2.322351|2.040585|1.978709|2.138366|3.961632|2.650123|2.816375|2.666338|2.414782|2.315224|2.404981|4.684482|4.058013|0.091154|0.097168|0.078592|0.078569|0.094308|0.208146|0.143697|0.301135|0.500000| |3.735529|4.015177|3.586087|3.647455|4.154588|7.961428|3.966434|6.754519|0.152388|6.385217|8.817866|17.786242|8.457966|5.858596|10.440170|3.888436|3.295424|3.122153|2.603723|2.496970|4.982722|2.136662|1.921772|1.934041|1.728605|1.569734|1.565860|1.708728|3.212742|2.177308|2.182288|2.142232|2.100257|2.099772|2.135564|4.502285|3.517256|0.091559|0.121094|0.091519|0.087832|0.089945|0.100853|0.093720|0.190656|0.136771|0.500000| |2.438460|2.552792|2.401111|2.486461|2.717162|4.927466|2.776227|4.693306|0.102455|4.046584|5.845227|8.454616|17.814130|8.826175|10.443716|3.190480|2.824349|2.847124|2.371429|2.192083|4.224995|1.877548|1.720972|1.764261|1.599469|1.447755|1.425977|1.534748|2.932007|1.840771|1.808011|1.737677|1.700411|1.730192|1.798493|3.737831|3.165613|0.062566|0.075437|0.062497|0.061448|0.065015|0.072747|0.070044|0.105872|0.099519|0.193509|0.500000| |2.117000|2.266503|2.148137|2.318151|2.600210|4.549263|2.875514|5.046756|0.103471|4.273409|6.034677|5.819721|8.616933|17.838240|16.498465|3.884105|3.317613|3.320283|2.662539|2.445189|4.794486|2.049742|1.922358|2.040013|1.855480|1.641911|1.581714|1.686050|3.209327|1.941704|1.910462|1.785071|1.701690|1.727052|1.837683|3.651992|3.407951|0.055998|0.063287|0.053767|0.054401|0.061674|0.077304|0.073917|0.101168|0.114373|0.123172|0.195137|0.500000| |2.550301|2.972742|2.887103|3.455129|4.152915|6.465377|5.587775|12.351290|0.214908|7.451849|7.129606|4.975424|4.508245|5.510975|14.476252|17.690899|9.038557|6.861443|4.647011|4.461058|10.279848|3.352825|3.065459|3.324181|2.820327|2.377170|2.283458|2.515447|4.451021|3.105770|3.086184|2.730100|2.482055|2.501176|2.758813|5.016811|5.142819|0.067816|0.072611|0.063295|0.070062|0.093378|0.143716|0.146805|0.147229|0.200511|0.114622|0.101188|0.136185|0.500000| |2.646637|3.133950|3.035474|3.732553|4.670134|7.033744|7.253840|12.365797|0.182272|6.697644|5.123419|3.815979|3.353541|3.817464|9.132447|17.615824|8.911787|5.647671|4.443083|4.889540|12.935537|3.795347|3.596658|3.979569|3.340016|2.769078|2.638023|2.906199|5.063365|3.592912|3.799383|3.283699|2.833239|2.756924|3.029323|5.355143|5.470913|0.072136|0.073239|0.065134|0.072717|0.100725|0.207439|0.199866|0.143793|0.207783|0.094506|0.078637|0.096883|0.301033|0.500000| |2.161976|2.521118|2.619834|3.138401|3.333345|5.052144|3.920591|6.825974|0.155545|3.992574|4.180055|3.699390|3.612972|3.997777|7.884978|6.377162|8.820787|17.780820|8.460449|5.845660|10.443050|4.022182|3.387675|3.497480|2.854989|2.431464|2.401903|2.733984|4.668127|3.452263|3.082228|2.663698|2.533120|2.735397|3.190066|5.589786|6.686472|0.056414|0.060723|0.055795|0.066257|0.091570|0.094917|0.115396|0.094543|0.100917|0.091750|0.088650|0.105561|0.189096|0.135963|0.500000| |1.904806|2.221952|2.406393|2.891093|2.866153|4.284271|3.223364|4.736296|0.104074|2.793919|2.730343|2.512771|2.413933|2.546917|4.903569|4.048579|5.849881|8.462297|17.839050|8.833892|10.463116|6.365263|4.723187|4.391459|3.397279|2.953867|3.063207|3.708634|5.854232|4.684302|3.672511|3.028905|2.936245|3.393859|4.382868|6.860070|12.673287|0.050123|0.052055|0.050275|0.062716|0.089895|0.079103|0.102272|0.070676|0.072890|0.066086|0.061873|0.068363|0.105553|0.099190|0.193650|0.500000| |1.851724|2.134159|2.212122|2.649010|2.823537|4.285262|3.477318|4.772392|0.091835|2.865399|2.603331|2.258671|2.140597|2.349841|4.784517|4.519512|5.733695|5.151271|5.827491|7.497286|13.116628|6.794336|8.886703|17.763831|8.953672|5.654545|4.993245|5.637152|8.339519|4.783812|4.525286|3.423222|2.920294|3.001048|3.644564|5.698963|9.067552|0.050584|0.050121|0.047938|0.056368|0.078506|0.093699|0.113513|0.071392|0.081349|0.058