Version2.0 2020-07-30T06:21:03Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 22-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cccc(c1C)N2CCN(CC2)CN3C(=O)C4(CC[NH+](CC4)C)NC3=O C23652435 RHF 6-31G(d) (6D,7F) Cc1cccc(c1C)N2CCN(CC2)CN3C(=O)C4(CC[NH+](CC4)C)NC3=O C01[X(C21H32N5O2)] 174 C1 484 C[NH+]1CCC2(CC1)NC(=O)N(C2=O)CN1CCN(CC1)c1cccc(c1C)C C[NH+]1CCC2(CC1)NC(=O)N(C2=O)CN1CCN(CC1)c1cccc(c1C)C C[NH+]1CCC2(CC1)NC(=O)N(CN3CCN(CC3)c4cccc(C)c4C)C2=O InChIKey=BHKDYRBBWBFZIM-UHFFFAOYSA-O InChI=1S/C21H31N5O2/c1-16-5-4-6-18(17(16)2)25-13-11-24(12-14-25)15-26-19(27)21(22-20(26)28)7-9-23(3)10-8-21/h4-6H,7-15H2,1-3H3,(H,22,28)/p+1 InChI=1/C21H31N5O2/c1-16-5-4-6-18(17(16)2)25-13-11-24(12-14-25)15-26-19(27)21(22-20(26)28)7-9-23(3)10-8-21/h4-6H,7-15H2,1-3H3,(H,22,28)/p+1/fC21H32N5O2/h22-23H/q+1 Cc1cccc(c1C)N2CCN(CC2)CN3C(=O)C4(CC[NH+](CC4)C)NC3=O C01[X(C21H32N5O2)] 174 C01 484 C[NH+]1CCC2(CC1)NC(=O)N(C2=O)CN1CCN(CC1)c1cccc(c1C)C C[NH]1CCC2(CC1)NC(=O)N(C2=O)CN1CCN(CC1)[C]1[CH][CH][CH][C]([C]1C)C C[C]1[CH][CH][CH][C]([C]1C)N2CCN(CC2)CN3C(=O)NC4(CC[NH](C)CC4)C3=O InChIKey=HXGXTMVZBHCGTM-UHFFFAOYSA-N InChI=1S/C21H32N5O2/c1-16-5-4-6-18(17(16)2)25-13-11-24(12-14-25)15-26-19(27)21(22-20(26)28)7-9-23(3)10-8-21/h4-6,23H,7-15H2,1-3H3,(H,22,28) InChI=1/C21H32N5O2/c1-16-5-4-6-18(17(16)2)25-13-11-24(12-14-25)15-26-19(27)21(22-20(26)28)7-9-23(3)10-8-21/h4-6,23H,7-15H2,1-3H3,(H,22,28)/f/h22H 2689.5700303763 -1235.6714322 1-A 17543.7502 104 380 484 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.66761 -20.64660 -15.87522 -15.72036 -15.71748 -15.63178 -15.60870 -11.50119 -11.48325 -11.46598 -11.46237 -11.45792 -11.43865 -11.40171 -11.39629 -11.38676 -11.31673 -11.31639 -11.31078 -11.30861 -11.30580 -11.28097 -11.27981 -11.27383 -11.27229 -11.26897 -11.26119 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0.8332 0.6181 0.5778 0.8204 0.6579 0.6716 0.7187 0.7940 0.8569 0.8293 0.8275 0.2347 0.3864 0.3949 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 6 6 6 6 6 6 6 6 7 6 6 7 6 6 6 7 6 8 6 6 6 7 1 6 6 6 7 6 8 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 12.00000 12.00000 14.00307 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 4200.1655 28000.3871 29838.7758 0.99994 -0.01140 0.00010 0.01140 0.99971 0.02105 -0.00034 -0.02105 0.99978 1 0.02062 0.00309 0.00290 0.42968 0.06445 0.06048 11.48 19.75 35.59 51.53 62.86 93.66 107.44 115.91 160.00 172.29 228.63 231.90 261.68 280.59 299.94 317.93 328.82 331.21 345.30 377.56 390.58 403.88 405.99 500.83 510.72 516.36 528.46 545.41 557.31 567.59 591.60 645.37 681.13 689.39 729.67 768.07 768.65 773.30 794.27 812.93 834.20 869.96 930.81 947.09 954.69 995.77 1103.00 1119.98 1153.18 1168.05 1174.10 1220.38 1229.82 1245.67 1252.35 1277.33 1282.82 