Version2.0 2020-01-21T01:16:48Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 09-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)(C)n1c(nnn1)[C@H](c2cc3ccc(cc3[nH]c2=O)OC)[NH+]4CCN(CC4)c5ccccc5F C06015077 RHF 6-31G(d) (6D,7F) CC(C)(C)n1c(nnn1)[C@H](c2cc3ccc(cc3[nH]c2=O)OC)[NH+]4CCN(CC4)c5ccccc5F C01[X(C26H31F1N7O2)] 195 C1 602 COc1ccc2c(c1)[nH]c(=O)c(c2)[C@@H](c1nnnn1C(C)(C)C)[NH+]1CCN(CC1)c1ccccc1F COc1ccc2c(c1)[nH]c(=O)c(c2)[C@@H](c1nnnn1C(C)(C)C)[NH+]1CCN(CC1)c1ccccc1F COc1ccc2C=C([C@H]([NH+]3CCN(CC3)c4ccccc4F)c5nnnn5C(C)(C)C)C(=O)Nc2c1 InChIKey=DHORARCZIWJSPG-QHCPKHFHSA-O InChI=1S/C26H30FN7O2/c1-26(2,3)34-24(29-30-31-34)23(19-15-17-9-10-18(36-4)16-21(17)28-25(19)35)33-13-11-32(12-14-33)22-8-6-5-7-20(22)27/h5-10,15-16,23H,11-14H2,1-4H3,(H,28,35)/p+1/t23-/m0/s1 InChI=1/C26H30FN7O2/c1-26(2,3)34-24(29-30-31-34)23(19-15-17-9-10-18(36-4)16-21(17)28-25(19)35)33-13-11-32(12-14-33)22-8-6-5-7-20(22)27/h5-10,15-16,23H,11-14H2,1-4H3,(H,28,35)/p+1/t23-/m0/s1/fC26H31FN7O2/h28,33H/q+1 CC(C)(C)n1c(nnn1)[C@H](c2cc3ccc(cc3[nH]c2=O)OC)[NH+]4CCN(CC4)c5ccccc5F C01[X(C26H31F1N7O2)] 195 C01 602 COc1ccc2c(c1)[nH]c(=O)c(c2)[C@@H](c1nnnn1C(C)(C)C)[NH+]1CCN(CC1)c1ccccc1F COc1ccc2c(c1)[nH]c(=O)c(c2)[C@@H]([C@@H]1NNNN1C(C)(C)C)[NH]1CCN(CC1)c1ccccc1F COc1ccc2C=C([C@@H]([C@@H]3NNNN3C(C)(C)C)[NH]4CCN(CC4)c5ccccc5F)C(=O)Nc2c1 InChIKey=NKCNAWUWGFFNLR-BJKOFHAPSA-N InChI=1S/C26H35FN7O2/c1-26(2,3)34-24(29-30-31-34)23(19-15-17-9-10-18(36-4)16-21(17)28-25(19)35)33-13-11-32(12-14-33)22-8-6-5-7-20(22)27/h5-10,15-16,23-24,29-31,33H,11-14H2,1-4H3,(H,28,35)/t23-,24+/m0/s1 InChI=1/C26H35FN7O2/c1-26(2,3)34-24(29-30-31-34)23(19-15-17-9-10-18(36-4)16-21(17)28-25(19)35)33-13-11-32(12-14-33)22-8-6-5-7-20(22)27/h5-10,15-16,23-24,29-31,33H,11-14H2,1-4H3,(H,28,35)/t23-,24+/m0/s1/f/h28H 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3240.9588 3277.6130 3281.3745 3287.1730 3296.2406 3296.5530 3299.4109 3302.0751 3302.1330 3303.6936 3314.2915 3331.5982 3335.5910 3358.1844 3366.9649 3371.4258 3373.0334 3378.1864 3384.6371 3389.1423 3396.6388 3400.0808 3408.8857 3426.8737 3491.4269 3831.2023 4.2118 5.2017 5.4842 4.5935 3.8882 5.9266 4.3635 4.1272 4.1259 5.0871 3.9223 5.7218 5.2084 6.6734 4.3170 5.7685 4.9542 3.3485 2.3547 3.7670 1.2299 2.5652 1.8264 2.2910 1.8373 5.1503 2.8024 2.0081 2.9656 2.9025 1.5097 2.7186 3.0263 3.2122 3.3833 2.7331 3.4697 4.6957 4.9780 2.9848 2.5278 6.1966 4.5942 2.9671 3.0854 4.6914 3.6851 3.2872 5.3083 6.9322 4.6213 3.2884 3.5240 5.0478 6.0683 3.2077 2.0775 1.9594 5.2199 5.1973 3.9318 3.4707 11.2078 4.1651 4.9541 7.7945 1.2751 3.6431 4.5222 4.7196 1.6231 2.3997 3.8246 2.3447 3.0434 1.6277 1.4257 1.6779 1.6647 3.6489 2.0636 3.5151 1.2284 2.6030 1.4537 1.3763 1.4443 2.4528 1.3226 2.0118 3.7734 1.9390 1.7184 1.4572 3.6750 3.3133 2.7891 2.9277 1.6881 3.3957 1.9399 2.8026 2.2152 2.3565 3.1934 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12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 14.00307 14.00307 14.00307 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 15.99491 15.99491 12.00000 14.00307 1.00783 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 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 1.00783 