Version2.4 2021-05-26T14:18:08Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 03-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOC(=O)[C@@H]1CCCC[NH+]1CCn2c3c(cccn3)n(c2=O)Cc4ccc(cc4F)Br C38733816 RHF 6-31G(d) (6D,7F) CCOC(=O)[C@@H]1CCCC[NH+]1CCn2c3c(cccn3)n(c2=O)Cc4ccc(cc4F)Br C01[X(C23H27Br1F1N4O3)] 171 C1 549 CCOC(=O)[C@@H]1CCCC[NH+]1CCn1c(=O)n(c2c1nccc2)Cc1ccc(cc1F)Br CCOC(=O)[C@@H]1CCCC[NH+]1CCn1c(=O)n(c2c1nccc2)Cc1ccc(cc1F)Br CCOC(=O)[C@@H]1CCCC[NH+]1CCN2C(=O)N(Cc3ccc(Br)cc3F)c4cccnc24 InChIKey=WPYPLAGFMMDLDP-FQEVSTJZSA-O InChI=1S/C23H26BrFN4O3/c1-2-32-22(30)20-6-3-4-11-27(20)12-13-28-21-19(7-5-10-26-21)29(23(28)31)15-16-8-9-17(24)14-18(16)25/h5,7-10,14,20H,2-4,6,11-13,15H2,1H3/p+1/t20-/m0/s1 InChI=1/C23H26BrFN4O3/c1-2-32-22(30)20-6-3-4-11-27(20)12-13-28-21-19(7-5-10-26-21)29(23(28)31)15-16-8-9-17(24)14-18(16)25/h5,7-10,14,20H,2-4,6,11-13,15H2,1H3/p+1/t20-/m0/s1/fC23H27BrFN4O3/h27H/q+1 CCOC(=O)[C@@H]1CCCC[NH+]1CCn2c3c(cccn3)n(c2=O)Cc4ccc(cc4F)Br C01[X(C23H27Br1F1N4O3)] 171 C01 549 CCOC(=O)[C@@H]1CCCC[NH+]1CCn1c(=O)n(c2c1nccc2)Cc1ccc(cc1F)Br CCOC(=O)[C@@H]1CCCC[NH]1CCN1[C]2[N][CH][CH][CH][C]2N(C1=O)C[C]1[CH][CH][C]([CH][C]1F)Br CCOC(=O)[C@@H]1CCCC[NH]1CCN2[C]3[N][CH][CH][CH][C]3N(C[C]4[CH][CH][C](Br)[CH][C]4F)C2=O InChIKey=QPGRJFYMZHOXPB-FQEVSTJZSA-N InChI=1S/C23H27BrFN4O3/c1-2-32-22(30)20-6-3-4-11-27(20)12-13-28-21-19(7-5-10-26-21)29(23(28)31)15-16-8-9-17(24)14-18(16)25/h5,7-10,14,20,27H,2-4,6,11-13,15H2,1H3/t20-/m0/s1 InChI=1/C23H27BrFN4O3/c1-2-32-22(30)20-6-3-4-11-27(20)12-13-28-21-19(7-5-10-26-21)29(23(28)31)15-16-8-9-17(24)14-18(16)25/h5,7-10,14,20,27H,2-4,6,11-13,15H2,1H3/t20-/m0/s1 3775.2097760666 -3998.2799926 1-A 21766.7056 130 419 549 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -490.13493 -64.54639 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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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.02665 0.03551 0.05529 0.05744 0.06326 0.06577 0.09025 0.09779 0.10956 0.12091 0.12138 0.13576 0.14336 0.14897 0.15209 0.16532 0.16979 0.17140 0.17733 0.18168 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0.4243 0.6295 0.8533 0.8571 0.4422 0.8456 0.8484 0.2335 0.1622 0.8568 0.2053 0.4154 0.7777 0.1997 0.0570 0.7754 0.8312 0.7247 0.6226 0.1612 0.3597 0.7565 0.6324 0.2922 0.2779 0.8204 0.8373 0.7632 0.6697 0.2433 0.8487 0.8441 0.6890 0.2567 0.5074 0.8288 0.8552 0.4880 0.8508 0.4058 0.6844 0.8558 0.1934 0.7730 0.5363 0.8400 0.3042 0.8565 0.3723 0.8563 0.6138 0.8451 0.7960 0.8425 0.8319 0.8178 0.2770 0.3038 0.8515 0.2131 0.8107 0.8562 0.8267 0.8398 0.4500 0.8550 0.2623 0.8032 0.6702 0.5053 0.3896 0.8300 0.8538 0.8571 0.5541 0.8571 0.8463 0.6983 0.8549 0.7200 0.4253 0.8347 0.8413 0.8521 0.5698 0.7361 0.7321 0.8330 0.7999 0.8086 0.5771 0.3365 0.8199 0.7838 0.7865 0.8383 0.6719 0.8545 0.7700 0.8510 0.5649 0.2743 0.3112 0.5336 0.0431 0.4185 0.5957 0.4329 0.2401 0.6666 0.0924 0.2431 0.7767 0.6732 0.7697 0.6355 0.6204 0.8451 0.8536 0.3797 0.5430 0.8157 0.5248 0.6052 0.3279 0.2100 0.5020 0.3423 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 6 6 8 6 8 6 1 6 6 6 6 7 1 6 6 7 6 6 6 6 6 7 7 6 8 6 6 6 6 6 6 6 9 35 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 