1317.62 1355.51 1371.03 1435.00 1454.74 1477.24 1492.07 1501.67 1544.42 1554.78 1563.02 1574.38 1584.21 1602.01 1622.27 1625.54 1636.85 1647.39 1659.41 1695.29 1701.42 1709.32 1722.14 1742.37 1764.07 1778.25 1786.12 1789.62 1807.68 1852.58 1863.52 1866.43 1868.30 1887.50 1905.83 1910.91 1931.16 1968.49 1983.69 2002.87 2010.59 2019.26 2071.55 2086.26 2094.34 2106.69 2134.26 2165.79 2169.90 2184.99 2191.66 2198.01 2207.17 2218.85 2234.02 2238.85 2257.46 2262.87 2271.05 2274.17 2291.75 2292.69 2312.09 2315.85 2318.40 2333.64 2337.91 2345.90 2346.37 2351.24 2358.20 2362.82 2365.92 2367.29 2369.58 2372.93 2378.63 2381.75 2384.02 2388.77 2396.84 2571.41 2586.74 2873.73 2971.99 4505.72 4528.43 4540.32 4548.61 4607.52 4614.45 4658.06 4666.95 4672.02 4684.73 4688.67 4692.32 4694.42 4701.85 4704.64 4708.12 4710.12 4713.04 4729.03 4737.44 4749.70 4789.45 4794.87 4795.83 4807.56 4824.81 4840.89 4841.92 4843.03 4866.26 5296.62 5581.60 0.567247 0.592344 0.593288 0.508787 -1235.104186 -1235.079089 -1235.078144 -1235.162645 2.834177D-04 MUNgauss RevisionA2.0 retrievium 30-Jul-2020 DUDE Cc1cccc(c1C)N2CCN(CC2)CN3C(=O)C4(CC[NH+](CC4)C)NC3=O C23652435 RHF 6-31G(d) (6D,10F) C1 386.255601 |X|Y|Z| 122.114492 42.732846 28.375065 52.904015 23 6 7 18 5 |36.858105| |12.597664|36.858105| |7.606982|13.754518|36.858105| |5.027630|7.899881|13.749905|36.858105| |4.442510|6.862045|7.983413|13.826500|36.858105| |5.005345|7.899667|6.883009|7.915278|13.676118|36.858105| |7.514078|13.559819|7.893502|6.811761|7.881669|13.659232|36.858105| |6.519480|7.556142|5.020896|4.421270|4.995115|7.509131|12.597546|36.858105| |3.823329|5.111301|4.533084|5.127382|7.778266|13.277243|7.783881|6.575418|53.358707| |3.204015|4.077002|3.816288|4.404408|6.272906|7.826532|5.449847|4.858413|17.861581|36.858105| |2.678750|3.198585|2.964995|3.280639|4.247362|5.087690|4.093672|4.075358|10.653513|12.524958|36.858105| |2.455689|2.907064|2.736309|3.051447|3.912915|4.508175|3.636893|3.603023|9.168255|7.811873|13.067974|53.358707| |2.704343|3.221741|2.970140|3.267444|4.214487|5.094694|4.137019|4.156009|10.660604|6.694872|7.897607|17.785534|36.858105| |3.249700|4.126856|3.827433|4.370945|6.162914|7.850159|5.556683|5.001888|17.870796|7.925491|6.683378|10.612831|12.528120|36.858105| |2.105716|2.408559|2.273702|2.481915|3.023510|3.385399|2.904097|2.965943|6.162833|5.090130|7.862303|18.097764|7.871879|5.088380|36.858105| |1.888275|2.150082|2.077395|2.290911|2.740855|2.929604|2.515825|2.505367|5.028282|4.047203|5.293356|10.815041|5.942173|4.310330|12.975541|53.358707| |1.780635|2.031342|2.000580|2.233814|2.647986|2.733260|2.333319|2.272567|4.533271|3.787526|4.672913|8.311319|4.589075|3.738401|7.667747|19.102666|36.858105| |1.789607|2.047877|2.028999|2.278092|2.699