Version2.0 2020-04-08T01:00:21Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 25-Jan-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCCn1c(=O)c2ccccc2c(n1)C(=O)N(CCOC)c3c(n(c(=O)[nH]c3=O)CCCC)N C14624354 RHF 6-31G(d) (6D,7F) CCCCCn1c(=O)c2ccccc2c(n1)C(=O)N(CCOC)c3c(n(c(=O)[nH]c3=O)CCCC)N C01[X(C25H34N6O5)] 204 C1 608 CCCCCn1nc(C(=O)N(c2c(=O)[nH]c(=O)n(c2N)CCCC)CCOC)c2c(c1=O)cccc2 CCCCCn1nc(C(=O)N(c2c(=O)[nH]c(=O)n(c2N)CCCC)CCOC)c2c(c1=O)cccc2 CCCCCN1N=C(C(=O)N(CCOC)C2=C(N)N(CCCC)C(=O)NC2=O)c3ccccc3C1=O InChIKey=BNJFQRRNPNZNSH-UHFFFAOYSA-N InChI=1S/C25H34N6O5/c1-4-6-10-14-31-23(33)18-12-9-8-11-17(18)19(28-31)24(34)29(15-16-36-3)20-21(26)30(13-7-5-2)25(35)27-22(20)32/h8-9,11-12H,4-7,10,13-16,26H2,1-3H3,(H,27,32,35) InChI=1/C25H34N6O5/c1-4-6-10-14-31-23(33)18-12-9-8-11-17(18)19(28-31)24(34)29(15-16-36-3)20-21(26)30(13-7-5-2)25(35)27-22(20)32/h8-9,11-12H,4-7,10,13-16,26H2,1-3H3,(H,27,32,35)/f/h27H CCCCCn1c(=O)c2ccccc2c(n1)C(=O)N(CCOC)c3c(n(c(=O)[nH]c3=O)CCCC)N C01[X(C25H34N6O5)] 204 C01 608 CCCCCn1nc(C(=O)N(c2c(=O)[nH]c(=O)n(c2N)CCCC)CCOC)c2c(c1=O)cccc2 CCCCCn1nc(C(=O)N([C@@H]2C(=O)NC(=O)N([C@@H]2N)CCCC)CCOC)c2c(c1=O)cccc2 CCCCCN1N=C(C(=O)N(CCOC)[C@H]2[C@@H](N)N(CCCC)C(=O)NC2=O)c3ccccc3C1=O InChIKey=WICCXBWFHCDNPA-SFTDATJTSA-N InChI=1S/C25H36N6O5/c1-4-6-10-14-31-23(33)18-12-9-8-11-17(18)19(28-31)24(34)29(15-16-36-3)20-21(26)30(13-7-5-2)25(35)27-22(20)32/h8-9,11-12,20-21H,4-7,10,13-16,26H2,1-3H3,(H,27,32,35)/t20-,21-/m0/s1 InChI=1/C25H36N6O5/c1-4-6-10-14-31-23(33)18-12-9-8-11-17(18)19(28-31)24(34)29(15-16-36-3)20-21(26)30(13-7-5-2)25(35)27-22(20)32/h8-9,11-12,20-21H,4-7,10,13-16,26H2,1-3H3,(H,27,32,35)/t20-,21-/m0/s1/f/h27H 4033.4170383156 -1667.5691474 1-A 22508.5052 133 475 608 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 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0.8557 0.4533 0.7934 0.3983 0.7386 0.8363 0.7906 0.7481 0.1388 0.1458 0.7251 0.7824 0.8397 0.5238 0.8550 0.4418 0.3335 0.3108 0.2894 0.4123 0.6755 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 6 6 6 6 6 7 6 8 6 6 6 6 6 6 6 7 6 8 7 6 6 8 6 6 6 7 6 8 7 1 6 8 6 6 6 6 7 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 14.00307 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 14.00307 1.00783 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 14.00307 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 1.00783 1.00783 1.00783 1.00783 1.00783 11669.3700 30854.7163 36570.9705 0.99937 0.03554 0.00103 -0.03554 0.99936 0.00289 -0.00093 -0.00293 1.00000 1 0.00742 0.00281 0.00237 0.15466 0.05849 0.04935 16.67 18.39 29.41 35.06 48.99 51.27 62.75 68.86 77.72 91.36 104.91 112.12 125.63 149.98 155.63 162.10 176.45 193.02 199.52 208.15 215.92 229.87 240.74 254.88 263.85 299.23 315.58 346.39 