615|0.053801|0.063807|0.111131|0.133627|0.115785|0.135425|0.500000| |1.566575|1.752996|1.790663|2.058090|2.181488|3.459010|2.569384|3.456813|0.066224|2.229455|2.051472|1.814177|1.745430|1.908808|3.797914|3.045786|3.374445|3.135657|3.377194|3.883485|6.907557|4.048412|5.640457|8.914073|17.728128|8.959090|5.692488|4.957856|9.630012|3.315440|3.343312|2.736580|2.358662|2.357565|2.702505|4.607686|6.181600|0.043464|0.042417|0.040856|0.046292|0.059797|0.072342|0.079615|0.056852|0.064795|0.047445|0.044544|0.052707|0.078759|0.092709|0.077186|0.086462|0.216850|0.500000| |1.425661|1.581582|1.633560|1.845849|1.902656|3.045886|2.146030|2.794223|0.054431|1.824386|1.680652|1.521296|1.457366|1.556915|3.042802|2.314973|2.544842|2.413073|2.670608|3.066681|5.252229|3.528131|4.924930|5.614193|8.854460|17.746567|8.944288|5.642473|16.714420|3.094973|3.151944|2.674707|2.335939|2.320031|2.601910|4.575831|5.698477|0.039725|0.038227|0.037663|0.042933|0.054078|0.060220|0.066303|0.047810|0.052316|0.040516|0.037684|0.042747|0.059725|0.068820|0.060228|0.070992|0.123968|0.213307|0.500000| |1.707843|1.959095|2.128672|2.484013|2.415595|3.695520|2.636050|3.293691|0.066490|2.043460|1.860857|1.707650|1.597931|1.661184|3.245207|2.611946|3.084882|2.980769|3.647185|4.549316|6.912024|7.062593|8.822873|5.631297|4.959770|5.645793|9.000670|17.745860|16.834022|6.708463|5.812080|4.539642|4.065870|4.363332|5.423465|8.034952|11.863925|0.046705|0.044963|0.045635|0.056616|0.077319|0.069933|0.085982|0.054459|0.056190|0.046361|0.041349|0.044545|0.064892|0.073730|0.071546|0.098474|0.123476|0.107654|0.124757|0.500000| |2.318684|2.776232|2.983217|3.729290|3.829089|5.528003|4.525991|5.029656|0.096175|2.949930|2.498444|2.205277|1.984117|2.070465|4.229958|3.916148|4.442795|3.696728|4.082418|5.712988|11.300677|6.917700|7.056401|5.794778|4.635812|4.306875|4.779876|6.045103|8.800515|8.889972|17.741351|8.942217|5.643500|4.996254|5.643561|8.339156|8.367443|0.064096|0.060076|0.060074|0.075338|0.114529|0.122109|0.164010|0.078618|0.082100|0.059787|0.050076|0.054198|0.089825|0.116595|0.085202|0.097585|0.146355|0.108638|0.099269|0.156062|0.500000| |2.687467|3.239353|3.581611|4.302185|4.119116|6.125548|4.194032|4.380416|0.085403|2.708688|2.281708|2.073423|1.834776|1.858922|3.737137|3.058605|3.211107|2.781778|2.942680|3.623512|6.994285|4.066819|3.835653|3.328435|2.952500|2.918285|3.248189|3.765145|6.729321|5.635871|8.928668|17.722756|8.936379|5.694601|4.951634|9.622338|5.916321|0.075393|0.066911|0.070635|0.091993|0.130327|0.114539|0.137660|0.076430|0.074220|0.057972|0.046818|0.048151|0.072443|0.088678|0.067530|0.073568|0.087606|0.073374|0.072305|0.108764|0.216162|0.500000| |2.711310|3.263485|3.943573|4.476579|3.726703|5.645322|3.404514|3.776998|0.077963|2.374587|2.080190|1.963051|1.742562|1.723748|3.373084|2.562902|2.748451|2.529966|2.720584|3.154933|5.664242|3.524295|3.085604|2.629057|2.332784|2.331473|2.636180|3.086558|5.655523|4.924921|5.616010|8.831054|17.743295|8.954382|5.632235|16.709559|5.673099|0.073475|0.066743|0.074625|0.110220|0.146504|0.087608|0.106529|0.068207|0.062849|0.056093|0.045187|0.044552|0.062558|0.070551|0.062858|0.070693|0.070030|0.058462|0.058533|0.094499|0.123755|0.212875|0.500000| |2.093695|2.493743|2.897986|3.513679|3.118497|4.564612|3.184083|4.007517|0.086857|2.395359|2.209252|2.080517|1.910646|1.925485|3.721095|2.976769|3.677943|3.781283|4.836572|5.524471|7.824478|6.958987|4.693424|3.605450|2.947204|2.859122|3.331535|4.373878|6.748734|8.854802|5.631304|4.956872|5.642132|8.973743|17.783454|16.807847|14.443639|0.055158|0.054873|0.056655|0.078505|0.120858|0.077944|0.104785|0.064774|0.062438|0.057647|0.049609|0.050506|0.073461|0.077714|0.090470|0.135230|0.095959|0.071533|0.068802|0.139007|0.123681|0.107601|0.124641|0.500000| 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