Version2.1 2021-01-09T09:10:37Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 06-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1ccc(cc1)NC(=O)C(=O)NC[C@@H](c2ccc3c(c2)CCCN3C)N4CCOCC4 C16838404 RHF 6-31G(d) (6D,7F) Cc1ccc(cc1)NC(=O)C(=O)NC[C@@H](c2ccc3c(c2)CCCN3C)N4CCOCC4 C01[X(C25H32N4O3)] 186 C1 544 Cc1ccc(cc1)NC(=O)C(=O)NC[C@@H](c1ccc2c(c1)CCCN2C)N1CCOCC1 Cc1ccc(cc1)NC(=O)C(=O)NC[C@@H](c1ccc2c(c1)CCCN2C)N1CCOCC1 CN1CCCc2cc(ccc12)[C@H](CNC(=O)C(=O)Nc3ccc(C)cc3)N4CCOCC4 InChIKey=OVHMPNOKVVYHJW-QHCPKHFHSA-N InChI=1S/C25H32N4O3/c1-18-5-8-21(9-6-18)27-25(31)24(30)26-17-23(29-12-14-32-15-13-29)20-7-10-22-19(16-20)4-3-11-28(22)2/h5-10,16,23H,3-4,11-15,17H2,1-2H3,(H,26,30)(H,27,31)/t23-/m0/s1 InChI=1/C25H32N4O3/c1-18-5-8-21(9-6-18)27-25(31)24(30)26-17-23(29-12-14-32-15-13-29)20-7-10-22-19(16-20)4-3-11-28(22)2/h5-10,16,23H,3-4,11-15,17H2,1-2H3,(H,26,30)(H,27,31)/t23-/m0/s1/f/h26-27H Cc1ccc(cc1)NC(=O)C(=O)NC[C@@H](c2ccc3c(c2)CCCN3C)N4CCOCC4 C01[X(C25H32N4O3)] 186 C01 544 Cc1ccc(cc1)NC(=O)C(=O)NC[C@@H](c1ccc2c(c1)CCCN2C)N1CCOCC1 O=[C]([NH][C]1[CH][CH][C]([CH][CH]1)C)[C]([NH]C[C@@H]([C]1[CH][CH][C]2[C]([CH]1)CCCN2C)N1CCOCC1)=O C[C]1[CH][CH][C]([CH][CH]1)NC(=O)C(=O)NC[C@@H]([C]2[CH][CH][C]3[C]([CH]2)CCCN3C)N4CCOCC4 InChIKey=OVHMPNOKVVYHJW-QHCPKHFHSA-N InChI=1S/C25H32N4O3/c1-18-5-8-21(9-6-18)27-25(31)24(30)26-17-23(29-12-14-32-15-13-29)20-7-10-22-19(16-20)4-3-11-28(22)2/h5-10,16,23H,3-4,11-15,17H2,1-2H3,(H,26,30)(H,27,31)/t23-/m0/s1 InChI=1/C25H32N4O3/c1-18-5-8-21(9-6-18)27-25(31)24(30)26-17-23(29-12-14-32-15-13-29)20-7-10-22-19(16-20)4-3-11-28(22)2/h5-10,16,23H,3-4,11-15,17H2,1-2H3,(H,26,30)(H,27,31)/t23-/m0/s1/f/h26-27H 3065.6937324757 -1407.7507604 1-A 26016.0510 117 427 544 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.55547 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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 10.5280 12.3967 20.3165 21.5101 26.6242 36.3862 40.6322 54.3454 63.9297 75.9603 80.3942 84.2801 109.4713 127.5617 152.3164 176.8911 187.5965 188.1276 196.4622 220.7978 243.0160 245.0646 258.8334 275.9253 297.7952 317.5378 330.9551 360.4131 377.8513 381.8918 397.1755 411.1324 418.7945 451.3014 458.4702 462.6811 487.1904 506.2213 529.0257 535.5613 537.7485 554.4223 560.9085 577.6501 594.8546 609.7818 631.9314 640.0062 688.8422 703.2005 721.5285 749.0278 753.2978 764.8242 786.8287 801.3152 805.3409 827.5478 871.1915 886.2765 904.7182 927.5383 927.8311 935.6495 950.5220 951.1426 951.8107 957.7920 965.0342 985.8368 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10.9510 23.8698 0.5018 0.0341 5.6173 0.5516 3.0177 12.4409 2.6938 29.4385 8.6065 53.8799 5.4264 3.7061 23.5778 0.9108 7.3234 5.3807 0.0571 22.5795 19.5830 121.0212 2.6694 1.6173 6.9072 7.0745 7.1206 43.9479 19.7542 0.4378 62.9180 25.0007 10.8493 0.5894 0.6639 13.3791 36.5871 4.2085 6.8518 10.3167 7.7721 5.8892 11.1765 3.5372 22.8727 