356.24 377.52 378.98 381.49 431.80 452.85 463.11 468.37 499.65 517.70 538.54 570.52 597.37 620.01 649.87 652.64 667.44 678.87 684.23 719.46 727.02 737.66 767.27 787.22 823.50 829.89 880.21 938.21 975.88 984.15 993.47 1023.75 1046.33 1082.39 1100.77 1119.66 1132.76 1140.43 1145.43 1150.23 1181.56 1192.75 1210.49 1224.44 1245.98 1248.35 1259.20 1285.79 1297.04 1316.63 1334.75 1375.58 1391.99 1417.99 1453.71 1466.30 1493.35 1519.23 1538.63 1567.89 1573.77 1594.14 1599.91 1615.60 1632.03 1637.19 1638.81 1640.46 1645.23 1662.93 1734.76 1746.26 1750.55 1770.40 1775.15 1793.25 1815.72 1831.56 1843.20 1867.47 1883.31 1893.51 1911.97 1920.50 1942.26 1962.10 1974.78 1985.91 2003.95 2015.07 2017.21 2024.85 2042.81 2045.40 2054.90 2083.49 2092.10 2097.18 2100.67 2126.48 2133.85 2140.00 2178.70 2186.03 2200.05 2227.87 2232.72 2243.87 2254.88 2255.41 2258.14 2263.82 2272.18 2290.41 2333.89 2345.53 2353.88 2354.40 2355.59 2356.01 2362.71 2365.35 2365.48 2366.04 2368.12 2368.91 2370.57 2381.70 2383.53 2384.14 2387.18 2405.57 2415.81 2539.48 2572.02 2602.25 2676.56 2686.95 2767.90 2794.81 2816.38 2837.47 4578.85 4579.56 4582.95 4587.06 4598.76 4600.51 4602.91 4606.73 4611.01 4624.07 4633.14 4637.64 4661.79 4672.09 4673.52 4675.17 4691.42 4693.19 4693.51 4701.14 4706.51 4717.02 4735.16 4756.09 4801.61 4805.18 4834.62 4847.07 4872.77 4918.43 4929.26 5455.27 5553.06 5681.31 0.630972 0.665441 0.666385 0.559157 -1666.938176 -1666.903706 -1666.902762 -1667.009990 3.596445D-04 MUNgauss RevisionA2.0 retrievium 08-Apr-2020 DUDE CCCCCn1c(=O)c2ccccc2c(n1)C(=O)N(CCOC)c3c(n(c(=O)[nH]c3=O)CCCC)N C14624354 RHF 6-31G(d) (6D,10F) C1 498.259069 |X|Y|Z| 125.490461 70.140681 42.905548 72.282203 18 6 7 13 5 |36.858105| |12.466356|36.858105| |7.473438|12.453354|36.858105| |4.863411|7.465614|12.455723|36.858105| |3.747843|4.876367|7.517922|12.481954|36.858105| |2.996132|3.780890|4.960547|7.658762|13.036158|53.358707| |2.696757|3.329303|4.117347|5.820025|7.771844|18.967183|36.858105| |2.801470|3.432475|4.223386|5.650400|6.949819|11.546317|15.820852|73.516695| |2.265634|2.719920|3.181535|4.189862|5.060084|10.820320|12.919678|14.333102|36.858105| |2.038819|2.395744|2.716780|3.391835|3.869826|7.057226|7.695313|11.975618|13.657982|36.858105| |1.795773|2.075089|2.302276|2.788862|3.104000|5.414797|5.098899|8.063610|7.963102|13.862040|36.858105| |1.728844|1.992844|2.204905|2.665777|2.968620|5.215737|4.499855|6.778605|6.904667|7.940313|13.640715|36.858105| |1.856587|2.162279|2.424969|2.992696|3.398904|6.252881|5.063323|7.103054|7.909299|6.829089|7.899408|13.850976|36.858105| |2.136505|2.543394|2.939757|3.805205|4.530217|9.440206|7.675405|9.424802|13.696653|7.866798|6.844615|7.944002|13.606100|36.858105| |2.334470|2.808623|3.314952|