488|2.757197|2.343150|2.262214|4.530598|3.991737|4.896328|7.774729|4.138921|3.545935|6.536589|11.307339|16.032461|73.516695| |1.619109|1.829092|1.820054|2.025629|2.345934|2.374372|2.058567|1.996313|3.787064|3.016052|3.469108|5.928268|3.723245|3.174694|5.074222|11.113266|12.421020|14.051733|36.858105| |1.639813|1.868758|1.895722|2.146286|2.475262|2.424832|2.077213|1.965788|3.771351|2.976159|3.217973|5.339749|3.484133|3.178222|4.085037|7.659683|7.609826|11.199074|12.389832|36.858105| |1.477159|1.661099|1.693150|1.896066|2.130717|2.073787|1.814362|1.722998|3.135769|2.418723|2.564247|4.106588|2.802455|2.612156|3.146598|5.534160|4.916168|7.665813|7.484395|12.501921|36.858105| |1.350480|1.502971|1.525991|1.690354|1.880150|1.842359|1.633705|1.566687|2.773304|2.166024|2.323372|3.616649|2.429404|2.249032|2.845785|4.903117|4.415323|7.202733|6.444778|7.641747|12.665314|53.358707| |1.354399|1.510651|1.540209|1.712987|1.904017|1.853802|1.638771|1.564026|2.781441|2.204874|2.353135|3.596679|2.376612|2.222278|2.801149|4.730112|4.395748|7.593461|5.918144|7.177937|9.323832|25.679927|0.500000| |1.335587|1.478244|1.482174|1.625549|1.816315|1.814020|1.619694|1.576990|2.768729|2.170399|2.398280|3.762478|2.496490|2.240510|3.103735|5.494564|4.919340|7.729862|7.506859|6.517922|7.673642|17.220394|0.258923|36.858105| |1.450003|1.616218|1.609709|1.771870|2.011866|2.031105|1.795263|1.753790|3.170412|2.541535|2.901986|4.629810|2.933895|2.560821|3.983806|7.530490|7.602671|11.405212|12.410996|7.595295|6.515931|10.418897|0.200156|12.520088|36.858105| |1.239768|1.367728|1.392889|1.531417|1.677008|1.637185|1.469959|1.411391|2.423797|1.866674|1.972798|3.018766|2.077592|1.952998|2.346263|3.876876|3.293510|5.469018|4.360659|4.975051|7.668282|17.379085|0.260270|7.661798|4.979359|36.858105| |1.627087|1.825173|1.795638|1.973667|2.279677|2.349782|2.063175|2.031702|3.766709|2.881741|3.336557|5.905891|3.969168|3.255845|5.234450|11.684670|8.295630|9.828522|13.193542|7.602066|5.984870|6.890855|0.122803|6.038337|7.663869|3.847852|53.358707| |1.782681|2.007135|1.942628|2.123467|2.492875|2.645293|2.316044|2.316842|4.391629|3.324257|4.028841|7.713305|5.202522|3.891292|7.530154|18.694504|8.376297|9.880404|8.133734|5.604310|4.352410|5.120358|0.096115|4.291154|5.450305|3.020947|18.846936|36.858105| |1.809751|2.019363|1.932091|2.082541|2.427426|2.618538|2.335020|2.377994|4.324997|3.137856|3.743532|7.005091|5.308289|3.895081|6.470306|11.267106|5.581841|7.483557|5.471430|4.304206|3.611800|4.296967|0.080579|3.534388|4.159106|2.658333|11.336500|16.072697|73.516695| |17.544993|8.809845|5.891487|4.293433|3.967256|4.572475|6.676269|6.614015|4.988055|3.011059|2.587183|3.294643|2.724036|3.234397|2.093224|2.557117|1.753718|3.100984|1.603454|1.616117