1.9985 16.7603 1.7934 9.1204 2.1794 6.1764 7.2516 19.8374 2.2383 8.7427 13.3638 23.0199 3.4796 5.2087 16.2067 17.5787 21.9365 32.3035 31.4230 6.6955 121.5589 1.8388 19.3458 53.9263 0.2540 45.9691 28.5417 3.4865 57.0263 8.4907 3.2374 8.5358 10.7562 188.4184 1.7528 76.6048 38.8400 24.8997 27.0140 18.8832 18.0905 23.2757 144.2609 15.3249 2.4519 27.2381 32.3400 23.7262 31.9050 18.2110 26.5119 22.7309 30.6173 3.9770 7.9523 5.9158 1.6361 4.1696 33.9484 5.6692 1.1037 8.8875 2.1069 14.8581 61.5403 0.6767 48.2747 15.3734 251.6390 9.3625 1390.2625 10.2421 3.8504 148.9405 69.2332 43.0120 707.3473 38.5060 68.4918 34.1561 80.3197 41.3062 34.4362 14.1779 115.2964 51.6900 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1946.26 1991.55 1993.19 2007.57 2023.76 2035.02 2044.15 2077.96 2086.34 2096.19 2113.89 2116.81 2128.72 2160.83 2166.55 2189.77 2204.27 2224.45 2245.84 2248.97 2255.23 2261.89 2264.52 2286.42 2307.59 2332.57 2344.06 2348.16 2361.46 2361.97 2363.34 2366.17 2373.81 2384.49 2393.41 2397.40 2401.82 2404.54 2432.19 2435.37 2459.83 2530.52 2541.79 2593.94 2616.66 2627.38 2787.64 2829.84 4506.59 4551.13 4557.47 4572.38 4584.64 4586.58 4598.99 4605.35 4624.78 4644.86 4656.29 4661.22 4675.42 4677.66 4685.78 4690.07 4697.30 4698.63 4717.66 4722.03 4726.90 4752.38 4756.54 4798.83 4812.82 4834.29 4841.89 4850.44 4912.30 4968.73 5520.87 5546.45 0.588714 0.616966 0.617910 0.523316 -1407.162047 -1407.133794 -1407.132850 -1407.227445 3.172732D-04 MUNgauss RevisionA2.0 retrievium 09-Jan-2021 DUDE Cc1ccc(cc1)NC(=O)C(=O)NC[C@@H](c2ccc3c(c2)CCCN3C)N4CCOCC4 C16838404 RHF 6-31G(d) (6D,10F) C1 436.247441 |X|Y|Z| 148.938530 53.044683 31.931931 63.186559 28 6 7 8 23 4 1 |36.858105| |12.607687|36.858105| |7.545080|13.684429|36.858105| |5.014313|7.889528|13.817276|36.858105| |4.410449|6.783425|7.916835|13.681377|36.858105| |4.989053|7.844449|6.883003|7.951532|13.741857|36.858105| |7.526728|13.753710|8.026729|6.937769|7.951873|13.722655|36.858105| |3.327112|4.519497|5.196368|7.971366|13.523999|7.728474|5.129403|53.358707| |2.845300|3.662889|3.908147|5.178305|7.675737|6.294244|4.321036|19.363266|36.858105| |2.815192|3.562699|3.573961|4.400697|6.418386|6.460327|4.433044|11.363529|15.862499|73.516695| |2.358466|2.900599|3.155579|4.038255|5.058918|4.204873|3.230791|10.882322|12.357713|14.168107|36.858105| |2.293247|2.798756|3.152092|4.080964|4.719902|3.753582|2.993646|9.777159|7.964921|9.795618|15.800163|73.516695| |2.096039|2.508336|2.643861|3.211796|3.928004|3.544488|2.816905|7.310638|7.957126|12.629602|14.373435|14.986356|53.358707| |1.820301|2.125695|2.247424|2.662469|3.082980|2.802979|2.327840|5.383314|5.034639|8.215191|7.807739|11.905778|17.921988|36.858105| |1.669771|1.918235|1.987661|2.291604|2.636640|2.491363|2.111324|4.365434|3.997633|7.074640|5.191254|7.955399|10.642686|12.427811|36.858105| |1.703401|1.958723|2.025510|2.333114|2.690612|2