4.379022|5.362333|11.419998|6.855415|8.508031|7.855248|5.113772|4.490169|5.054620|7.526427|13.025579|36.858105| |2.729126|3.368747|4.196130|5.920410|8.051758|19.282846|7.920795|9.700825|6.877010|4.574091|3.814318|3.974415|5.175997|7.952958|15.060403|53.358707| |2.109721|2.472778|2.830704|3.501319|4.039629|7.133375|4.442166|6.170544|4.984972|3.809228|3.643533|4.332813|6.303873|7.377665|12.585550|10.943340|36.858105| |1.891652|2.170352|2.469784|2.953165|3.433530|5.853427|3.856062|5.527213|4.443843|3.587241|3.572560|4.382692|6.264246|6.378013|8.204748|7.945023|15.904889|73.516695| |2.157528|2.528840|2.818941|3.423313|3.695223|6.028676|3.715676|5.384566|3.951772|3.162524|3.037957|3.512963|4.674705|5.205926|7.629338|8.665835|13.925239|15.037543|53.358707| |2.462715|2.961816|3.239852|4.004994|4.017142|6.273257|3.770276|5.553377|3.789336|3.042340|2.844496|3.145265|3.969367|4.599536|6.428045|8.598877|7.586527|9.387931|17.688995|36.858105| |2.424821|2.958082|3.127834|3.941278|3.758450|6.005214|3.877615|5.769922|4.015363|3.293357|3.097687|3.402645|4.192772|4.750354|5.815246|7.431912|5.893340|7.818200|10.343892|12.533369|36.858105| |2.073022|2.448171|2.544421|3.063137|2.976650|4.700605|3.194893|4.870519|3.460760|2.989063|2.953231|3.347742|4.035578|4.143264|4.662280|5.623661|5.143973|7.400517|8.965317|7.972403|13.594430|73.516695| |1.973225|2.318857|2.358475|2.807354|2.677519|4.183878|2.977104|4.662639|3.255743|2.942237|2.955254|3.286976|3.729276|3.711583|3.842476|4.706402|3.945482|5.990904|6.153143|5.186499|8.115373|24.232822|36.858105| |1.942209|2.213393|2.427501|2.809525|3.005328|4.643152|2.948652|4.437589|3.114868|2.615267|2.570798|2.967898|3.750091|3.907146|5.065971|6.108635|8.072573|12.746638|18.254235|7.710059|5.276387|9.309955|3.814183|36.858105| |1.730717|1.950273|2.097765|2.395362|2.521847|3.881870|2.571912|3.940080|2.780995|2.419280|2.449045|2.871831|3.528213|3.448315|4.085358|4.837840|5.904616|10.408017|10.700527|5.606041|4.572625|9.130605|3.874589|14.010844|36.858105| |1.580430|1.749564|1.867956|2.080939|2.184911|3.277565|2.193626|3.428707|2.342574|2.083050|2.118007|2.444595|2.889528|2.806562|3.219344|3.944843|4.301552|7.990310|7.019117|4.116888|3.477744|6.828928|3.117822|7.976065|13.786125|53.358707| |1.579494|1.729717|1.856096|2.034135|2.150668|3.157611|2.088984|3.289742|2.184226|1.938518|1.945488|2.203067|2.579265|2.567217|2.979465|3.773070|3.880893|7.262100|6.141632|3.713648|3.050911|5.677812|2.639299|6.791913|7.897106|18.683702|36.858105| 