Version2.0 2020-01-13T13:14:21Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 02-Dec-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCC(CC)C(=O)NCCCCCc1nc2ccccc2n1CCCOc3cccc4c3cccc4 C40211651 RHF 6-31G(d) (6D,7F) CCC(CC)C(=O)NCCCCCc1nc2ccccc2n1CCCOc3cccc4c3cccc4 C01[X(C31H39N3O2)] 219 C1 618 CCC(C(=O)NCCCCCc1nc2c(n1CCCOc1cccc3c1cccc3)cccc2)CC CCC(C(=O)NCCCCCc1nc2c(n1CCCOc1cccc3c1cccc3)cccc2)CC CCC(CC)C(=O)NCCCCCc1nc2ccccc2n1CCCOc3cccc4ccccc34 InChIKey=AHSZYQQVJLJJOR-UHFFFAOYSA-N InChI=1S/C31H39N3O2/c1-3-24(4-2)31(35)32-21-11-5-6-20-30-33-27-17-9-10-18-28(27)34(30)22-13-23-36-29-19-12-15-25-14-7-8-16-26(25)29/h7-10,12,14-19,24H,3-6,11,13,20-23H2,1-2H3,(H,32,35) InChI=1/C31H39N3O2/c1-3-24(4-2)31(35)32-21-11-5-6-20-30-33-27-17-9-10-18-28(27)34(30)22-13-23-36-29-19-12-15-25-14-7-8-16-26(25)29/h7-10,12,14-19,24H,3-6,11,13,20-23H2,1-2H3,(H,32,35)/f/h32H CCC(CC)C(=O)NCCCCCc1nc2ccccc2n1CCCOc3cccc4c3cccc4 C01[X(C31H39N3O2)] 219 C01 618 CCC(C(=O)NCCCCCc1nc2c(n1CCCOc1cccc3c1cccc3)cccc2)CC CCC(C(=O)NCCCCCc1nc2c(n1CCCO[C@@H]1CC=C[C@@H]3[C@H]1CCC=C3)cccc2)CC CCC(CC)C(=O)NCCCCCc1nc2ccccc2n1CCCO[C@@H]3CC=C[C@H]4C=CCC[C@@H]34 InChIKey=QJHMAOQIYNRXSN-WWPJHQMMSA-N InChI=1S/C31H45N3O2/c1-3-24(4-2)31(35)32-21-11-5-6-20-30-33-27-17-9-10-18-28(27)34(30)22-13-23-36-29-19-12-15-25-14-7-8-16-26(25)29/h7,9-10,12,14-15,17-18,24-26,29H,3-6,8,11,13,16,19-23H2,1-2H3,(H,32,35)/t25-,26-,29-/m1/s1 InChI=1/C31H45N3O2/c1-3-24(4-2)31(35)32-21-11-5-6-20-30-33-27-17-9-10-18-28(27)34(30)22-13-23-36-29-19-12-15-25-14-7-8-16-26(25)29/h7,9-10,12,14-15,17-18,24-26,29H,3-6,8,11,13,16,19-23H2,1-2H3,(H,32,35)/t25-,26-,29-/m1/s1/f/h32H 3415.1530777810 -1509.7564602 1-A 37535.4477 131 487 618 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|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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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 71 72 73 74 75 6 6 6 6 6 6 8 7 6 6 6 6 6 6 7 6 6 6 6 6 6 7 6 6 6 8 6 6 6 6 6 6 6 6 6 6 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 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 20131.6423 49794.9983 65127.2692 0.99991 -0.01315 0.00179 0.01315 0.99991 -0.00217 -0.00177 0.00220 1.00000 1 0.00430 0.00174 0.00133 0.08965 0.03624 0.02771 9.01 13.91 14.93 24.95 30.78 43.74 46.86 50.62 67.43 83.52 111.79 120.34 138.90 162.28 174.27 181.03 187.19 203.98 222.36 225.11 243.42 247.43 282.19 285.52 288.02 300.82 344.91 385.83 409.56 418.09 431.04 436.24 457.85 475.41 480.16 494.90 532.46 556.83 577.10 639.45 663.98 677.33 679.07 724.05 725.42 745.20 749.50 800.15 820.88 837.60 846.41 884.66 917.63 927.83 952.69 979.16 1021.03 1064.32 1069.64 1131.18 1153.23 1154.94 1171.68 1178.83 1184.14 1186.77 1191.21 1204.04 1211.39 1229.50 1231.44 1248.51 1255.19 1283.60 1307.45 1320.60 1349.03 1368.33 1383.75 1386.83 1399.13 1423.86 1427.25 1429.69 1457.91 1523.94 1534.12 1543.40 1560.85 1569.63 1572.19 1582.42 1584.26 1586.23 1591.60 1600.07 1609.19 1618.03 1627.52 1632.76 1636.06 1667.23 1674.87 1695.23 1699.62 1737.93 1744.09 1753.89 1757.90 1778.82 1781.65 1794.90 1807.81 1843.74 1852.53 1857.79 1881.19 1884.07 1888.39 1924.19 1933.54 1963.85 1969.92 1980.19 1988.78 2008.35 2014.74 2027.77 2046.07 2047.37 2055.99 2066.67 2076.85 2082.36 2086.16 2096.20 2107.16 2111.76 