.550803|2.160459|4.433961|4.047126|7.204056|5.094508|7.779797|9.846877|9.070905|17.568095|0.500000| |1.483073|1.677753|1.743602|1.980972|2.213506|2.090315|1.815050|3.565802|3.086556|5.387489|3.868984|6.435270|6.827062|7.511852|12.486459|0.250643|36.858105| |1.409688|1.585848|1.654396|1.871305|2.063240|1.940589|1.700318|3.296231|2.789859|4.817803|3.471139|5.972312|5.821253|6.203059|7.411216|0.155897|13.717295|36.858105| |1.283508|1.428390|1.489060|1.664643|1.806657|1.705719|1.517193|2.829921|2.333084|4.032699|2.808504|4.940536|4.471205|4.342840|4.962690|0.117136|7.880107|13.788878|36.858105| |1.223667|1.354285|1.407490|1.562756|1.688198|1.602445|1.435296|2.616400|2.139596|3.719516|2.525746|4.440845|3.964973|3.693816|4.365856|0.111046|6.711127|7.855477|13.630499|36.858105| |1.270391|1.409802|1.460733|1.624442|1.767200|1.683424|1.502016|2.744797|2.265046|3.964272|2.667752|4.621584|4.245741|3.927626|4.981138|0.134531|7.795507|6.867907|7.944809|13.570552|36.858105| |1.393439|1.561996|1.617592|1.817211|2.008015|1.910243|1.680651|3.170004|2.681804|4.711628|3.226373|5.451381|5.371943|5.183880|7.550831|0.207196|13.719258|8.068536|6.976676|7.918353|13.753749|36.858105| |1.196975|1.317723|1.359977|1.497526|1.616572|1.550460|1.398227|2.471368|2.010236|3.537730|2.302194|4.000721|3.564364|3.112277|3.794557|0.108573|4.996520|4.441538|5.004881|7.483479|12.564676|7.599443|36.858105| |1.108533|1.212334|1.254580|1.373357|1.464860|1.401614|1.275245|2.220327|1.776843|3.105660|2.019971|3.569771|3.053061|2.630874|3.029574|0.084822|3.855838|3.748412|4.503984|6.706997|7.582835|5.033478|12.500250|36.858105| |1.072474|1.170770|1.210052|1.322313|1.409752|1.351322|1.231409|2.133411|1.707920|2.991914|1.939931|3.426432|2.939383|2.545855|2.905580|0.078432|3.750376|3.930097|5.124300|7.828861|6.766192|4.541397|7.655096|12.531381|36.858105| |1.126521|1.236524|1.284176|1.413240|1.510046|1.437178|1.301286|2.308626|1.856783|3.227936|2.148062|3.816368|3.279558|2.928380|3.307670|0.086314|4.498621|5.143251|7.819865|13.640901|7.820015|5.162598|6.544614|7.811625|13.131028|53.358707| |1.079424|1.180314|1.225272|1.342962|1.428201|1.361035|1.238267|2.170665|1.734138|3.015315|1.989850|3.549342|3.005642|2.644649|2.891219|0.074196|3.743148|4.517705|6.708689|7.796467|5.109312|3.935313|4.405343|5.077411|7.785423|17.943080|36.858105| |1.686205|1.930672|1.962567|2.235080|2.609190|2.546936|2.160310|4.217649|3.930097|7.474612|4.635805|6.814601|9.300841|7.734573|12.990189|0.260442|7.479888|5.680859|4.135672|3.665502|4.049791|5.497067|3.259950|2.655668|2.606469|3.948444|2.617980|53.358707| |1.609250|1.827853|1.854942|2.093914|2.414090|2.364715|2.032373|3.837535|3.470604|6.548889|4.006058|6.103999|7.374377|6.155735|7.650658|0.157713|6.147775|5.744009|4.232427|3.556583|3.651659|4.525028|2.931947|2.480116|2.530503|3.902840|2.692074|17.809993|36.858105| |1.626191|1.834499|1.827501|2.031