1.00783 1.00783 12733.0791 30761.7731 38990.6296 0.99999 0.00486 0.00110 -0.00485 0.99987 -0.01538 -0.00118 0.01538 0.99988 1 0.00680 0.00282 0.00222 0.14174 0.05867 0.04629 23.91 31.20 34.50 44.31 55.65 74.70 88.09 102.39 120.39 128.49 145.34 175.65 206.46 209.71 221.27 232.42 261.76 303.40 325.72 352.01 364.23 381.20 393.96 397.93 413.27 422.54 426.45 442.80 448.72 493.93 501.85 503.39 543.77 557.22 563.00 593.22 602.80 633.18 651.70 680.11 704.27 715.87 729.03 735.73 739.97 759.30 782.53 799.04 855.20 878.22 881.70 897.23 903.94 925.39 987.51 1016.74 1028.11 1052.57 1118.73 1146.17 1151.44 1158.40 1165.85 1183.71 1215.62 1236.37 1247.62 1270.94 1280.77 1284.80 1312.76 1318.98 1325.36 1338.98 1363.36 1377.20 1419.66 1462.56 1465.89 1471.05 1494.13 1518.01 1533.06 1534.72 1551.12 1565.88 1589.93 1618.90 1620.09 1639.30 1645.04 1654.09 1659.04 1661.29 1675.46 1687.44 1703.70 1739.99 1754.27 1768.87 1794.96 1801.38 1817.81 1853.72 1856.53 1857.62 1868.10 1884.79 1895.77 1902.95 1913.47 1913.76 1958.47 1973.96 1981.93 1988.52 2009.34 2017.25 2022.04 2031.32 2035.52 2037.74 2052.14 2071.10 2114.67 2126.89 2134.82 2170.82 2206.56 2210.80 2232.52 2243.00 2247.38 2252.92 2281.92 2286.80 2290.41 2295.54 2326.74 2336.76 2339.79 2340.60 2345.17 2345.72 2348.08 2358.16 2366.30 2372.25 2375.48 2376.70 2377.67 2379.91 2380.32 2392.88 2401.05 2412.98 2439.84 2473.54 2527.87 2571.85 2600.64 2612.91 2622.63 2731.14 4599.77 4609.92 4631.70 4645.31 4646.52 4663.02 4715.75 4721.17 4729.51 4742.56 4743.00 4747.12 4750.95 4751.03 4753.28 4768.53 4793.43 4799.17 4831.68 4844.31 4850.73 4853.04 4860.46 4869.74 4876.22 4887.01 4891.96 4904.63 4930.51 5023.38 5512.25 0.600452 0.630273 0.631217 0.537441 -1632.087503 -1632.057682 -1632.056738 -1632.150514 3.145262D-04 MUNgauss RevisionA2.0 retrievium 21-Jan-2020 DUDE CC(C)(C)n1c(nnn1)[C@H](c2cc3ccc(cc3[nH]c2=O)OC)[NH+]4CCN(CC4)c5ccccc5F C06015077 RHF 6-31G(d) (6D,10F) C1 492.252327 |X|Y|Z| 76.763190 123.947472 37.462056 70.902373 28 6 7 21 7 |36.858105| |12.444819|36.858105| |7.531279|12.436735|36.858105| |7.641104|12.425951|7.614819|36.858105| |7.682655|12.694933|7.719334|7.743484|53.358707| |5.937700|7.254471|5.876709|5.025244|19.323184|36.858105| |4.393333|5.253577|4.437413|4.249157|12.116384|14.740675|53.358707| |4.278551|5.437867|4.390355|4.884374|12.372690|9.078194|19.512704|53.358707| |5.387473|7.799842|5.570210|7.182272|19.486676|8.930449|12.227051|20.732416|53.358707| |5.448553|5.623719|5.221575|3.955259|9.992360|12.584670|10.616792|7.306477|7.151797|36.858105| |6.402285|6.230139|6.191460|4.157256|9.351645|8.877138|7.822284|6.121546|6.457150|17.670021|0.500000| |4.717614|4.365879|3.867695|3.340347|7.277198|7.617335|8.425837|6.143787|5.826977|12.488999|0.247005|36.858105| |5.057664|4.187474|3.633116|3.268403|6.326162|5.644320|6.298671|5.114360|5.112071|7.586122|0.200258|14.154535|36.858105| |3.914533|3.297336|2.883676|2.752739|4.899441|4.156795|5.084871|4.321011|4.246147|4.954447|0.129999|7.814351|13.300792|36.858105| |3.627797|2.968204|2.612007|2.558560|4.189200|3.347496|4.112457|3.661670|3.688636|3.807621|0.105365|5.112207|7.633504|13.610465|36.858105| |2.920466|2.478205|2.207601|