2120.52 2135.24 2155.13 2171.26 2181.05 2193.22 2230.67 2236.21 2240.33 2246.55 2262.80 2265.74 2269.50 2270.06 2293.31 2318.58 2344.02 2344.93 2347.28 2350.82 2353.07 2354.73 2358.75 2365.39 2368.79 2369.31 2371.53 2374.34 2377.41 2382.63 2389.54 2392.20 2414.92 2427.93 2455.11 2508.91 2568.68 2572.12 2598.44 2618.28 2651.25 2783.23 4570.55 4576.14 4593.09 4597.52 4602.05 4607.68 4610.76 4616.22 4620.82 4626.45 4633.75 4642.72 4648.61 4652.74 4659.22 4664.30 4668.99 4680.63 4685.45 4701.42 4705.18 4709.77 4727.93 4733.41 4747.96 4748.18 4750.44 4825.51 4829.00 4833.00 4845.56 4847.48 4861.97 4866.22 4867.81 4881.62 4900.92 4915.28 5604.43 0.696243 0.729519 0.730463 0.622493 -1509.060217 -1509.026942 -1509.025997 -1509.133967 3.621332D-04 MUNgauss RevisionA2.0 retrievium 13-Jan-2020 DUDE CCC(CC)C(=O)NCCCCCc1nc2ccccc2n1CCCOc3cccc4c3cccc4 C40211651 RHF 6-31G(d) (6D,10F) C1 485.304228 |X|Y|Z| 162.040484 98.565551 39.537060 85.792835 23 6 7 8 20 2 1 |36.858105| |12.459469|36.858105| |7.414212|12.403417|36.858105| |6.079060|7.332160|12.311438|36.858105| |5.104576|6.057017|7.308765|12.451007|36.858105| |4.891319|7.600499|12.489729|7.584536|6.056153|36.858105| |4.381067|6.692556|7.946105|5.935450|5.771383|15.817165|73.516695| |3.885060|5.221408|7.817087|5.868976|4.630013|14.077115|15.133328|53.358707| |3.051046|3.900381|4.995849|4.199247|3.692224|7.750332|12.195113|17.880121|36.858105| |2.835251|3.570332|4.146303|3.375429|3.029306|5.833585|10.019263|10.420803|12.465716|36.858105| |2.323668|2.812220|3.154207|2.730734|2.547989|4.118428|7.475154|6.752329|7.497529|12.457586|36.858105| |2.130954|2.522973|2.705713|2.336757|2.195463|3.341135|6.114049|5.149852|4.873420|7.478279|12.457510|36.858105| |1.828205|2.116676|2.253133|2.010259|1.922897|2.700397|4.977327|4.078173|3.743261|4.863259|7.475318|12.398797|36.858105| 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|1.424149|1.592063|1.580563|1.488426|1.547800|1.774759|3.493084|2.369972|1.907776|2.043338|2.245323|2.357105|2.527557|2.521624|2.987147|2.205153|1.953961|1.952494|2.191310|2.559369|2.563854|3.908031|3.610356|4.414105|6.734872|14.111098|14.005733|36.858105| |1.349511|1.494981|1.478953|1.407979|1.476661|1.640662|3.220262|2.176444|1.729188|1.819795|1.965237|2.027855|2.142830|2.125516|2.568844|1.895362|1.709341|1.714615|1.902832|2.166941|2.156468|3.219700|2.848169|3.327984|4.486329|9.212252|7.918457|13.426297|36.858105| |1.240945|1.364673|1.358097|1.302969|1.363833|1.497268|2.908613|1.999943|1.587421|1.658249|1.795143|1.845045|1.968840|1.958225|2.399328|1.772398|1.615513|1.623225|1.787071|2.004272|1.989747|2.928621|2.517310|2.967859|3.773064|8.167878|6.805798|7.885666|14.078588|36.858105| |1.194942|1.313607|1.317860|1.263796|1.312199|1.456544|2.807147|1.967824|1.574738|1.651811|1.813816|1.876957|2.046169|2.049976|2.520732|1.865680|1.701518|1.708322|1.877484|2.102500|2.090089|3.061587|2.603627|3.181772|3.949171|9.321059|7.798286|6.803487|7.923164|13.382616|36.858105| |1.244176|1.376018|1.386299|1.319348|1.359666|1.545606|2.977518|2.104312|1.703450|1.810476|2.023442|2.124797|2.368596|2.393744|2.907813|2.155552|1.939888|1.940897|2.149893|2.450741|2.449902|3.626841|3.138516|4.076629|5.212995|14.447345|13.302301|7.856022|6.815254|7.785953|13.538988|36.858105| |1.183696|1.304722|1.323692|