643|2.354629|2.378989|2.064274|3.629190|3.249773|6.428569|3.462595|5.247984|5.947396|4.382058|5.028809|0.118781|4.198063|3.968273|3.224895|2.839192|2.922139|3.454488|2.477532|2.135139|2.178645|3.261691|2.287621|10.680709|12.522811|36.858105| |1.540845|1.720394|1.699185|1.866148|2.147443|2.198492|1.934982|3.248499|2.860511|5.706175|2.985430|4.580659|5.008701|3.696300|4.492346|0.113094|3.897756|3.557150|3.007790|2.765316|2.920815|3.424241|2.545387|2.169769|2.198678|3.208589|2.224954|9.215417|7.912464|13.618350|73.516695| |1.602949|1.798783|1.774169|1.955902|2.270505|2.331702|2.036311|3.451034|3.082005|6.242810|3.199864|4.833323|5.459918|3.943146|5.061771|0.136157|4.162042|3.537732|2.971540|2.812863|3.104704|3.774221|2.743525|2.280242|2.246721|3.232564|2.183918|10.666953|6.793942|8.208002|24.202309|36.858105| |1.587104|1.792841|1.799021|2.010656|2.323416|2.319176|2.006563|3.627021|3.267437|6.356979|3.609012|5.467288|6.491427|5.071799|7.784883|0.209916|6.033644|4.603225|3.689231|3.501814|4.038518|5.354702|3.419740|2.722538|2.640684|3.849693|2.521685|17.820864|7.981820|6.802598|14.068090|12.528762|36.858105| |17.540204|8.830706|6.701349|4.591246|3.952596|4.276824|5.862363|4.186125|2.638261|4.601365|2.228034|3.889063|2.701618|1.739773|1.602931|0.045688|1.432393|1.358980|1.243155|1.191656|1.239955|1.355635|1.174761|1.090444|1.051087|1.497652|1.052166|2.185616|1.524179|1.530410|2.593517|1.524893|1.519509|0.500000| |17.577647|8.841481|5.567116|4.169862|3.951280|4.733385|7.221991|4.169912|2.709105|4.895125|2.242979|3.823599|2.759070|1.761724|1.634720|0.046355|1.451048|1.376601|1.254202|1.197952|1.245749|1.366376|1.176439|1.087811|1.053414|1.501751|1.057443|2.270730|1.594482|1.628875|2.761790|1.616628|1.583673|0.301943|0.500000| |17.539787|8.830715|6.691775|4.588349|3.952865|4.279652|5.869114|4.186224|2.639018|4.604036|2.228418|3.891015|2.700774|1.739822|1.590760|0.044738|1.422830|1.363795|1.245847|1.184306|1.221901|1.333750|1.149507|1.069568|1.039255|1.488762|1.053186|2.185379|1.548116|1.564328|2.623258|1.520925|1.505765|0.302240|0.301949|0.500000| |6.992316|8.896774|17.695105|8.981925|5.645952|4.955617|5.677250|5.748799|3.292995|5.345591|2.790536|5.068309|3.220354|2.057475|1.826860|0.051623|1.625575|1.552926|1.409891|1.336376|1.381343|1.516624|1.291524|1.199840|1.158028|1.670265|1.174231|2.438753|1.702680|1.671050|2.771073|1.620643|1.649075|0.190087|0.140246|0.189567|0.500000| |4.094054|5.627930|8.948656|17.695048|8.896518|5.649390|4.983798|10.017672|4.854584|7.056690|4.104249|7.842914|4.366619|2.714603|2.301028|0.064853|2.009999|1.911331|1.705222|1.598034|1.653785|1.842485|1.521250|1.401750|1.348915|1.969918|1.376036|2.995973|2.065682|1.972469|3.209438|1.886036|1.965887|0.108274|0.095975|0.108183|0.217386|0.500000| |4.081416|5.618144|4.964867|5.652713|8.918868|17.814836|8.914380|9.532263|6.867025|14.803273|4.418133|6.663095|5.269439