15.99491 12.00000 15.99491 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 78.91834 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 11469.9835 33073.7797 38638.4568 0.99943 0.02733 -0.01968 -0.02665 0.99907 0.03400 0.02059 -0.03345 0.99923 1 0.00755 0.00262 0.00224 0.15734 0.05457 0.04671 14.04 17.00 27.47 36.75 46.79 56.05 78.67 96.89 125.80 138.05 146.63 163.43 193.44 201.53 213.46 239.29 250.69 289.19 327.83 334.37 353.03 365.40 399.11 421.02 432.63 445.93 461.43 478.54 506.55 526.96 546.36 567.16 579.83 603.55 630.55 676.20 708.89 715.86 733.09 746.11 772.15 802.59 851.99 872.50 917.94 928.50 967.80 1010.17 1024.52 1086.51 1106.92 1118.01 1169.05 1194.78 1214.98 1221.91 1239.03 1261.06 1268.26 1277.88 1300.21 1320.27 1343.93 1350.10 1373.58 1374.98 1383.62 1388.65 1448.40 1462.48 1476.57 1495.39 1522.07 1557.77 1573.29 1582.15 1586.60 1605.55 1606.23 1611.60 1639.32 1654.00 1664.69 1679.39 1696.72 1699.47 1739.71 1754.67 1775.64 1781.82 1793.03 1808.77 1840.36 1846.39 1862.72 1880.78 1914.56 1949.24 1962.44 1970.77 1986.69 2019.19 2036.08 2053.50 2056.85 2060.92 2093.35 2102.44 2119.47 2136.09 2161.59 2166.79 2190.43 2194.73 2211.52 2217.11 2221.74 2228.94 2241.75 2260.28 2266.61 2281.45 2289.37 2308.50 2336.79 2342.38 2348.18 2352.77 2359.31 2361.45 2362.31 2364.29 2370.12 2380.15 2382.78 2391.92 2394.01 2398.28 2557.56 2610.14 2618.75 2632.70 2763.98 2862.24 4620.49 4625.34 4636.74 4639.15 4701.88 4709.11 4720.48 4721.89 4726.11 4730.69 4735.43 4741.95 4744.40 4748.55 4797.61 4799.62 4805.57 4812.48 4822.49 4857.86 4883.59 4907.07 4908.46 4909.69 4923.63 4923.92 5279.20 0.524121 0.551729 0.552673 0.460179 -3997.755871 -3997.728264 -3997.727320 -3997.819813 3.102230D-04 MUNgauss RevisionA2.1 retrievium 26-May-2021 DUDE CCOC(=O)[C@@H]1CCCC[NH+]1CCn2c3c(cccn3)n(c2=O)Cc4ccc(cc4F)Br C38733816 RHF 6-31G(d) (6D,10F) C1 505.125055 |X|Y|Z| 68.599810 123.791761 41.678435 70.736248 24 6 7 20 4 |36.858105| |12.607631|36.858105| |8.003980|13.176911|73.516695| |5.294709|8.096029|26.186500|36.858105| |4.554725|7.005410|15.215420|15.977547|73.516695| |4.071446|5.153618|14.534693|12.510345|14.274180|36.858105| |4.090723|4.854638|13.414006|8.871582|10.752187|17.679682|0.500000| |3.739832|4.438527|11.372510|7.679615|10.417532|12.375237|0.243210|36.858105| |2.921341|3.291691|7.657134|4.938532|7.452765|7.446368|0.182386|12.487085|36.858105| |2.555698|2.937034|6.559763|4.469654|7.306911|6.431714|0.153241|7.638090|12.488458|36.858105| |2.645528|3.101128|6.997449|4.992262|8.224608|7.535503|0.184744|6.530247|7.619956|12.534241|36.858105| |3.200194|3.982666|9.441620|7.778703|12.682003|12.607918|0.250562|7.564419|6.468268|7.582379|12.648913|53.358707| |3.135197|3.993661|9.041899|7.677795|14.752827|9.446555|0.182851|6.996073|5.792876|6.993750|9.254061|25.652312|0.500000| |3.055086|3.776166|8.348403|6.349099|11.244021|7.500337|0.194236|4.893645|4.368678|4.950033|7.663949|17.151039|0.262531|36.858105| |2.877166|3.350783|7.313807|4.903209|8.022841|5.961574|0.187635|4.182264|3.962485|4.279289|6.301261|10.130412|0.156840|12.393508|36.858105| |2.879462|3.304808|6.794519|4.297081|7.249389|4.578676|0.142575|3.376434|3.122086|3.259576|4.304816|6.956366