2.207487|3.507112|2.773344|3.532640|3.206407|3.192472|3.056127|0.083440|3.924412|5.085911|7.882533|13.907049|36.858105| |2.588904|2.281423|2.044019|2.047463|3.317042|2.670533|3.514675|3.174097|3.082819|2.914933|0.077229|3.777437|4.514827|6.831552|7.953988|13.542360|36.858105| |2.678508|2.413524|2.160125|2.137285|3.625645|3.019586|4.051906|3.564943|3.376746|3.329428|0.085169|4.531840|5.132922|7.859330|6.857274|7.855900|13.732985|36.858105| |3.201257|2.864746|2.539248|2.455084|4.402567|3.814525|5.006470|4.226574|3.985086|4.388486|0.109195|6.752743|7.838178|13.597008|7.924204|6.851833|7.962315|13.776035|36.858105| |3.123027|2.933683|2.630278|2.491347|4.717630|4.327543|5.953241|4.778018|4.314456|5.030612|0.116825|7.948246|7.002466|8.002893|5.215392|4.580947|5.200314|7.920972|13.816058|53.358707| |2.710533|2.599623|2.360731|2.257678|4.164349|3.743750|5.370949|4.415723|3.926182|4.176338|0.098289|5.795663|5.122885|5.794717|4.273763|4.015523|4.788647|7.322725|9.243261|25.949384|0.500000| |3.535510|3.425613|3.096318|2.801778|5.765498|5.813092|7.891320|5.765690|5.101213|7.381717|0.153734|12.959714|7.845365|6.717093|4.498485|3.765677|3.943508|5.171442|7.810640|19.109498|0.265777|36.858105| |3.122838|3.176600|2.962140|2.641037|5.420857|5.496967|8.188868|5.860558|4.972872|6.554219|0.136252|8.047732|5.373990|4.710493|3.501138|3.060715|3.239769|4.111033|5.408028|11.610866|0.221180|15.695783|73.516695| |2.209263|1.980346|1.792572|1.811799|2.861351|2.273250|3.037686|2.791576|2.706402|2.435675|0.064770|3.015785|3.437256|4.631748|5.242778|7.894087|14.359905|8.294791|5.338214|5.514998|0.110216|3.193774|4.888031|73.516695| |2.058491|1.834435|1.669281|1.699277|2.597278|2.022902|2.681356|2.502313|2.460228|2.150374|0.058208|2.577498|2.951433|3.781662|4.524747|6.701712|7.988801|5.264132|3.989941|4.318736|0.085617|2.642204|4.114042|24.008225|36.858105| |3.926966|4.245894|4.376314|3.239724|7.165674|7.743203|8.901789|6.297406|5.832695|12.593592|0.253257|7.621192|5.176112|3.900615|3.106988|2.613981|2.565095|2.949493|3.725059|6.082662|0.109771|6.505794|12.702552|3.910179|1.945863|53.358707| |3.492070|3.764706|3.720573|2.996552|6.557878|7.154354|9.745790|6.579374|5.707653|9.431767|0.183314|7.423855|4.901176|3.888916|3.052069|2.616189|2.634725|3.107624|3.928015|6.841030|0.126551|7.744511|18.311712|4.032022|1.981692|25.403828|0.500000| |3.663996|4.282974|4.843856|3.341649|7.006843|6.589557|7.938689|6.223333|5.911654|7.488205|0.187897|4.925094|3.821494|3.035852|2.549039|2.194313|2.145995|2.405494|2.900757|4.552507|0.085288|4.387570|8.645297|3.345660|1.695243|17.269385|0.254941|36.858105| |2.837371|3.205027|3.579484|2.668757|5.028847|4.445307|5.916697|4.910762|4.561202|4.930582|0.126308|3.837804|3.097320|2.597225|2.218355|1.958815|1.945975|2.180927|2.558883|4.035547|0.078295|3.726502|7.696919|3.084913|1.566998|10.470914|0.197602|12.523081|36.858105| |2.633554|2.839938|3.174865|2.370144|4.271496|3.716502|4.797460|4.022445|3.816029|4.433789|0.118949|3.671888|3.049402|2.587395|2.228064|1.972250|1.954887|2.178599|2.540751|3.951774|0.076708|3.565698|7.178965|3.103288|1.580208|9.050103|0.165925|7.834488|13.135640|53.358707| |2.703987|2.810102|3.014243|2.321075