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|1.335965|1.464469|1.555292|1.721653|1.815274|2.739146|1.909008|3.029934|2.089743|1.931997|2.033314|2.377156|2.687412|2.465578|2.624509|3.166614|3.265485|6.437150|4.703122|2.872014|2.655358|5.311488|2.639562|4.255027|5.811929|10.364431|5.765394|9.867276|5.804289|0.102112|3.776070|5.459650|12.475413|36.858105| |1.217539|1.325238|1.393725|1.529236|1.596803|2.387698|1.686225|2.712574|1.840814|1.734353|1.837957|2.121211|2.323507|2.123287|2.208906|2.699837|2.628583|5.070625|3.750591|2.394705|2.282803|4.584655|2.368855|3.216342|4.096812|6.730894|4.123034|7.522355|4.411552|0.080913|2.918122|4.398488|7.521413|12.452043|36.858105| |1.146639|1.244329|1.312735|1.438120|1.512287|2.265968|1.620689|2.621279|1.781544|1.702663|1.825627|2.107458|2.261929|2.038184|2.074734|2.530747|2.416270|4.739558|3.328520|2.127661|2.047929|4.045095|2.127044|2.757634|3.331048|5.139286|3.322875|6.060387|3.755302|0.070368|2.537160|3.925025|4.884157|7.487688|12.466817|36.858105| |1.677354|1.900656|2.024309|2.335132|2.429667|3.806228|2.597923|3.982719|2.891473|2.557541|2.648933|3.177675|3.884337|3.617299|4.050707|4.646284|5.515084|9.576373|9.263762|5.252894|4.904590|11.074228|4.737989|8.056741|14.056687|11.071469|5.255158|7.355697|6.408034|0.104933|5.174963|7.187001|6.787597|5.717577|4.265857|3.488645|53.358707| |17.538109|8.776068|6.771742|4.496839|3.635689|3.945646|2.662701|5.032123|2.224506|2.023983|1.775914|1.693443|1.801995|2.069545|2.228118|3.527082|1.999568|3.219682|2.739889|2.252477|2.222561|3.410765|1.836176|1.816300|1.626119|2.028291|1.490699|2.451080|2.229930|0.044932|1.833632|3.570459|1.347667|1.275541|1.165608|1.104431|2.150341|0.500000| |17.548164|8.773507|5.454725|4.038598|3.172511|3.601441|2.424053|4.465837|2.081052|1.895904|1.688057|1.628412|1.737696|1.973170|2.135839|3.330389|1.952089|3.123363|2.740171|2.303343|2.301522|3.545628|1.921038|1.826525|1.645862|2.054787|1.503800|2.473203|2.237152|0.044916|1.832397|3.532375|1.369169|1.283092|1.176322|1.106784|2.183757|0.301697|0.500000| |17.537134|8.774376|6.771717|4.494643|3.635041|3.946589|2.561845|4.646353|2.171609|1.942028|1.722832|1.675292|1.811944|2.079596|2.305110|3.676785|2.116497|3.384521|2.965543|2.477291|2.379086|3.625521|1.916667|1.983906|1.758113|2.198259|1.630261|2.674326|2.465899|0.049939|2.033911|4.013170|1.447179|1.353459|1.230245|1.155778|2.292949|0.301675|0.301670|0.500000| |8.861821|17.508570|8.858729|6.863639|4.543763|5.022344|3.196963|5.664532|2.679032|2.342713|2.054016|2.001649|2.193294|2.566910|2.883143|4.676904|2.584188|3.986910|3.692974|3.282314|3.282555|4.770349|2.523077|2.372257|2.083604|2.533325|1.834759|2.956356|2.766824|0.054702|2.343589|4.559400|1.655592|1.534973|1.385929|1.291381|2.759304|0.172972|0.212793|0.210715|0.500000| |8.860223|17.514054|8.861834|6.873166|4.546079|5.021257|3.398663|6.404921|2.779832|2.489989|2.145234|2.032733|2.176000|2.548450|2.737827|4.382314|2.380978|3.726736|3.284878|2.809225|2.906435