1.261564|1.290186|1.473353|2.808421|2.028030|1.648751|1.754753|1.981335|2.092189|2.383782|2.435543|3.000414|2.229855|2.020489|2.018047|2.215000|2.495059|2.501462|3.646494|3.042817|4.010692|4.595465|12.325978|7.646428|5.111015|4.521790|5.092773|7.810701|13.434717|36.858105| |1.097564|1.201227|1.220137|1.171273|1.198818|1.346983|2.551570|1.855017|1.497285|1.576753|1.762785|1.842111|2.077217|2.114896|2.657224|1.974154|1.821692|1.824533|1.975386|2.171086|2.167245|3.104714|2.514506|3.146949|3.460122|8.244608|5.107774|3.938299|3.789651|4.511323|6.805207|7.897268|14.004525|36.858105| |1.063016|1.158675|1.172332|1.131567|1.165596|1.286371|2.441057|1.758877|1.407096|1.467996|1.618239|1.672730|1.848485|1.865579|2.351017|1.743422|1.619305|1.626609|1.757026|1.916823|1.905157|2.726091|2.211835|2.674791|3.001539|6.826116|4.509441|3.781450|3.951584|5.117637|7.883229|6.821470|7.919409|13.480497|36.858105| |1.103132|1.204223|1.211906|1.169699|1.212653|1.329888|2.541549|1.803505|1.437191|1.496480|1.637237|1.685528|1.838130|1.843733|2.303309|1.705562|1.575988|1.584459|1.722338|1.893661|1.879281|2.712432|2.241024|2.686131|3.139253|7.092788|5.098650|4.515952|5.137149|7.675771|13.428840|7.836765|6.842553|7.923436|14.013818|36.858105| |17.525651|8.754079|6.790036|5.551072|4.358793|4.540229|6.943783|5.226416|2.999368|2.804991|2.292103|2.110826|1.808084|1.673301|2.163156|1.492206|1.387942|1.313845|1.323375|1.410700|1.505137|2.204952|1.643806|1.488168|1.479882|2.400500|1.304914|1.356189|1.282298|1.184087|1.146475|1.196826|1.145210|1.063785|1.027663|1.061765|0.500000| |17.552914|8.816131|5.443424|4.593819|4.195575|4.086846|6.865607|4.524979|2.723217|2.606950|2.175272|2.034298|1.756686|1.639718|2.102379|1.465820|1.361212|1.300991|1.325294|1.419244|1.499703|2.198166|1.664986|1.510174|1.523085|2.464394|1.350126|1.419588|1.348556|1.237346|1.186954|1.232866|1.169399|1.084193|1.052274|1.094674|0.301965|0.500000| |17.559936|8.724999|6.578658|6.595903|5.832103|4.433612|7.163480|4.863063|2.845126|2.587618|2.160429|1.968428|1.712161|1.576840|2.022422|1.397640|1.296665|1.232572|1.249406|1.337091|1.421202|2.092170|1.581583|1.451363|1.463565|2.389356|1.312127|1.373927|1.310595|1.209983|1.163835|1.205989|1.147439|1.068113|1.038218|1.078059|0.301668|0.302650|0.500000| |8.823661|17.602268|8.845538|6.627966|6.661711|6.972670|12.913519|6.407390|3.721810|3.406497|2.753264|2.471411|2.096436|1.900341|2.380143|1.634347|1.487975|1.409686|1.444501|1.574509|1.687549|2.538576|1.958517|1.773451|1.805635|2.895247|1.585311|1.677605|1.581508|1.436419|1.372666|1.431965|1.347866|1.239059|1.199677|1.253837|0.172496|0.210799|0.210591|0.500000| |8.892630|17.529403|8.905907|5.430389|4.613892|7.123305|11.501644|7.077820|3.998629|3.886408|3.006000|2.749477|2.265247|2.067074|2.606908|1.785952|1.626351|1.532824|1.561533|1.697887|1.830054|2.741226|2.077911|1.839530|1.836426|2.914163|1.573187|1.647926|1.535291|1.395412|1.345056|1.416698|1.343311|1.231354|1.183049|1.228623|0.209133|0.216906|0.172969|0.305760|0.500000| |6.859148|8.917699|17.492684|8.943377|5.450129|8.946903|10.543751|10.369010|4.837275|4.115127|3.108880|2.693084|2.233978|1.993178|2.550360|1.712762|1.566906|1.455922|1.456845|1.568844|1.712734|2.561471|1.897188|1.705849|1.676071|2.703088|1.452850|1.496005|1.397257|1.289007|1.258042|1.