|4.277063|3.857288|4.956735|4.024371|3.775796|4.969373|0.129500|4.398085|3.569654|3.027908|2.546750|2.240767|2.237716|2.536381|3.009663|4.782129|0.092275|4.400518|8.953418|3.513369|1.765835|10.457549|0.199139|6.650986|7.953486|17.875347|36.858105| |3.384378|3.441277|3.643843|2.713765|5.282936|4.999921|5.946186|4.633876|4.419457|7.636195|0.199424|6.370138|4.873073|3.822633|3.104494|2.627619|2.570581|2.926027|3.637683|5.756473|0.104957|5.669628|10.616291|3.930272|1.963100|17.267080|0.258660|7.774075|6.669444|10.690091|12.534467|36.858105| |2.208102|2.365768|2.628711|2.040725|3.491872|2.929219|3.880499|3.378336|3.210958|3.329939|0.090191|2.905740|2.502500|2.197846|1.933748|1.745391|1.741502|1.922740|2.184450|3.351319|0.066420|2.895271|5.793728|2.808334|1.441058|6.076284|0.118536|5.102793|7.834376|18.132520|7.830875|5.108361|36.858105| |2.073768|2.206980|2.496356|1.925073|3.157870|2.567372|3.347283|2.986021|2.900308|2.886354|0.080816|2.535158|2.252623|1.992353|1.787899|1.619789|1.601382|1.739743|1.954223|2.924760|0.057738|2.471281|4.782796|2.597305|1.347756|4.937355|0.094088|4.148791|5.514308|10.642076|5.507577|4.150292|13.733992|36.858105| |1.803400|1.909484|2.130153|1.700124|2.717834|2.178088|2.881996|2.616522|2.538944|2.394790|0.066730|2.157421|1.946720|1.756351|1.594983|1.464051|1.454726|1.571211|1.737058|2.580849|0.051520|2.133476|4.115190|2.385087|1.244380|3.945960|0.077143|3.232243|4.105997|6.982239|4.102256|3.232732|7.898478|13.751002|36.858105| |1.676367|1.775161|1.941651|1.594688|2.560341|2.061962|2.785105|2.534321|2.426744|2.239859|0.061247|2.052256|1.844609|1.685137|1.527305|1.414440|1.420530|1.542333|1.692222|2.534234|0.051257|2.078082|4.064454|2.343317|1.219080|3.684573|0.074200|2.962688|3.799546|6.147944|3.797635|2.963444|6.833644|7.943926|13.748137|36.858105| |1.741725|1.851177|1.997925|1.655789|2.723713|2.231346|3.064798|2.756701|2.595691|2.423665|0.064889|2.230104|1.970818|1.801165|1.612804|1.493773|1.513753|1.663466|1.832499|2.792663|0.056970|2.307704|4.624129|2.492102|1.285490|4.081646|0.084373|3.248865|4.344864|6.933019|4.344777|3.250610|7.860767|6.867091|7.926423|13.748939|36.858105| |1.981449|2.118175|2.291692|1.861206|3.165102|2.653031|3.637353|3.194890|2.982975|2.934828|0.077600|2.652132|2.288310|2.056444|1.811808|1.658957|1.679268|1.864856|2.090134|3.238079|0.065592|2.748476|5.623636|2.734159|1.399145|5.205018|0.107941|4.182641|6.134474|10.498299|6.137171|4.186777|13.744204|8.027305|6.945060|8.022781|13.844764|36.858105| |2.024820|2.167888|2.289793|1.904557|3.322861|2.844841|4.021299|3.478959|3.168081|3.120815|0.079828|2.866147|2.422430|2.188989|1.901796|1.745975|1.789874|2.019142|2.270710|3.608684|0.074210|3.088593|6.593200|2.910652|1.474345|5.617746|0.123843|4.329626|6.249390|9.290728|6.260166|4.335906|8.151546|5.309338|4.672090|5.305311|8.159622|14.275562|97.533100| |17.592942|8.715178|6.962630|5.514776|9.148543|6.082695|5.933792|5.409214|6.362508|6.500520|0.238607|5.594904|6.221769|4.469894|4.061944|3.159965|2.768483|2.877506|3.519947|4.649140|0.080927|3.930847|6.047788|4.139642|2.155245|6.088999|0.107055|3.993125|3.052456|3.944519|3.036732|3.958503|2.390797|2.240313|1.926984|1.779285|1.848273