|2.991979|2.698602|0.076857|2.224655|2.045957|1.783828|1.673852|1.767438|2.023768|1.622573|1.454998|1.403712|2.031129|1.409632|3.848494|2.605284|2.664298|4.381980|2.636935|2.581705|0.099266|0.112961|0.099347|0.107698|0.124134|0.500000| |6.970979|8.936800|5.679048|4.984515|5.668274|8.980241|17.702563|5.660602|3.756029|7.168733|2.884743|4.706566|3.536361|2.170929|2.007664|0.057093|1.732942|1.622556|1.453324|1.379724|1.445459|1.612937|1.351728|1.232673|1.192076|1.707028|1.194856|2.836598|1.968777|2.032393|3.424278|2.026121|1.964467|0.151615|0.221496|0.151882|0.124378|0.108028|0.217156|0.500000| |3.070575|4.035636|4.886082|7.550598|9.227322|5.717241|4.271159|25.980936|9.691124|10.929021|8.066436|15.787786|7.063663|4.020192|3.171802|0.088967|2.641962|2.468394|2.127994|1.962226|2.045642|2.347386|1.836804|1.660951|1.594819|2.361123|1.632092|4.037596|2.715699|2.513743|3.993612|2.370382|2.535253|0.080279|0.077572|0.080275|0.116021|0.231682|0.142920|0.097893|0.500000| |2.120026|2.529942|2.601253|3.101915|3.872795|3.675276|2.907441|6.868159|7.733733|14.919149|9.515309|10.852358|25.992909|9.025853|7.445595|0.196113|4.700466|3.963976|3.085435|2.769554|2.990607|3.782601|2.543199|2.165218|2.090374|3.135483|2.116832|10.870958|6.025412|5.121993|7.628250|4.808171|5.531545|0.055458|0.057632|0.055471|0.064159|0.083779|0.116219|0.075707|0.127869|0.500000| |1.793359|2.090154|2.242084|2.667382|3.016961|2.686188|2.251816|5.271238|4.656672|7.284221|7.293516|13.009480|12.538969|17.628173|8.872952|0.221064|6.919204|5.819176|4.315322|3.765642|4.027520|5.202293|3.217672|2.744404|2.608454|4.090855|2.679157|7.662172|4.645544|3.523509|5.504225|3.321896|4.203784|0.048019|0.047870|0.047626|0.057537|0.077042|0.077926|0.057914|0.113695|0.181657|0.500000| |1.760751|2.043927|2.164487|2.547776|2.908186|2.645601|2.221656|4.992110|4.503652|7.361470|6.585670|10.784116|12.443551|17.575992|8.722618|0.174843|6.780835|6.720003|4.608632|3.699552|3.711796|4.619443|2.916566|2.530621|2.518683|4.026227|2.748905|9.143500|6.499466|4.514254|6.473210|3.665208|4.486824|0.046546|0.047305|0.047199|0.055379|0.072522|0.077830|0.057644|0.104582|0.196832|0.304401|0.500000| |1.455085|1.642618|1.717625|1.951022|2.156006|2.019399|1.762330|3.465515|2.941385|5.048953|3.696025|6.367092|6.186533|6.595817|6.791635|0.139336|8.874891|17.722714|9.032064|5.637462|4.950645|5.684622|3.551719|3.114872|3.294188|5.706262|3.964471|7.664491|6.329121|4.267842|6.427079|3.468278|4.303272|0.038761|0.039408|0.039260|0.044714|0.055416|0.059102|0.046584|0.072223|0.115854|0.162911|0.230981|0.500000| |1.238730|1.372999|1.433002|1.595416|1.718451|1.621616|1.451004|2.672571|2.176880|3.752129|2.591789|4.611538|4.030259|3.788005|4.071026|0.097013|5.652544|9.028938|17.778302|8.866779|5.637875|5.011096|4.064306|3.917902|4.662681|9.676156|7.592762|4.843355|3.805765|2.997369|4.913755|2.666252|3.173014|0.033295|0.033599|0.033