326885|1.275370|1.178167|1.128828|1.161229|0.205610|0.141554|0.164089|0.174499|0.215915|0.500000| |4.631350|5.433163|8.861488|17.521514|8.873869|7.113473|9.669558|8.732366|4.585497|3.504595|2.850064|2.390642|2.064570|1.816357|2.313887|1.549031|1.417108|1.318353|1.320945|1.423313|1.551751|2.331346|1.744714|1.613878|1.604259|2.632788|1.430156|1.471752|1.389511|1.291972|1.260674|1.319542|1.268758|1.179867|1.136902|1.170232|0.124709|0.102610|0.135469|0.138167|0.123654|0.216947|0.500000| |6.691485|6.620602|8.858111|17.549751|8.861988|5.546718|8.080272|6.327856|3.487332|2.923755|2.410635|2.108675|1.831783|1.649370|2.115319|1.437241|1.326813|1.246152|1.252376|1.341874|1.445581|2.146207|1.609091|1.485831|1.485024|2.437763|1.331648|1.379280|1.310673|1.217797|1.181727|1.229808|1.178721|1.098977|1.063976|1.098401|0.177789|0.136103|0.221852|0.159965|0.138021|0.222254|0.305273|0.500000| |4.203581|4.586391|5.401752|8.835630|17.546687|4.677550|7.934182|5.324503|3.252157|2.679876|2.313708|2.002736|1.782409|1.592871|2.019362|1.373836|1.261938|1.189867|1.205164|1.299517|1.396180|2.089431|1.594687|1.502201|1.528350|2.534904|1.402792|1.463720|1.405696|1.307639|1.260319|1.300155|1.237502|1.156403|1.127833|1.171534|0.103843|0.098861|0.136329|0.135619|0.102398|0.123674|0.216969|0.212758|0.500000| |5.834578|6.576172|6.521962|8.746077|17.564307|5.236021|9.316563|5.410780|3.244047|2.785388|2.362041|2.081096|1.828170|1.648230|2.079476|1.424822|1.306421|1.237957|1.262150|1.365861|1.460616|2.186656|1.682348|1.567363|1.604388|2.632379|1.457960|1.536787|1.472574|1.356000|1.296979|1.338514|1.264471|1.175066|1.146368|1.197123|0.129352|0.136026|0.195713|0.220191|0.135035|0.137442|0.173023|0.212198|0.302409|0.500000| |4.360065|5.533905|6.666388|8.751341|17.592729|6.714407|12.630193|6.821528|4.138599|3.326616|2.808223|2.380179|2.081354|1.832798|2.286842|1.546478|1.402867|1.318431|1.343116|1.464956|1.584945|2.408099|1.860226|1.737726|1.776924|2.910446|1.604858|1.684459|1.601516|1.472295|1.414071|1.468269|1.387672|1.283790|1.246749|1.300335|0.104685|0.103642|0.129384|0.177398|0.124134|0.137670|0.208369|0.172900|0.301155|0.302357|0.500000| |3.895602|4.933511|7.487608|5.800816|4.291292|9.392975|10.889707|26.104509|9.018170|6.305073|4.351057|3.455525|2.779813|2.376230|3.021699|1.967154|1.772387|1.613942|1.599746|1.734549|1.939608|2.953342|2.154304|1.927574|1.857661|2.986836|1.582192|1.605627|1.480735|1.369277|1.351898|1.442970|1.399006|1.286641|1.220415|1.246493|0.111701|0.091487|0.099527|0.118364|0.135924|0.241410|0.183343|0.134423|0.103556|0.102946|0.121938|0.500000| |2.738428|3.344319|4.269468|3.820903|3.340031|5.803873|9.017459|12.598798|17.555930|8.822237|6.825838|4.517284|3.639349|2.889180|3.598183|2.255527|1.986263|1.774764|1.752182|1.923362|2.206845|3.457418|2.504181|2.260109|2.140461|3.445329|1.798219|1.794323|1.632995|1.514561|1.514484|1.638241|1.602292|1.464585|1.373654|1.393275|0.076051|0.067981|0.072008|0.088062|0.093835|0.119481|0.120598|0.090482|0.084517|0.081044|0.101638|0.228211|0.500000| |2.930793|3.757008|4.679379|4.141440|3.888324|7.303737|13.440399|12.604128|17.620465|8.850090|6.875297|4.542207|3.658529|2.897295|3.481742|2.222676|1.936750|1.756258|1.770500|1.975367|2.248251|3.594307|2.725656|2.465778|2.404468|3.825391|2.013762|2.043376|1.853525|1.695