|2.119377|4.854625|0.500000| |17.580029|8.779683|5.485109|6.831411|9.685659|5.704120|6.055340|5.998390|7.417667|5.063671|0.151806|4.808731|5.366074|4.310407|4.030054|3.228469|2.843190|2.927158|3.494685|4.540039|0.079954|3.672058|5.643569|4.278326|2.234602|4.959284|0.093346|3.307907|2.621002|3.311328|2.536708|3.139737|2.059547|1.920757|1.685940|1.584806|1.657200|1.877994|4.369148|0.299972|0.500000| |17.590685|8.878216|6.759123|7.174069|7.603622|4.483762|4.822713|4.806191|5.935571|4.248366|0.138338|3.789423|4.125636|3.379780|3.277330|2.700423|2.374855|2.406023|2.794755|3.663563|0.065934|2.970496|4.736233|3.657409|1.951122|4.487771|0.082018|3.163936|2.534045|3.248575|2.424510|2.954266|2.039238|1.947913|1.709388|1.583533|1.628519|1.831061|4.165681|0.304238|0.301469|0.500000| |6.847540|8.853071|17.584586|7.027034|7.606710|4.466849|4.852985|4.873718|6.029119|4.166704|0.137254|3.307908|3.231856|2.639431|2.460156|2.097632|1.925230|2.002040|2.314333|3.202257|0.059021|2.696038|4.563454|3.024268|1.603138|4.885272|0.086353|3.901554|3.066365|3.823066|2.671156|3.159096|2.388390|2.319588|2.005778|1.821146|1.850289|2.089491|4.646965|0.173227|0.139422|0.200626|0.500000| |5.484040|8.788311|17.579808|6.913774|9.626120|5.510524|6.074180|6.230775|7.824967|4.675515|0.142999|3.480508|3.179714|2.586516|2.334301|2.009248|1.890667|2.011726|2.341799|3.358884|0.062480|2.909645|5.098940|2.977321|1.557750|5.752485|0.101843|5.062406|3.795240|4.410146|2.973557|3.457843|2.709011|2.568469|2.196988|2.007692|2.068567|2.370721|5.324037|0.141349|0.122882|0.139223|0.301542|0.500000| |6.855525|8.708511|17.560170|5.495656|9.338909|6.141483|6.096228|5.612787|6.612739|6.229969|0.227692|4.350531|4.017330|3.095292|2.762625|2.307771|2.133875|2.269288|2.702909|3.836091|0.069699|3.384486|5.747905|3.303856|1.721542|7.167808|0.117598|5.813186|4.100672|5.049940|3.530182|4.437787|2.976588|2.818053|2.352335|2.117140|2.177098|2.532230|5.646038|0.208060|0.141046|0.166204|0.303171|0.300388|0.500000| |6.950497|8.747036|5.508097|17.614091|9.531841|4.768068|5.731161|6.793101|9.835501|3.723683|0.105409|3.305774|3.286383|2.834850|2.653618|2.305644|2.141446|2.227673|2.540608|3.474941|0.064348|2.816854|4.670521|3.371729|1.778970|4.115700|0.079537|3.022548|2.457458|2.988819|2.184880|2.545250|1.903405|1.786135|1.589094|1.504128|1.569668|1.758087|4.086502|0.140097|0.203654|0.177988|0.142322|0.141172|0.122385|0.500000| |5.516522|8.733691|6.949027|17.635036|9.484029|4.718596|5.730453|6.901513|10.138060|3.658307|0.104280|3.052492|2.905335|2.476088|2.286188|2.001811|1.885483|1.982823|2.261068|3.177290|0.059557|2.637289|4.532191|2.994123|1.577490|4.276268|0.081531|3.370803|2.727512|3.234854|2.283002|2.610422|2.062334|1.945095|1.723722|1.621358|1.684641|1.889212|4.349176|0.122558|0.139932|0.144367|0.174582|0.207316|0.140552|0.302111|0.500000| |7.081702|8.942066|7.010555|17.581386|7.648770|4.076304|4.726719|5.213012|6.953017|3.456585|0.103886|2.981847|2.994673|2.559125|2.436516|2.113435|1.940611|1.995874|2.265145|3.082229|0.057181|2.508798|4.194182|3.070992|1.639015|3.934966|0.073825|2.985922|2.437452|3.008804|2.160506|2.507032|1.924965|1.843027|1.636507|1.527114|1.570154|1.749985|3.986125