|1.461463|1.816079|0.036974|1.324154|1.433656|1.227673|2.217993|1.793577|3.274363|0.500000| |17.543939|8.810855|5.909030|4.300820|3.967735|4.565916|6.655395|6.570892|4.976360|3.169671|2.685295|3.282188|2.606144|3.043920|2.086131|2.523224|1.748907|3.144203|1.579975|1.586554|1.427104|1.789337|0.036710|1.307316|1.424636|1.205587|2.154899|1.737650|3.129315|0.302805|0.500000| |17.590015|8.859780|7.362555|4.796336|3.994491|4.176242|5.554655|4.769700|4.433662|2.814216|2.374966|2.993546|2.393558|2.846360|1.907219|2.362176|1.652920|2.959467|1.517556|1.548165|1.406510|1.754252|0.035954|1.268208|1.367136|1.190210|2.068261|1.646832|2.961937|0.302100|0.302151|0.500000| |7.091975|8.941831|17.709923|8.933224|5.670543|4.956609|5.625556|4.096513|4.912593|3.156143|2.545500|3.228567|2.549598|3.164137|2.015816|2.536792|1.806798|3.259006|1.662856|1.736328|1.570547|1.938096|0.039942|1.379617|1.485617|1.310656|2.232574|1.757293|3.110234|0.153328|0.154028|0.228868|0.500000| |4.103166|5.630043|8.906456|17.713997|8.927827|5.631499|4.919873|3.538190|5.659914|3.781120|2.920581|3.757998|2.901644|3.738452|2.289634|2.937795|2.139579|3.894799|1.967522|2.117300|1.889957|2.293646|0.047616|1.603208|1.732027|1.535574|2.587397|2.012172|3.484297|0.099512|0.099720|0.114223|0.215350|0.500000| |3.551687|4.945897|5.665380|8.949678|17.712022|8.907040|5.623482|4.075933|9.752885|6.547306|4.454677|5.745874|4.379991|6.306456|3.222354|4.063491|2.944883|5.376016|2.602664|2.807647|2.380014|2.823945|0.058654|1.981935|2.204456|1.833203|3.381935|2.688067|4.563720|0.090331|0.090336|0.090867|0.124534|0.215369|0.500000| |6.694214|6.765852|4.615192|3.967639|4.279432|5.835897|8.838556|17.541721|7.069256|4.306953|3.699351|4.342565|3.501878|4.008478|2.702232|3.118837|2.103199|3.763999|1.849345|1.815046|1.600586|2.002521|0.040963|1.484383|1.648221|1.330412|2.543073|2.110527|3.827050|0.179024|0.218613|0.135907|0.108804|0.090367|0.099034|0.500000| |6.579279|6.706798|4.594968|3.965726|4.292807|5.871810|8.835476|17.533076|7.148131|3.954205|3.473476|4.396206|3.827964|4.505752|2.730944|3.197992|2.120692|3.706096|1.894787|1.866975|1.655303|2.046923|0.041467|1.514145|1.668172|1.364351|2.659000|2.222480|4.118695|0.215934|0.174212|0.134422|0.108207|0.090322|0.099434|0.303136|0.500000| |4.773690|5.573110|4.176366|3.959436|4.734563|7.230782|8.863025|17.667676|10.734857|5.682324|4.983059|5.891421|5.086797|5.844837|3.499221|3.881744|2.533268|4.459199|2.186363|2.119981|1.835999|2.270286|0.046168|1.693724|1.905612|1.490221|3.045610|2.603934|4.769602|0.134753|0.134614|0.104678|0.096084|0.090165|0.112673|0.301656|0.301566|0.500000| |2.942274|3.748427|3.728697|4.555594|6.567005|6.767853|4.669008|3.982882|12.216582|17.447076|8.914772|9.523375|5.811274|7.012688|4.755