319|1.674546|1.807768|1.736920|1.573062|1.482372|1.521674|0.078156|0.073251|0.077210|0.104146|0.104557|0.118863|0.124471|0.094086|0.095271|0.094206|0.127267|0.182283|0.302761|0.500000| |3.063044|3.976178|4.390132|3.445582|3.147345|6.294598|11.738911|9.576492|8.921796|17.552186|8.838245|6.851699|4.524862|3.655612|4.294353|2.737908|2.334887|2.105059|2.136395|2.423280|2.803124|4.564040|3.423658|2.849990|2.706360|4.115429|2.118716|2.156264|1.914358|1.724395|1.700665|1.860086|1.780943|1.592084|1.488030|1.528913|0.082677|0.079159|0.076462|0.106982|0.124482|0.117183|0.095715|0.082655|0.075925|0.082047|0.096660|0.156497|0.174088|0.213038|0.500000| |2.834093|3.480208|4.022768|3.238804|2.824177|5.223424|8.410193|9.487770|8.865261|17.506189|8.838126|6.847380|4.523196|3.662525|4.545099|2.813466|2.433001|2.144618|2.111566|2.337833|2.736461|4.315574|3.026321|2.554430|2.352253|3.662436|1.875883|1.872880|1.676709|1.537467|1.536310|1.680252|1.640173|1.482769|1.380472|1.401028|0.079861|0.072380|0.071133|0.089419|0.106954|0.117004|0.093460|0.079822|0.069900|0.072661|0.083602|0.181014|0.211980|0.173818|0.302870|0.500000| |2.169240|2.572122|2.932727|2.607894|2.415335|3.711308|6.508064|6.278670|6.870254|8.838625|17.496396|8.864235|6.890931|4.584825|5.454745|3.152701|2.638963|2.270881|2.223822|2.495891|3.025058|4.987104|3.446799|3.026521|2.700729|4.261852|2.137382|2.073748|1.832630|1.696605|1.729139|1.924283|1.910426|1.716762|1.573219|1.578095|0.060039|0.056135|0.056577|0.069406|0.075145|0.081625|0.077138|0.064495|0.061882|0.061670|0.073210|0.117418|0.205039|0.170883|0.173371|0.211326|0.500000| |2.268286|2.756000|3.069332|2.714879|2.610440|4.047684|7.739345|6.314917|6.914382|8.862718|17.497932|8.853820|6.878999|4.563456|5.030528|3.044313|2.513096|2.222386|2.250940|2.597911|3.111993|5.373122|4.064466|3.550789|3.275650|5.021735|2.516962|2.477849|2.155180|1.957110|1.972742|2.207073|2.141892|1.891698|1.737067|1.766779|0.061248|0.059155|0.059186|0.076766|0.080578|0.081768|0.078477|0.066019|0.065997|0.067148|0.081574|0.110036|0.170607|0.208227|0.211627|0.173551|0.303609|0.500000| |2.222969|2.654792|2.769870|2.358774|2.237892|3.420468|6.445727|5.037317|4.552197|6.892081|8.860056|17.517105|8.798712|6.863951|6.951140|4.217319|3.289091|2.874383|2.955737|3.551804|4.475036|8.273878|5.916999|4.253225|3.675070|5.282902|2.571078|2.534576|2.160334|1.936628|1.948785|2.205527|2.136434|1.866137|1.701944|1.731585|0.060598|0.059553|0.056613|0.072947|0.081637|0.075605|0.065852|0.059092|0.056208|0.059653|0.067574|0.092551|0.111870|0.120890|0.207228|0.171184|0.173791|0.211418|0.500000| |2.124302|2.482509|2.660762|2.282664|2.107645|3.200433|5.666404|5.001461|4.524432|6.836790|8.834481|17.545110|8.886442|6.976640|8.260925|4.534270|3.595203|2.986591|2.899715|3.309803|4.238947|7.064756|4.387937|3.436279|2.917365|4.426557|2.173610|2.109188|1.837637|1.685040|1.715193|1.926267|1.909931|1.700399|1.549209|1.554884|0.059272|0.056343|0.054200|0.066388|0.075762|0.075258|0.064920|0.057870|0.053521|0.055617|0.062485|0.096471|0.119776|0.111844|0.169910|0.205158|0.211773|0.173479|0.304001|0.500000| |1.749803|2.007663|2.166528|1.957637|1.861433|2.572170|4.651294|3.960935|3.647941|4.526838|6.838526|8.842001|17.597412|9.133103|10.115473|4.918486|3.768084|3.056105|2.943752|3.382488|4.477262|7