|0.144954|0.169404|0.220699|0.213662|0.170730|0.142912|0.301053|0.301269|0.500000| |6.258372|4.691429|4.062974|3.563544|6.524645|5.383160|5.732381|4.852208|5.090927|7.007137|0.218087|9.058819|17.717475|8.869566|7.041964|4.681742|3.941917|4.173282|5.622343|6.832007|0.110391|5.577836|7.611048|5.504070|2.763287|6.470879|0.119111|3.715404|2.975994|4.004485|3.340933|4.537855|2.424085|2.224609|1.920461|1.798880|1.895941|2.185903|5.107187|0.237706|0.178224|0.140858|0.102004|0.095112|0.125899|0.098077|0.085818|0.092446|0.500000| |3.990399|3.126006|2.755515|2.687293|4.236501|3.284572|3.935430|3.555308|3.673258|3.723152|0.107620|4.681669|6.981472|8.896404|17.710270|9.006266|5.652045|4.943280|5.637382|5.739680|0.098126|3.908160|5.575936|7.493976|3.915458|4.093012|0.080116|2.516091|2.172525|2.975383|2.460990|3.013419|1.897797|1.774823|1.581380|1.501859|1.571739|1.760456|4.108086|0.125878|0.122302|0.102368|0.073212|0.067321|0.080884|0.076954|0.065795|0.072254|0.212123|0.500000| |2.711711|2.295569|2.060171|2.078434|3.181594|2.462936|3.135668|2.895975|2.914762|2.676961|0.074293|3.283082|4.132229|5.631350|8.997508|17.787606|8.809936|5.605784|4.946465|4.958368|0.091189|3.120495|4.652292|12.521120|7.433304|3.154273|0.063948|1.987697|1.786303|2.453933|2.021943|2.339158|1.611261|1.510550|1.373926|1.325627|1.390348|1.531442|3.598436|0.080586|0.082796|0.071300|0.055118|0.052125|0.059425|0.060322|0.052360|0.055988|0.111324|0.217908|0.500000| |2.384468|2.201320|1.988613|1.973665|3.332216|2.775569|3.828361|3.391742|3.164928|3.007041|0.076230|3.931818|4.160429|5.595173|4.946155|5.619104|8.962418|17.742768|8.862094|9.706767|0.216424|4.729342|7.103647|13.584614|4.880100|3.750819|0.082121|2.278073|2.104994|2.857180|2.436853|2.730328|1.874751|1.690035|1.537921|1.524405|1.653990|1.844744|4.536085|0.070329|0.071747|0.059840|0.051193|0.052106|0.057799|0.057104|0.051485|0.051129|0.096075|0.107399|0.123726|0.500000| |2.043977|1.810141|1.663697|1.667262|2.536999|1.975398|2.589593|2.406353|2.380009|2.129411|0.058315|2.539218|2.936061|3.725079|4.580281|6.697785|7.003915|4.758925|3.790764|4.118218|0.080786|2.563301|3.994437|16.412717|17.591053|2.632769|0.054244|1.685770|1.560978|2.162931|1.780254|1.980762|1.451297|1.364434|1.259822|1.229598|1.290667|1.402775|3.303916|0.060034|0.060968|0.054163|0.044594|0.042971|0.047945|0.048097|0.042930|0.044950|0.077429|0.112947|0.223035|0.119970|0.500000| |1.854959|1.676696|1.535091|1.565774|2.379602|1.850167|2.478010|2.326240|2.276319|1.951432|0.052648|2.303210|2.570503|3.184634|3.630105|4.898661|5.899598|4.445504|3.428362|3.876775|0.078651|2.393730|3.800572|16.987874|17.677208|2.438005|0.050924|1.574919|1.469984|2.017111|1.648257|1.806654|1.362696|1.276064|1.185468|1.167065|1.231079|1.332180|3.162106|0.053615|0.055603|0.048996|0.040995|0.040085|0.043859|0.045495|0.040678|0.041968|0.066909|0.089132|0.145514|0.122340|0.299967|0.500000| |2.140303|1.891948|1.704237|1.767966|2.659889|2.044514|2.701612|2.548874|2.527047|2.143208|0.058253|2.546737|2.943378|3.730004|4.584813|6.700312|7.013708|4.766393|3.796108|4.119674|0.080634|2.563111|3.980728|16.413876|17.591912|2.606410|0.053929|1.678784|1.539981|2.097752|1.706880|1.908