806|5.550697|4.030936|7.753946|3.221754|3.294524|2.635870|3.179069|0.066693|2.297821|2.690705|1.997329|4.059964|3.338596|5.457183|0.076375|0.079752|0.073622|0.086646|0.112839|0.219696|0.099523|0.093666|0.122288|0.500000| |3.388841|4.277315|3.948217|4.409721|5.900242|7.309892|5.621733|5.049140|12.516751|17.593437|8.903141|7.692331|4.997410|5.718531|4.189332|4.622845|3.240745|6.183750|2.634221|2.596834|2.159199|2.679326|0.055977|1.974723|2.289498|1.715850|3.415287|2.841573|4.806287|0.086353|0.095811|0.082355|0.090993|0.104590|0.160209|0.131708|0.110378|0.158626|0.301214|0.500000| |2.407950|2.827602|2.679834|2.972999|3.721703|4.183372|3.461129|3.409436|7.705507|8.907255|17.577870|12.494160|5.704823|4.996561|7.288442|7.148413|5.004828|10.145075|3.591211|3.297150|2.609773|3.279668|0.068773|2.499852|3.080091|2.029142|4.508785|3.867835|6.179004|0.064126|0.067572|0.060247|0.065016|0.075299|0.110612|0.088962|0.081900|0.110849|0.219934|0.212415|0.500000| |2.748696|3.199267|2.869983|3.055978|3.824057|4.772930|4.139432|4.450883|9.526437|8.889127|17.450972|12.234540|6.996161|5.798863|6.891193|6.240395|3.943974|7.185372|3.045090|2.786829|2.286928|2.859793|0.058767|2.192728|2.617529|1.809776|4.102710|3.663357|6.297081|0.074416|0.077877|0.066909|0.068819|0.074954|0.106236|0.114073|0.104472|0.159085|0.174442|0.218626|0.300111|0.500000| |2.440505|2.854620|2.684538|2.952409|3.677521|4.185901|3.506099|3.494123|7.700820|4.994406|5.696383|12.449991|17.582677|8.887372|7.294419|8.833090|4.817655|7.280904|4.114300|3.831822|3.087482|3.565916|0.069948|2.697015|3.140656|2.234899|6.336806|6.371536|12.199682|0.068934|0.064837|0.060927|0.065129|0.074472|0.107818|0.083059|0.092748|0.113549|0.130329|0.109557|0.127728|0.142594|0.500000| |2.776057|3.221198|2.872691|3.042356|3.795627|4.774885|4.183288|4.559893|9.527578|5.810044|7.019647|12.281172|17.451707|8.884330|6.923370|6.844700|3.895389|6.333383|3.228103|2.968602|2.464528|2.974219|0.059302|2.273829|2.644847|1.896153|4.759827|4.562268|8.748207|0.078904|0.075177|0.067435|0.068882|0.074463|0.104771|0.106198|0.118238|0.163702|0.133197|0.130410|0.142944|0.205941|0.301690|0.500000| |3.481875|4.374198|3.965283|4.346642|5.735488|7.332442|5.823711|5.337291|12.516007|5.717446|4.994668|7.685438|8.905169|17.590916|4.191099|4.997130|3.189082|5.325809|2.821064|2.835096|2.406865|2.828736|0.056614|2.067650|2.314286|1.834829|4.032390|3.497710|6.472219|0.099289|0.088490|0.084132|0.091338|0.102477|0.152247|0.114576|0.142372|0.166857|0.142810|0.128129|0.109612|0.130336|0.212362|0.218474|0.500000| |2.984907|3.798045|3.748917|4.529431|6.457541|6.806065|4.750935|4.071388|12.235611|7.008968|5.786660|9.468037|8.887578|17.425647|4.739310|5.928127|3.957282|6.678964|3.424977|3.590973|2.909089|3.