.777455|4.688371|4.101601|3.283076|5.157149|2.457008|2.285743|1.970712|1.837743|1.923278|2.209266|2.258579|1.999260|1.779044|1.752476|0.048386|0.046453|0.045778|0.054889|0.059104|0.060204|0.056490|0.049735|0.048326|0.048833|0.055686|0.076225|0.102942|0.097883|0.111709|0.120272|0.206729|0.170212|0.173319|0.213773|0.500000| |1.799083|2.089942|2.219441|2.002455|1.947758|2.677061|5.045481|3.972180|3.660865|4.530606|6.863433|8.800016|17.542765|8.900430|7.945568|4.510844|3.412363|2.929361|2.994985|3.632499|4.745602|9.475558|6.726006|5.812390|4.525805|6.724654|3.097389|2.869385|2.393029|2.186593|2.281371|2.677171|2.679013|2.297514|2.031447|2.026516|0.048967|0.048070|0.047104|0.058286|0.061562|0.060235|0.057054|0.050433|0.050256|0.051438|0.059171|0.074112|0.097863|0.103889|0.120071|0.111716|0.171849|0.207327|0.209150|0.173726|0.303280|0.500000| |1.352163|1.475915|1.516777|1.379127|1.311355|1.667089|2.973852|2.432445|1.971704|2.298967|2.591090|3.180783|3.612281|4.748629|9.184158|8.883971|17.729066|8.872725|5.598741|4.875135|5.623231|5.965718|3.310532|2.967562|2.413179|3.939144|1.918103|1.782499|1.575947|1.498353|1.577239|1.782412|1.862275|1.698656|1.517640|1.472935|0.037922|0.036881|0.035298|0.040047|0.043860|0.042922|0.038872|0.036352|0.034388|0.035395|0.037971|0.048788|0.054661|0.052338|0.062162|0.066423|0.072100|0.066697|0.084218|0.096157|0.101199|0.087383|0.500000| |1.239554|1.339990|1.351808|1.234489|1.186940|1.467016|2.644246|2.091005|1.662075|1.904757|2.088166|2.494043|2.746314|3.483319|5.614117|5.677153|8.951742|17.716988|8.898066|5.624857|4.992913|5.019389|3.028618|2.796341|2.345347|3.871896|1.907405|1.778095|1.581429|1.507711|1.585207|1.781648|1.856743|1.701126|1.527032|1.483905|0.034580|0.034197|0.032422|0.036648|0.039800|0.037973|0.034447|0.032715|0.031171|0.032370|0.034280|0.041766|0.045448|0.044729|0.052877|0.054244|0.056812|0.055211|0.069341|0.072694|0.073898|0.070234|0.213760|0.500000| |1.266975|1.375990|1.369720|1.248571|1.215174|1.491962|2.735362|2.089585|1.657975|1.901457|2.079275|2.487077|2.726974|3.455548|4.990900|4.969666|5.628832|8.891320|17.715665|8.966420|5.699987|5.597821|3.621512|3.376890|2.860737|4.657043|2.276720|2.123886|1.863657|1.757626|1.841918|2.089257|2.146525|1.930499|1.729559|1.697619|0.034977|0.035215|0.033126|0.038065|0.040958|0.038012|0.034554|0.032973|0.031803|0.033368|0.035280|0.041215|0.044599|0.045269|0.054018|0.053048|0.055168|0.056217|0.071973|0.069901|0.070367|0.072315|0.123639|0.215999|0.500000| |1.425917|1.577089|1.566888|1.417617|1.390685|1.740919|3.253525|2.422397|1.952848|2.280468|2.548305|3.138678|3.508815|4.583841|5.850614|5.574860|4.874413|5.600511|8.899127|17.719280|8.805443|8.938901|6.312639|5.563128|4.425293|6.632263|3.074953|2.851430|2.385641|2.183293|2.277802|2.667190|2.669457|2.294260|2.031028|2.025972|0.038957|0.039590|0.037179|0.044072|0.047143|0.042958|0.039116|0.037024|0.036134|0.038176|0.040856|0.046962|0.051686|0.054014|0.065966|0.062067|0.065667|0.070263|0.094640|0.084355|0.085443|0.095951|0.106202|0.123823|0.215319|0.500000| |1.843676|2.141830|2.175036|1.932299|1.906245|2.578819|5.013773|3.613734|3.110687|3.858146|4.756423|6.260681|6.995530|7.072372|6.601564|4.498256|3.418809|3.138060|3.479691|4.597740|5.702731|12.562676|17.613064|8.818651|6.873822|8.373413|3.745665|3.595