114|1.402022|1.314149|1.212039|1.184303|1.246071|1.356677|3.209933|0.061602|0.065299|0.056621|0.045622|0.044053|0.048441|0.051838|0.045358|0.047479|0.077666|0.113043|0.222683|0.120151|0.298106|0.299970|0.500000| |3.932354|4.603034|5.743328|3.509763|6.888646|5.900280|6.617981|5.518762|5.591686|6.858587|0.202015|4.535622|3.726335|2.937252|2.520028|2.155476|2.072380|2.279378|2.728090|4.130126|0.076748|3.843610|7.159469|3.232575|1.655741|12.381696|0.179984|17.626878|8.838970|9.632065|5.866084|7.109970|4.820353|4.223458|3.254030|2.884892|3.046894|3.801296|8.393244|0.121031|0.094963|0.095766|0.127868|0.164114|0.209427|0.085881|0.097448|0.088932|0.105148|0.070488|0.054735|0.059416|0.046043|0.042620|0.045704|0.500000| |3.779665|4.700393|5.147084|3.720545|8.274916|7.667153|9.886308|7.862988|7.281566|6.945276|0.167333|4.645291|3.634573|2.923445|2.465953|2.135786|2.096069|2.348751|2.813485|4.416216|0.083287|4.205163|8.291473|3.280780|1.663821|12.325512|0.221052|17.694093|8.873499|7.704080|4.978842|5.640979|4.185841|3.504904|2.854634|2.672646|2.933495|3.650738|8.707308|0.109547|0.095771|0.089814|0.111972|0.158256|0.158797|0.093206|0.107225|0.089677|0.097998|0.067510|0.053838|0.062056|0.045611|0.043033|0.046066|0.299007|0.500000| |2.670411|3.070544|3.526596|2.620746|4.684837|3.909386|5.220373|4.578954|4.341392|4.098284|0.108830|3.238325|2.707138|2.300822|2.004469|1.783650|1.764907|1.952314|2.254416|3.481860|0.067923|3.114410|6.256089|2.822443|1.447252|7.633078|0.144350|9.000766|17.610008|12.492726|5.723797|4.988029|7.318072|5.721341|4.330483|3.942840|4.355479|5.785996|12.307161|0.078385|0.068109|0.067351|0.085066|0.107542|0.109701|0.066389|0.075777|0.067011|0.073556|0.055003|0.045618|0.052453|0.040059|0.037848|0.039666|0.216466|0.214364|0.500000| |2.641804|2.969426|3.175716|2.524689|4.790272|4.297818|6.147825|5.064062|4.509764|4.583176|0.112195|3.756946|2.997658|2.566737|2.177795|1.944016|1.961186|2.225180|2.597245|4.193736|0.083064|3.870873|8.446007|3.123568|1.575923|9.384536|0.208177|8.872189|17.493367|12.206680|7.048697|5.783212|6.724392|4.688519|3.745085|3.681764|4.444927|6.322937|17.026419|0.077923|0.069307|0.065352|0.075997|0.093507|0.097768|0.065752|0.071984|0.063559|0.078231|0.058474|0.049054|0.060436|0.043336|0.041245|0.042916|0.173632|0.217206|0.301958|0.500000| |2.485597|2.527110|2.715254|2.114699|3.735627|3.260175|4.164981|3.477228|3.311968|4.137545|0.112422|3.852521|3.297873|2.871951|2.467818|2.191723|2.182791|2.441627|2.843540|4.386678|0.085160|3.836912|7.464524|3.450854|1.746157|7.625390|0.145382|4.977977|5.724223|12.493032|17.608381|8.997953|7.312773|5.709086|4.322973|3.938714|4.354332|5.788189|12.330263|0.077807|0.064886|0.062923|0.068399|0.073694|0.087868|0.055466|0.057484|0.055439|0.086845|0.066541|0.055337|0.065193|0.049337|0.045353|0.046624|0.131650|0.109368|0.127950|0.143285|0.500000| |2.527340|2.630267|2.739754|2.208669|4.094108|3.732691|5.040241|4.062915|3.709676|4.619735|0.114636|4.323711|3.456372|3.016628|2.512469|2.242241|2.286978|2.640805|3.115979|5.132662|0.102007|4.717141|10.367639|3.608999|1.795592|9.383098|0.210320|5.774495|7.047817|12.199460|17.501065|8.880497|6.716089|4.681495|3.740042|3.677623|4.441