565|0.037845|0.045509|0.046878|0.038621|0.056012|0.077338|0.104374|0.115761|0.221651|0.500000| |1.426832|1.600161|1.650112|1.850447|2.053707|1.965767|1.728638|3.227769|2.738179|4.858585|3.231460|5.385286|5.349413|4.843750|7.066823|0.231342|8.944308|5.698978|5.002238|5.652866|9.017962|17.672875|7.174213|4.638512|3.967885|5.705361|3.290776|7.296453|4.156718|3.317422|6.019363|3.920894|5.649861|0.038671|0.038947|0.037721|0.042860|0.051837|0.058083|0.046190|0.065862|0.106631|0.135715|0.114884|0.124396|0.108448|0.500000| |1.173051|1.287123|1.318794|1.444404|1.564617|1.515877|1.371372|2.373895|1.937277|3.455878|2.182010|3.741641|3.392934|2.898123|3.594054|0.103051|4.538963|4.013904|4.399900|6.075100|8.906775|6.547097|17.503747|8.882220|6.699255|7.468066|3.998436|4.410858|2.928013|2.526335|4.737282|2.887112|3.557813|0.031945|0.032170|0.031265|0.034730|0.040487|0.044301|0.037044|0.048578|0.068533|0.081131|0.075600|0.091235|0.101729|0.182325|0.500000| |1.233036|1.359524|1.405530|1.549863|1.671956|1.599740|1.441396|2.557635|2.074601|3.637525|2.372661|4.132662|3.642437|3.136281|3.782873|0.113247|4.711229|4.005106|4.244570|5.690585|8.887825|7.101259|17.549476|8.828103|5.554162|6.789305|3.621116|4.347445|2.791904|2.377237|4.340639|2.686319|3.354157|0.033731|0.033619|0.032777|0.037071|0.043773|0.046416|0.038634|0.052869|0.071912|0.091827|0.079752|0.091002|0.097469|0.214517|0.303962|0.500000| |1.061202|1.154757|1.190793|1.295486|1.377615|1.325118|1.212955|2.069538|1.647114|2.893039|1.845124|3.252709|2.764674|2.328589|2.662131|0.075440|3.243179|3.120605|3.612642|4.914593|5.528858|4.110683|8.821067|17.548006|8.867054|7.680404|4.175596|3.250569|2.231870|1.963139|3.587650|2.127672|2.490402|0.029064|0.028987|0.028429|0.031694|0.036633|0.038184|0.032680|0.042862|0.054911|0.067097|0.062074|0.074014|0.089812|0.110591|0.220308|0.206016|0.500000| |1.118051|1.223882|1.274124|1.397932|1.482403|1.407644|1.280832|2.252253|1.788730|3.093133|2.047615|3.670629|3.056272|2.641165|2.952521|0.082899|3.716670|3.651912|4.361266|6.174239|6.629009|4.697467|8.836639|17.548060|8.935035|9.729950|4.846739|3.454539|2.364733|2.029061|3.613801|2.135064|2.542032|0.030616|0.030363|0.029991|0.033951|0.039875|0.040354|0.034245|0.047171|0.059449|0.078248|0.070582|0.085227|0.106994|0.120325|0.174293|0.217990|0.301892|0.500000| |1.055329|1.149677|1.181529|1.286695|1.376803|1.329698|1.213715|2.074202|1.667286|2.949978|1.874514|3.273782|2.857689|2.446954|2.839295|0.076503|3.606593|3.735923|4.707879|6.681313|6.113027|4.330531|6.947759|8.846414|17.424986|12.271361|6.712178|3.571605|2.570852|2.243106|4.091874|2.339862|2.722234|0.028685|0.028897|0.028395|0.031350|0.036265|0.038540|0.032782|0.042773|0.057189|0.068330|0.067286|0.087902|0.119626|0.106896|0.198561|0.140220|0.213208|0.174057|0.500000| |1.019155|1.107812|1.146120|1.247239|1.320590|1.265193|1.159382|1.986399|1.575246|2.751715