550|2.855080|2.495452|2.538521|3.008655|2.864933|2.387743|2.130245|2.179985|0.049613|0.050265|0.047844|0.060633|0.064240|0.058320|0.053572|0.048954|0.048686|0.051546|0.057753|0.067062|0.079194|0.088796|0.115012|0.096597|0.110828|0.141296|0.216079|0.137994|0.140421|0.225909|0.083203|0.074078|0.084755|0.131542|0.500000| |1.690274|1.921446|1.909874|1.704008|1.682108|2.187991|4.199186|3.021412|2.490915|2.999131|3.431617|4.370272|4.764073|5.762654|6.120393|4.808849|3.753682|3.673285|4.443183|6.509556|7.076476|12.612531|17.570879|8.808797|6.898683|8.386785|3.753186|3.604375|2.861102|2.499814|2.542361|3.013178|2.867821|2.389733|2.132311|2.182645|0.045637|0.046723|0.043835|0.054286|0.057847|0.051583|0.046854|0.043810|0.043181|0.046064|0.050216|0.057167|0.064167|0.070015|0.089627|0.078548|0.083793|0.097514|0.144410|0.108502|0.105833|0.137849|0.087663|0.085137|0.108620|0.210955|0.304935|0.500000| |1.425446|1.596692|1.614788|1.482254|1.475027|1.831788|3.477992|2.561164|2.126043|2.438644|2.870966|3.419426|4.206055|5.041867|5.717676|4.543913|3.686379|3.649569|4.364392|5.977730|6.198440|9.519664|8.838388|17.570768|8.917090|13.137962|4.922305|4.056034|3.144653|2.874334|3.141866|4.040094|4.141950|3.266254|2.732254|2.696592|0.038610|0.039150|0.037557|0.045154|0.046974|0.043703|0.041270|0.038275|0.038502|0.040106|0.044003|0.048927|0.056525|0.060517|0.069545|0.063894|0.074293|0.083506|0.100274|0.085582|0.101391|0.129485|0.086823|0.085557|0.108212|0.185820|0.173363|0.210277|0.500000| |1.515946|1.719245|1.768355|1.627593|1.621896|2.046807|3.908319|2.897129|2.477449|2.841985|3.526519|4.130255|5.505563|5.827466|6.079396|4.260513|3.355138|3.112606|3.430087|4.382355|5.188353|9.457164|8.843640|17.559122|8.917943|13.125609|4.920199|4.058127|3.145603|2.873870|3.139596|4.035267|4.132793|3.259951|2.728587|2.694089|0.040978|0.041221|0.040042|0.048699|0.050286|0.047637|0.045703|0.041618|0.042316|0.043642|0.048901|0.054772|0.066077|0.071584|0.079732|0.072604|0.091275|0.106620|0.117263|0.097994|0.130245|0.193805|0.082205|0.074130|0.084329|0.124385|0.211483|0.173251|0.303422|0.500000| |1.649461|1.889856|1.903078|1.749486|1.785819|2.212153|4.386774|3.009211|2.518697|2.827612|3.282370|3.593378|3.985076|3.887584|4.247751|3.037473|2.531386|2.442745|2.742608|3.408258|3.671641|6.273021|6.853772|8.821558|17.531010|16.554427|7.101672|6.826299|4.592201|3.752318|3.782711|4.751271|4.088395|3.176921|2.830401|3.007645|0.043815|0.045222|0.043617|0.054807|0.055187|0.050158|0.048347|0.044446|0.046232|0.048634|0.054525|0.055836|0.064920|0.075047|0.083485|0.070360|0.081236|0.103507|0.110592|0.084673|0.093898|0.134802|0.063072|0.059864|0.070631|0.103994|0.204704|0.170330|0.173779|0.212505|0.500000| |1.534459|1.730104|1.714742|1.571828|1.594289|1.946444|3.800190|2.636074|2.150326|2.427957|2.732142|3.093690|3.397126|3.624848|4.118027|3.136392|2.666164|2.680087|3.159399|4.022815|3.985750|6.293323|6.856789|8.822184|17.531182|16.556166|7.101585|6.815017|4.588494|3.752048|3.784557|4.755288|4.093792|3.180580|2.832884|3.009573|0.040949|0.042525|0.040450|0.049879|0.050886|0.045608|0.043163|0.040425|0.041359|0.043858|0.047938|0.049655|0.055752|0.062511|0.071955|0.062317|0.068509|0.081891|0.095966|0.076246|0.081107|0.106433|0.065105|0.065467|0.083107|0.133057|0.169519|0.205761|0.212284|0.173