328614|0.067280|2.384305|2.710510|2.110178|4.672613|3.956419|6.802854|0.081496|0.077054|0.074538|0.087057|0.111564|0.208276|0.094363|0.103495|0.124583|0.205489|0.142905|0.130193|0.132741|0.218231|0.174083|0.301271|0.500000| |2.018657|2.289456|2.164834|2.350516|2.826183|3.139510|2.731290|2.800907|5.555013|4.867126|7.765737|12.537837|5.776654|4.240321|17.661873|12.640523|7.189981|12.505738|4.670943|3.753849|2.936841|3.739115|0.076437|3.027003|3.944197|2.269130|6.153482|5.806335|8.867540|0.055295|0.056208|0.050962|0.053631|0.060525|0.083334|0.072575|0.070958|0.091049|0.126530|0.116867|0.236919|0.195647|0.144892|0.150099|0.098569|0.110792|0.500000| |2.076256|2.336061|2.174660|2.327711|2.788411|3.173436|2.813127|2.966140|5.663463|4.358673|6.239882|12.255271|7.494318|4.723354|17.590795|12.644359|5.768504|8.700699|4.370947|3.539259|2.857399|3.548100|0.070313|2.874039|3.563543|2.195805|6.646526|7.318583|13.099008|0.058082|0.057234|0.052076|0.053814|0.059422|0.080608|0.074984|0.077276|0.098107|0.110057|0.102990|0.154570|0.173465|0.203091|0.212527|0.114171|0.117765|0.300955|0.500000| |1.767668|2.035517|2.071263|2.369552|2.766656|2.693724|2.274514|2.129707|4.206546|3.244834|3.431219|5.865535|3.966327|3.678563|4.253516|7.748979|6.822938|9.968929|8.786730|17.580867|8.951748|7.588476|0.145308|4.893243|5.513775|4.136921|9.657021|5.802938|8.162709|0.048487|0.047128|0.046242|0.052354|0.064779|0.088236|0.053981|0.056282|0.063786|0.100599|0.077117|0.094660|0.081688|0.124378|0.091218|0.090817|0.119640|0.104375|0.102538|0.500000| |1.649861|1.888023|1.930260|2.203692|2.541208|2.455903|2.090614|1.960307|3.791369|3.080376|3.285536|5.231750|3.311054|3.097543|3.900440|6.870887|7.210940|12.521470|8.876707|17.554673|8.857246|9.325386|0.209593|5.687118|6.815126|4.607551|7.638837|4.608546|6.480679|0.044787|0.044482|0.043371|0.049132|0.060798|0.081028|0.050603|0.051251|0.058483|0.097083|0.075289|0.096111|0.078032|0.097226|0.078551|0.075842|0.097662|0.103271|0.092029|0.303407|0.500000| |1.454509|1.626619|1.648927|1.831070|2.049667|2.012786|1.776307|1.699394|3.041307|2.298861|2.444146|3.957245|2.780196|2.568189|3.059132|5.373466|4.449461|6.720455|6.680200|8.733332|17.603778|12.436575|0.182114|7.022551|5.733215|7.099711|8.723791|4.530399|6.885073|0.040247|0.038948|0.038448|0.042550|0.050485|0.062879|0.043718|0.045736|0.050318|0.068472|0.056984|0.068008|0.061342|0.086938|0.068519|0.066784|0.078674|0.078074|0.079153|0.212824|0.172578|0.500000| |1.468181|1.653713|1.704663|1.920641|2.137744|2.045065|1.788046|1.679507|3.037625|2.331676|2.408347|3.778053|2.612251|2.511984|2.805439|4.712321|4.091158|6.696509|5.464512|8.801083|17.626691|12.359047|0.223916|5.605522|4.893881|7.187484|6.228531|3.617668|5.525708|0.040229|0.039256|0.