|4.313106|2.348513|2.101769|1.874552|2.284071|1.643435|2.664588|2.447074|0.048347|2.052676|3.942691|1.512026|1.424756|1.296019|1.221406|2.522090|0.210746|0.212719|0.172944|0.303835|0.500000| |6.879996|8.863758|17.503134|8.859535|6.915968|6.294290|4.049220|7.791690|3.096678|2.700095|2.273030|2.143789|2.320347|2.793057|3.055498|5.150452|2.597209|4.110320|3.445985|2.816450|2.738807|4.056560|2.140268|2.204491|1.926378|2.354157|1.722332|2.789320|2.613043|0.052198|2.211899|4.380045|1.540008|1.466531|1.320706|1.253686|2.539840|0.204118|0.140533|0.169249|0.173785|0.211931|0.500000| |6.876660|8.860877|17.497828|8.848082|6.914212|6.300269|3.721561|6.558621|2.960092|2.515739|2.165829|2.107943|2.342064|2.818450|3.263164|5.651915|2.869018|4.469418|3.928266|3.295462|3.047784|4.431308|2.270476|2.524032|2.156187|2.630752|1.947132|3.130386|3.014912|0.060497|2.590545|5.280324|1.692956|1.587968|1.416541|1.329978|2.783430|0.169142|0.140493|0.204016|0.211877|0.173787|0.303595|0.500000| |4.525619|6.840154|8.840610|17.511233|8.886516|9.546674|5.204691|8.402886|4.055168|3.251871|2.742523|2.691444|3.082998|3.896011|4.695802|8.634675|3.852217|5.601790|5.360480|4.941201|4.837314|6.348774|3.197124|3.164183|2.660483|3.102939|2.214070|3.474967|3.397533|0.065721|3.034170|5.980770|1.977233|1.841573|1.626238|1.513614|3.520564|0.111104|0.108381|0.119409|0.206267|0.170762|0.173562|0.211473|0.500000| |4.524015|6.830934|8.837952|17.545523|8.903091|9.532110|6.245481|11.662475|4.431843|3.685162|2.971643|2.767568|3.033801|3.829785|4.131408|7.103371|3.257538|4.937632|4.291447|3.648006|3.817642|5.365318|2.857808|2.591616|2.259281|2.672968|1.897939|3.023529|2.849088|0.055419|2.467854|4.753127|1.743768|1.658527|1.485103|1.403489|3.060380|0.119478|0.108321|0.111041|0.170243|0.206187|0.211852|0.173463|0.302343|0.500000| |3.645522|4.524929|6.841109|8.839463|17.653875|12.587421|7.442246|13.933607|4.781703|3.850760|3.051757|2.839971|3.145594|4.071861|4.461696|8.122966|3.450039|5.431867|4.245788|3.291725|3.142853|4.596897|2.377283|2.615836|2.243999|2.688743|1.952336|3.119842|2.983416|0.058907|2.588770|5.145992|1.738577|1.681606|1.492323|1.426670|2.960037|0.102627|0.085436|0.097144|0.111839|0.120409|0.206399|0.170474|0.173929|0.213223|0.500000| |3.639957|4.517240|6.824250|8.810142|17.628840|12.663850|5.844306|9.143709|4.322127|3.365568|2.806530|2.759883|3.203947|4.157600|5.211300|10.735407|4.191524|6.370985|5.280445|4.152076|3.642984|5.171956|2.561737|3.213244|2.638464|3.130908|2.304531|3.627397|3.637859|0.071886|3.273757|6.842999|1.971294|1.874972|1.636904|1.543941|3.372877|0.097013|0.085327|0.102451|0.120178|0.111728|0.170158|0.205794|0.212199|0.173818|0.301333|0.500000| |2.077836|2.430371|2.746547|3.370958|3.784875|6.479445|7.178270