776|0.301072|0.500000| |1.533554|1.726945|1.702745|1.588755|1.652326|1.922864|3.821984|2.549096|2.050529|2.218032|2.422382|2.558068|2.694591|2.680358|3.134466|2.309534|2.027447|2.021033|2.279992|2.699068|2.716111|4.206137|4.017490|4.690804|7.471307|12.579302|8.963951|17.765918|8.856012|5.654767|4.920183|5.589096|4.130432|3.281951|3.127537|3.600923|0.040420|0.042567|0.040898|0.050751|0.049946|0.044596|0.043415|0.040762|0.043080|0.045718|0.050108|0.047694|0.052966|0.061088|0.065978|0.056169|0.061175|0.074457|0.077986|0.063152|0.066579|0.084941|0.051155|0.050844|0.061102|0.084196|0.113592|0.113918|0.115673|0.115824|0.228427|0.227418|0.500000| |1.384631|1.531561|1.502740|1.432278|1.512551|1.658706|3.272574|2.177726|1.713287|1.793452|1.907487|1.954511|2.027024|2.001097|2.426258|1.787621|1.618237|1.624115|1.797323|2.035779|2.024149|3.015447|2.651428|2.979015|3.904486|7.454451|5.661299|8.859069|17.715153|9.025523|5.625774|4.922062|3.602381|3.132906|3.293001|4.151726|0.036374|0.038592|0.037406|0.045296|0.043612|0.039262|0.039041|0.037068|0.039954|0.042165|0.045561|0.041105|0.044708|0.051088|0.052796|0.045899|0.049210|0.057977|0.058188|0.049377|0.051754|0.062322|0.041569|0.041751|0.049033|0.062148|0.074788|0.074947|0.077858|0.077903|0.113823|0.113690|0.216218|0.500000| |1.192725|1.303873|1.294798|1.249601|1.313048|1.416691|2.744781|1.885896|1.485094|1.538733|1.649283|1.682936|1.779249|1.765441|2.183019|1.611717|1.481551|1.490610|1.630518|1.807311|1.790947|2.614586|2.210960|2.543385|3.120459|6.486227|4.916941|5.608688|9.000256|17.716369|8.810574|5.578641|4.143057|3.930228|4.692632|7.039939|0.031591|0.033086|0.032426|0.038173|0.036884|0.034125|0.034376|0.032551|0.035114|0.036362|0.039247|0.035972|0.039437|0.044010|0.044399|0.039768|0.043474|0.049712|0.048918|0.042981|0.046446|0.054378|0.038388|0.038715|0.044743|0.054347|0.061144|0.061243|0.068768|0.068760|0.086899|0.086892|0.124225|0.216243|0.500000| |1.209863|1.337247|1.361533|1.291045|1.311535|1.522346|2.892422|2.110944|1.729518|1.859858|2.129948|2.281311|2.662422|2.757429|3.383017|2.519797|2.261297|2.247130|2.470770|2.812641|2.844158|4.155031|3.446040|4.764432|5.142183|14.074111|7.034283|4.690863|3.938833|4.145072|5.596122|8.850263|17.767606|8.998794|5.630344|4.940073|0.032610|0.033140|0.032473|0.038208|0.038389|0.036566|0.036152|0.033469|0.034858|0.035604|0.039178|0.040474|0.046795|0.050378|0.052201|0.048362|0.057162|0.063758|0.064361|0.057711|0.070005|0.083555|0.057520|0.056914|0.065785|0.083059|0.088285|0.088351|0.140463|0.139993|0.122297|0.122496|0.110871|0.089804|0.095696|0.500000| |1.058567|1.155482|1.177762|1.131725|1.152973|1.297397|2.441829|1.796977|1.451344|1.528178|1.712832|1.793018|2.036318|2.084316|2.652269|1.972667|1.836072|1.836900|1.969248|2.137667|2.137511|3.027042|2.395545|2.965292|3.118770|7.132763|4.138278|3.286282|3.133844|3.595761|4.916779|5.619690|9.006789|17.717308|8.829851|5.651764|0.028599|0.029003|0.028619|0.032967|0.032898|0.031720|0.031761|0.029555|0.030951|0.031326|0.034195|0.034768|0.039680|0.042139|0.042585|0.040130|0.046729|0.050699|0.050012|0.046270|0.055053|0.062041|0.047810|0.047802|0.053430|0.061964|0.062874|0.062911|0.086670|0.086481|0.079484|0.079579|0.078771|0.074121|0.089621|0.216505|0.500000| 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