293|6.319188|17.050984|0.077594|0.067176|0.062762|0.067458|0.075670|0.086632|0.058540|0.060606|0.056719|0.087364|0.066278|0.055878|0.071712|0.049931|0.046793|0.047985|0.134098|0.129791|0.143267|0.207108|0.301687|0.500000| |3.308104|3.228875|3.276767|2.576494|4.948106|4.671955|5.644378|4.405300|4.178402|7.175422|0.182602|7.470300|5.728427|4.545206|3.568349|2.992821|2.947388|3.418074|4.369006|6.994134|0.124405|6.899631|12.044303|4.433692|2.182370|12.330179|0.224691|5.641264|4.980560|7.703578|8.849907|17.688774|4.182018|3.501991|2.851641|2.669308|2.929484|3.645938|8.696439|0.108349|0.087496|0.080152|0.080214|0.085080|0.107800|0.068397|0.067993|0.066316|0.140191|0.094052|0.072762|0.087636|0.061346|0.055416|0.058375|0.144805|0.126573|0.109424|0.129631|0.213869|0.216260|0.500000| |3.593278|3.602364|3.986340|2.802460|5.234048|4.680242|5.328384|4.321461|4.282464|6.975580|0.216713|5.586969|4.678817|3.629835|3.051445|2.560830|2.445977|2.706212|3.312146|4.964366|0.090115|4.618937|8.163833|3.749229|1.901935|12.396871|0.181380|7.124410|5.888975|9.663906|8.839035|17.614580|4.828372|4.227647|3.255864|2.886501|3.049269|3.805996|8.405117|0.119810|0.089844|0.088383|0.097234|0.102696|0.141184|0.071856|0.074269|0.073096|0.129612|0.084710|0.064180|0.069419|0.053744|0.048490|0.051638|0.216278|0.144829|0.132090|0.134390|0.216183|0.173658|0.299856|0.500000| |2.204802|2.339965|2.706272|2.025056|3.283615|2.639631|3.363061|3.009239|2.971590|2.994934|0.086196|2.592324|2.328314|2.037774|1.838790|1.653474|1.616869|1.743441|1.966435|2.907329|0.056733|2.460088|4.664249|2.611717|1.361076|5.025654|0.092647|4.265559|5.252592|9.882705|5.244426|4.266194|8.985580|17.730832|8.887566|5.641390|4.950068|5.697198|9.628590|0.066616|0.056037|0.057873|0.070402|0.076819|0.086146|0.051730|0.056583|0.054257|0.064866|0.051203|0.042955|0.046640|0.038404|0.035659|0.036979|0.127931|0.098873|0.152561|0.118869|0.152160|0.118696|0.098830|0.128049|0.500000| |1.716789|1.809126|2.027424|1.623192|2.537269|2.004467|2.635320|2.418670|2.370901|2.190640|0.061782|1.982231|1.814896|1.644669|1.509477|1.389291|1.373752|1.470778|1.616381|2.372719|0.047256|1.942193|3.692460|2.260048|1.186951|3.514174|0.068234|2.862516|3.463032|5.673486|3.459636|2.862422|5.633489|8.922966|17.736538|8.910327|5.641295|4.990820|8.320468|0.050823|0.044498|0.045631|0.053722|0.057945|0.061868|0.042092|0.045680|0.043764|0.050173|0.041817|0.036431|0.039907|0.033466|0.031438|0.032168|0.081722|0.071107|0.102279|0.087543|0.102090|0.087430|0.071040|0.081749|0.214213|0.500000| |1.533238|1.617503|1.759129|1.468569|2.319346|1.849487|2.506547|2.305803|2.213892|1.988856|0.054493|1.842058|1.673550|1.543943|1.411009|1.316032|1.323507|1.429232|1.553361|2.309068|0.046896|1.869110|3.627658|2.197736|1.148575|3.198076|0.064685|2.544449|3.144912|4.899900|3.143422|2.544806|4.932775|5.647463|8.909850|17.733361|8.940082|5.688511|9.609056|0.044966|0.040425|0.040464|0.046193|0.050495|0.052776|0.038617|0.041509|0.039225|0.045423|0.038571|0.034418|0.039366|0.032188|0.030657|0.030997|0.069162|0.064868|0.090919|0.085687|0.090829|0.085600|0.064788|0.069188|0.123965|0.214562|0.500000| 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