039052|0.044123|0.053788|0.066728|0.043379|0.044854|0.049255|0.071318|0.058171|0.067909|0.059649|0.079013|0.063871|0.064698|0.078653|0.073114|0.070920|0.212325|0.214881|0.301975|0.500000| |1.319889|1.455081|1.453349|1.585241|1.766989|1.774775|1.594146|1.560665|2.706875|2.085677|2.303535|3.654855|2.485678|2.215971|3.028416|5.357471|4.469304|6.783458|6.735511|5.763604|7.035550|12.411046|0.181941|17.606231|8.757467|7.062962|8.870411|4.481060|6.740187|0.036554|0.035810|0.034797|0.037612|0.043312|0.053195|0.040684|0.041919|0.046573|0.060695|0.052608|0.065595|0.059087|0.075859|0.063333|0.057468|0.065132|0.080486|0.079839|0.129312|0.132523|0.212762|0.144138|0.500000| |1.253181|1.378177|1.381775|1.506861|1.669544|1.667355|1.501414|1.466626|2.523758|1.984192|2.184867|3.345949|2.221752|2.010345|2.751824|4.666068|4.087614|6.755975|5.471399|4.888160|5.607603|12.359001|0.223627|17.627980|8.798744|7.198827|6.280322|3.556400|5.377330|0.034473|0.034198|0.033146|0.035894|0.041369|0.050291|0.038612|0.039131|0.043597|0.058089|0.050786|0.063732|0.056056|0.065722|0.056953|0.051778|0.058926|0.076109|0.071418|0.107710|0.127530|0.144211|0.126592|0.301530|0.500000| |1.447503|1.616450|1.617219|1.786698|2.026090|2.031020|1.790286|1.739147|3.154266|2.583053|2.932551|4.523711|2.804915|2.492925|3.802215|6.761193|7.186752|12.794425|8.869741|6.810524|5.696411|9.353434|0.210929|8.851475|17.555668|4.617090|7.667428|4.512102|6.308085|0.039502|0.039637|0.037979|0.041496|0.048697|0.061953|0.045674|0.045629|0.052331|0.076858|0.065248|0.088769|0.072912|0.081231|0.070235|0.062091|0.073481|0.108548|0.092509|0.139371|0.199847|0.132215|0.127992|0.172675|0.214083|0.500000| |1.418493|1.569515|1.548855|1.687289|1.911309|1.956688|1.748214|1.731515|3.067727|2.451260|2.855379|4.528766|2.873644|2.461158|4.070188|7.541561|6.829514|10.231991|8.825934|5.520916|4.892826|7.598776|0.145744|8.970557|17.595808|4.139712|9.805464|5.534133|7.666176|0.039089|0.038890|0.037059|0.039734|0.045534|0.057446|0.045373|0.045849|0.052522|0.070625|0.061779|0.084175|0.072998|0.085110|0.073494|0.062150|0.070831|0.114125|0.104014|0.123481|0.139579|0.128718|0.107796|0.213404|0.212566|0.302857|0.500000| |1.240554|1.370975|1.407022|1.553560|1.691321|1.633093|1.464137|1.394594|2.393115|1.838056|1.911568|2.900904|2.009782|1.923132|2.208220|3.584009|3.030135|5.120254|3.856827|4.664944|7.084548|12.302885|0.223962|5.583406|4.149462|17.647683|4.632039|2.756873|4.356021|0.034047|0.033416|0.033209|0.036887|0.043597|0.051560|0.036513|0.037451|0.040667|0.055036|0.047034|0.054480|0.048572|0.059771|0.050798|0.050311|0.058207|0.059229|0.057225|0.111778|0.124246|0.176034|0.220523|0.143821|0.145958|0.110980|0.096687|0.500000| 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