|1.776819|3.162085|2.654342|2.267509|2.520600|0.068173|3.142035|3.330727|4.241779|5.747996|4.965198|3.649012|5.548315|8.876341|17.589853|12.589671|7.401948|3.106868|2.236990|1.955282|3.494008|1.995353|2.298156|0.027792|0.027788|0.027500|0.030594|0.035415|0.036342|0.031185|0.041357|0.052360|0.064826|0.062753|0.080222|0.113316|0.090783|0.139205|0.124066|0.214530|0.215384|0.302053|0.500000| |1.020559|1.110359|1.151574|1.255285|1.327311|1.267561|1.160441|2.001455|1.585729|2.759270|1.798993|3.218998|2.683932|2.313899|2.505022|0.065402|3.127779|3.609456|4.886644|5.712808|4.244337|3.334608|3.976350|4.883780|7.580916|12.559762|17.615171|3.120562|2.341944|2.034848|3.549818|1.967092|2.236428|0.027701|0.027785|0.027689|0.030765|0.035733|0.036356|0.031158|0.041805|0.052686|0.065428|0.066287|0.089997|0.148518|0.080242|0.101759|0.092558|0.116909|0.130882|0.181385|0.243137|0.500000| |1.101410|1.206717|1.259104|1.384489|1.467375|1.388988|1.261883|2.238948|1.781145|3.069417|2.061602|3.720538|3.089755|2.739506|2.901101|0.073656|3.718510|4.674268|6.932046|6.877526|4.598016|3.737920|3.853204|4.290748|5.729626|12.383731|17.594199|3.534233|2.692829|2.271300|3.851638|2.116427|2.437605|0.029798|0.029877|0.029923|0.033573|0.039603|0.039801|0.033693|0.047071|0.059770|0.077774|0.080509|0.117792|0.248400|0.086680|0.095835|0.091608|0.099178|0.120277|0.137126|0.155245|0.303742|0.500000| |1.075562|1.175108|1.214120|1.328042|1.418390|1.359953|1.237571|2.150378|1.726891|3.028472|1.967596|3.470711|2.995599|2.618392|2.897222|0.073470|3.711293|4.528650|6.501669|6.871720|4.738827|3.805254|4.044301|4.375870|6.401846|12.210305|17.469998|3.676742|2.849366|2.437716|4.229579|2.294382|2.620231|0.029040|0.029353|0.029167|0.032246|0.037617|0.039297|0.033284|0.044630|0.059253|0.072057|0.076262|0.112560|0.209869|0.088678|0.107032|0.092478|0.103558|0.111819|0.177807|0.163568|0.300742|0.300199|0.500000| |1.475640|1.658793|1.686879|1.887489|2.136676|2.087562|1.822740|3.351075|2.935804|5.436652|3.385796|5.371745|5.926028|5.208525|6.682984|0.140961|6.581325|6.687244|4.997729|4.096417|4.080541|4.893998|3.197185|2.706133|2.831236|4.431653|3.077061|12.237540|17.481056|8.900724|12.541959|5.888107|7.076219|0.039024|0.040605|0.039576|0.043404|0.052073|0.063049|0.049163|0.066761|0.127831|0.116701|0.155528|0.198934|0.124193|0.119376|0.089360|0.082185|0.067076|0.070690|0.080877|0.068790|0.073170|0.084545|0.092606|0.500000| |1.666996|1.905736|1.952920|2.226536|2.565927|2.471941|2.109435|4.145295|3.753292|6.874943|4.479540|6.866800|8.206602|6.963826|7.057533|0.143929|5.706492|5.784500|4.196860|3.407304|3.392790|4.111226|2.720588|2.352989|2.410722|3.776539|2.648020|12.406423|17.574249|8.929358|10.182956|5.053098|5.719556|0.043694|0.045595|0.044767|0.049784|0.061436|0.074970|0.056209|0.082294|0.176051|0.141327|0.234773|0.197881|0.107971|0.103568|0.073972|0.072365|0.058646|0.063359|0.066986