|13.460926|8.944446|17.760274|8.893174|5.629687|4.932837|5.633096|4.182391|5.437284|3.215312|5.388529|3.750125|2.711742|2.926612|4.709911|2.639248|2.319148|2.148462|2.554271|1.763970|2.840334|2.534669|0.048717|2.120493|3.846096|1.727368|1.743599|1.580236|1.554197|3.063873|0.057965|0.053667|0.054481|0.064995|0.071122|0.077383|0.069682|0.087375|0.104333|0.108829|0.089983|0.500000| |1.673235|1.910153|2.091393|2.474868|2.704570|4.508623|4.139876|6.957357|5.651916|8.952410|17.724198|8.881164|5.636623|4.937840|3.582655|4.289759|3.033470|5.350457|3.546495|2.465630|2.684208|4.624023|2.653037|2.260376|2.183024|2.614113|1.771167|2.869676|2.475245|0.047191|2.025334|3.556353|1.813233|1.880645|1.726241|1.730896|3.215073|0.046211|0.043962|0.044501|0.052331|0.055157|0.057842|0.054617|0.067267|0.073616|0.074981|0.068327|0.213539|0.500000| |1.580088|1.799700|1.965715|2.326204|2.549369|4.307170|3.588548|5.596110|4.968559|5.654221|8.890957|17.718789|8.978571|5.649258|4.099577|4.508085|3.785066|7.024893|4.322137|2.829648|3.050972|5.537652|3.108624|2.782666|2.776904|3.271305|2.150550|3.447042|2.943967|0.055055|2.401351|4.074105|2.286817|2.437877|2.206212|2.226805|4.249480|0.043001|0.041611|0.042658|0.050372|0.050937|0.053150|0.052521|0.065540|0.066778|0.068054|0.066788|0.123881|0.214806|0.500000| |1.764275|2.036170|2.263528|2.742494|3.075472|5.430669|4.117525|5.935165|5.633915|4.934286|5.631201|8.951887|17.778921|8.869373|6.861197|6.427927|7.097635|13.734776|7.114388|4.144538|4.251421|7.646287|3.853460|4.307411|4.179978|4.565591|2.918889|4.483344|4.059144|0.073524|3.470955|5.730243|3.016114|3.158983|2.670847|2.587613|6.433327|0.047325|0.046053|0.048223|0.057931|0.056408|0.059749|0.061587|0.079791|0.075897|0.078428|0.082842|0.107270|0.124114|0.216393|0.500000| |2.370858|2.788587|2.966227|3.484885|3.415341|5.060534|3.122080|4.756080|3.119921|2.598724|2.465845|2.712753|3.307471|3.668783|4.761289|6.464365|5.720658|7.894566|12.682966|17.651552|8.986451|12.940013|4.856604|7.823315|5.907057|6.070467|4.047824|5.809583|6.274952|0.109300|6.201590|10.282243|3.494226|2.943711|2.458353|2.144014|7.185967|0.059824|0.062296|0.066985|0.087034|0.072903|0.071720|0.085079|0.117999|0.088247|0.079635|0.099519|0.065366|0.060516|0.069357|0.097235|0.500000| |2.812517|3.460635|3.910272|4.972877|4.966362|7.463563|4.167328|6.115213|3.929289|3.089070|2.798522|3.002458|3.733194|4.559450|6.622265|10.482309|6.805118|8.607646|12.289391|17.653850|8.906085|10.213430|4.260309|6.076647|4.465634|4.779054|3.327279|4.918343|5.315088|0.096995|5.370463|10.351449|2.837007|2.537797|2.144387|1.934184|5.595360|0.070848|0.071780|0.079038|0.107216|0.089142|0.091886|0.112163|0.179738|0.119422|0.107920|0.146505|0.077581|0.067390|0.074120|0.104326|0.303