|0.059875|0.063967|0.075300|0.077133|0.300914|0.500000| |1.546336|1.729517|1.723091|1.899930|2.171027|2.191488|1.928500|3.302276|2.876548|5.582283|3.049036|4.751028|5.015061|3.755309|4.123858|0.098106|3.680726|3.680333|3.089624|2.695337|2.696406|3.074675|2.300258|2.023401|2.100160|3.154937|2.263667|7.693541|8.846909|17.602430|16.918463|5.892288|5.059351|0.040379|0.043047|0.041626|0.044044|0.051403|0.067341|0.052870|0.064078|0.114784|0.086403|0.111576|0.112321|0.082049|0.080803|0.065159|0.060739|0.051813|0.053434|0.060295|0.052804|0.056079|0.062661|0.067828|0.217515|0.211857|0.500000| |1.781375|2.028294|2.006276|2.239206|2.645271|2.708787|2.318445|4.077457|3.732033|7.680544|3.821891|5.627820|6.500357|4.399413|4.717541|0.115050|3.759009|3.507837|2.865786|2.546700|2.639161|3.125300|2.271008|1.969635|1.985630|2.955415|2.070556|9.567662|8.864314|17.499647|16.549556|7.291063|5.909061|0.046212|0.049689|0.047456|0.050454|0.059710|0.085931|0.063511|0.076897|0.163779|0.097898|0.124019|0.105360|0.074380|0.085014|0.063819|0.061502|0.050567|0.052533|0.056267|0.049905|0.051614|0.057541|0.060472|0.174073|0.217558|0.300192|0.500000| |1.512127|1.678535|1.647651|1.795962|2.059938|2.128354|1.889335|3.077734|2.681084|5.374639|2.751069|4.245070|4.524917|3.297548|4.156628|0.115726|3.640565|3.130948|2.730542|2.657808|2.956438|3.486281|2.700825|2.249927|2.209064|3.110917|2.098735|7.687289|5.057215|5.892037|16.911722|17.602208|8.842833|0.040149|0.042539|0.039838|0.042029|0.048095|0.066349|0.052615|0.058966|0.106983|0.079965|0.085458|0.083851|0.068361|0.102373|0.080735|0.073477|0.059114|0.057974|0.064691|0.054617|0.053031|0.055886|0.061358|0.132087|0.110631|0.132319|0.147711|0.500000| |1.749368|1.977872|1.932880|2.134128|2.521839|2.635929|2.276899|3.817689|3.472046|7.352665|3.461281|5.102625|5.849762|3.935891|4.743148|0.131440|3.730318|3.186162|2.675128|2.526187|2.777388|3.367162|2.480870|2.087249|2.038972|2.932157|1.988943|9.549411|5.896064|7.289662|16.551399|17.501306|8.874280|0.046001|0.049214|0.045823|0.048583|0.056494|0.084676|0.063245|0.071428|0.150215|0.092010|0.100231|0.088221|0.067312|0.098346|0.071472|0.068620|0.054328|0.055002|0.058313|0.050800|0.050097|0.054069|0.057451|0.134774|0.132092|0.147741|0.217639|0.300154|0.500000| |1.626325|1.840300|1.845976|2.064428|2.389645|2.386870|2.062273|3.725574|3.349820|6.517435|3.660828|5.540740|6.456960|4.875063|7.275346|0.238501|5.561714|4.112831|3.383232|3.326157|3.984181|5.363012|3.503991|2.747745|2.583100|3.694600|2.382916|12.463935|5.728047|5.061420|10.172302|8.909662|17.555104|0.043484|0.045066|0.042573|0.046937|0.055981|0.073819|0.056036|0.072160|0.151554|0.117230|0.114391|0.104948|0.080608|0.173459|0.101053|0.099014|0.070421|0.071671|0.073309|0.062589|0.059332|0.063920|0.067605|0.143352|0.127561|0.110713|0.132526|0.210736|0.217789|0.500000| 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