657|0.500000| |2.640490|3.266093|3.326891|4.129665|3.684729|5.549056|3.591851|5.538292|3.555078|2.988185|2.776653|2.949757|3.474474|3.939242|4.646896|6.413918|4.528243|6.333643|7.586913|8.946673|17.496574|16.543564|7.292720|4.300911|3.797211|4.145184|2.739589|4.182298|4.002437|0.073269|3.576108|6.248696|2.641502|2.360593|2.069390|1.861362|5.415784|0.066171|0.070318|0.071486|0.103850|0.089372|0.079477|0.089177|0.145674|0.111797|0.085747|0.098436|0.075856|0.068094|0.074112|0.095963|0.218018|0.217862|0.500000| |2.456199|3.037164|3.277458|4.316583|4.193646|7.176860|4.772469|6.862757|5.087536|4.027178|3.703788|4.035962|5.065531|6.056655|7.102801|8.719899|6.190308|8.136162|9.171065|8.775515|17.547811|16.592465|7.320943|4.607797|4.026548|4.251418|2.768828|4.197622|4.036898|0.073307|3.671696|6.372392|2.703388|2.507432|2.170751|1.986176|5.955353|0.063284|0.064276|0.066080|0.091357|0.084413|0.080632|0.086653|0.143383|0.119966|0.097165|0.108421|0.097333|0.086980|0.097130|0.135254|0.174144|0.211137|0.301904|0.500000| |1.780143|2.053739|2.084832|2.428473|2.347394|3.630679|2.604684|4.125386|2.871804|2.656413|2.736064|3.083141|3.425868|3.277227|3.341615|4.065783|3.543641|5.602767|5.477840|4.330904|5.848868|16.851008|17.616852|3.609213|3.876217|4.343572|2.650557|4.143571|3.513843|0.063463|2.869008|4.632582|3.068229|2.803673|2.558269|2.278591|6.747893|0.046258|0.048346|0.048271|0.061643|0.057633|0.053091|0.056189|0.075508|0.068380|0.058704|0.063026|0.066436|0.069328|0.083530|0.100945|0.117363|0.099704|0.147660|0.147998|0.500000| |2.067995|2.436029|2.416945|2.841553|2.623796|3.979270|2.817379|4.502914|2.974133|2.704996|2.664558|2.866317|3.182940|3.260244|3.407626|4.364781|3.416867|5.206841|5.337016|4.737860|7.218151|16.468799|17.530641|3.369936|3.356774|3.795997|2.422145|3.794745|3.330197|0.061059|2.777683|4.652005|2.593035|2.350562|2.136711|1.923436|5.289562|0.053031|0.056498|0.055508|0.074622|0.068940|0.060507|0.064256|0.090686|0.080858|0.064779|0.069486|0.068915|0.067302|0.075118|0.089434|0.127590|0.112973|0.217490|0.176756|0.300036|0.500000| |1.975848|2.336639|2.398804|2.902275|2.793083|4.475188|3.296317|5.141359|3.721326|3.411285|3.458004|3.840309|4.282951|4.203959|4.104187|4.926912|3.991873|6.089441|5.815758|4.712640|7.214220|16.452387|17.525294|3.513560|3.513143|3.877683|2.442834|3.806815|3.351133|0.061102|2.823203|4.705084|2.651491|2.496222|2.249177|2.062839|5.789713|0.051518|0.053210|0.052862|0.069547|0.066588|0.061046|0.063317|0.090165|0.083851|0.069379|0.072816|0.083987|0.085530|0.099671|0.118922|0.116689|0.112047|0.176072|0.218229|0.299667|0.299407|0.500000| |1.369649|1.490895|1.566262|1.708722|1.770423|2.605671|1.782120|2.849448|1.893633|1.733336|1.779869|2.021602|2.285887|2.191176|2.404864|3.009421|2.959349|5.507796|4.543700|2.918775|2.632229|5.215916|2.556295|4.307859|5.747655|12.653083|7.793701|15.084751|6.857070|0.121009|4.073140|5.808502|17.704698|8.861853|6.840804|4.538485|6.825114|0.036034|0.036702|0.038863|0.043873|0.039944|0.040677|0.044860|0.051325|0.045288|0.045261|0.051326|0.044019|0.045781|0.056350|0.072032|0.087759|0.071827|0.066669|0.066810|0.074906|0.065059|0.065184|0.500000| |1.427090|1.572420|1.644559|1.822106|1.871841|2.800781|1.930494|3.065677|2.083772|1.908645|1.978712|2.280646|2.593957|2.443219|2.654990|3.252794|3.286161|5.979996|5.160761|3.321764|3.109471|6.555558|3.199886|4.740381|7.058791|12.407051|5.877383|9.395170|5.954754|0.101985|3.984451|5.673999|17.592711|8.767347|6.869367|4.524111|10.061969|0.037446|0.038327|0.040141|0.046482|0.042459|0.042522|0.046576|0.055183|0.048739|0.047557|0.053520|0.048060|0.050681|0.063881|0.082975|0.099488|0.078838|0.077390|0.078011|0.097029|0.079321|0.079963|0.305815|0.500000| |1.376599|1.520157|1.622397|1.816963|1.927798|2.958368|2.077391|3.269843|2.317140|2.142460|2.283793|2.731700|3.119762|2.784886|2.924292|3.441177|3.684766|7.428880|5.172375|3.075341|2.880950|5.824057|2.889218|4.536189|6.252022|9.457918|5.096448|8.180412|5.528200|0.096305|3.823437|5.550147|8.838833|17.542834|8.829886|6.856396|9.203948|0.036562|0.036639|0.038561|0.044160|0.041247|0.042525|0.045750|0.053939|0.048840|0.049541|0.054939|0.053119|0.058303|0.078508|0.105009|0.085427|0.074769|0.069882|0.076553|0.085338|0.070074|0.076847|0.173835|0.207726|0.500000| |1.321708|1.442157|1.541287|1.696875|1.806808|2.711777|1.882112|2.991854|2.046553|1.887803|1.975277|2.293010|2.592467|2.403747|2.574441|3.131621|3.201929|6.465401|4.513034|2.734704|2.480227|4.811831|2.385322|4.115225|5.240302|9.515610|6.169864|11.190402|6.183017|0.111184|3.868809|5.633477|8.937001|17.549038|8.842162|6.859692|6.492907|0.035151|0.035146|0.037339|0.041808|0.038823|0.040517|0.043956|0.050116|0.045172|0.046681|0.052253|0.047468|0.050765|0.064969|0.083951|0.077460|0.068382|0.061548|0.065565|0.069072|0.059615|0.063272|0.215503|0.173724|0.303342|0.500000| |1.181903|1.278551|1.339688|1.457011|1.515098|2.239642|1.574128|2.546581|1.697261|1.597505|1.676921|1.908047|2.083462|1.936373|2.030884|2.520361|2.396233|4.570504|3.452046|2.241378|2.120350|4.208161|2.175893|2.980318|3.702311|6.291142|4.090954|7.914606|4.329524|0.080896|2.790752|4.238036|6.940260|8.854278|17.518327|8.862988|5.035246|0.031409|0.031780|0.033287|0.037180|0.034634|0.035265|0.037972|0.043028|0.039187|0.039390|0.043326|0.040725|0.043876|0.054680|0.065496|0.064707|0.056254|0.054053|0.055688|0.064865|0.055324|0.057083|0.206946|0.173029|0.173478|0.211741|0.500000| 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