|0.120175|7.829419|13.259944|53.358707| |2.432838|2.718856|5.351706|3.299265|5.741991|3.452743|0.104315|2.728347|2.595857|2.744685|3.490005|5.260965|0.095412|5.393835|7.510800|18.679497|36.858105| |2.467071|2.705519|5.129071|3.045930|5.318928|3.041213|0.091672|2.450098|2.291702|2.361321|2.875370|4.395108|0.081799|4.224274|5.242473|11.623289|13.666332|36.858105| |2.127459|2.292273|4.262471|2.507085|4.427860|2.501603|0.074272|2.087930|1.982151|2.050181|2.436835|3.615211|0.068611|3.319282|3.921115|7.367745|8.027392|13.916551|36.858105| |1.893480|2.044021|3.839024|2.288587|4.064057|2.334772|0.068689|1.978939|1.918377|2.019704|2.403720|3.456956|0.065812|3.146357|3.709912|6.454368|7.198789|8.112336|13.611563|36.858105| |1.897929|2.072815|3.975930|2.418658|4.291411|2.534689|0.074440|2.137437|2.103525|2.260471|2.751772|3.874413|0.073009|3.594026|4.363319|7.295825|8.584214|7.068576|7.908192|13.818425|36.858105| |2.116872|2.349305|4.616819|2.865877|5.044250|3.069630|0.090964|2.511858|2.466712|2.677437|3.396010|4.823938|0.088613|4.741862|6.260747|10.819047|14.718646|7.924146|6.743068|7.957955|14.240809|53.358707| |2.973027|3.269541|6.140057|3.553093|6.095405|3.411163|0.104263|2.686303|2.433233|2.441978|2.944659|4.695929|0.087137|4.448345|5.328304|11.779318|8.486365|13.635443|7.467659|5.117546|4.705420|7.399344|53.358707| |3.392711|3.876467|7.745084|4.616217|7.638645|4.499848|0.141908|3.319428|2.942182|2.936593|3.658251|6.135324|0.109513|6.123781|7.738842|18.870050|8.435235|8.466252|5.285624|4.217920|4.289645|7.387109|19.060909|36.858105| |4.301786|5.038228|10.427436|5.915212|9.151934|5.403558|0.174824|3.835828|3.233460|3.104558|3.772602|6.635358|0.118198|6.032438|6.719882|11.339928|5.573082|5.556220|4.003553|3.329500|3.386468|5.611932|11.211066|15.763259|73.516695| |3.083083|3.262864|5.796417|3.198909|5.504262|2.961240|0.089364|2.415050|2.168409|2.135818|2.481731|3.927015|0.074638|3.477312|3.883344|7.192294|5.197032|7.452155|5.874806|4.134298|3.639750|5.310919|17.796628|7.677240|11.580497|36.858105| |2.856791|2.873129|5.142523|2.767885|4.655722|2.638973|0.081029|2.217771|2.025380|1.967954|2.244234|3.439003|0.064950|2.923336|3.347479|5.817946|4.291214|5.741284|5.076964|3.751617|3.280336|4.652956|10.439773|5.592075|9.027527|12.591096|36.858105| |3.119344|3.021278|5.490684|2.864841|4.672091|2.767208|0.087031|2.347018|2.139701|2.033024|2.290323|3.488150|0.065171|2.870854|3.318176|5.464101|3.802233|4.573773|3.963855|3.158702|2.900087|4.214132|8.072980|5.190705|9.172913|7.521741|13.687469|36.858105| |2.722734|2.575684|4.677927|2.438355|3.984406|2.397357|0.074942|2.098897|1.949192|1.844326|2.040549|3.027874|0.056859|2.431178|2.791655|4.395156|3.137478|3.634527|3.346238|2.790475|2.568625|3.648636|5.793916|3.852816|6.820258|5.000237|7.870866|13.791961|36.858105| |2.308842|2.211752|3.978531|2.111556|3.517107|2.078379|0.063810|1.839345|1.728293|1.658018|1.829322|2.682856|0.050872|2.163679|2.462618|3.883003|2.894183|3.406486|3.334254|2.802925|2.513226|3.451437|5.121563|3.282194|5.621499|4.432331|6.840184|7.983164|13.741150|36.858105| |2.189917|2.144490|3.827064|2.064529|3.497486|2.015709|0.061125|1.770160|1.662139|1.617854|1.800163|2.651250|0.050597|2.177393|2.464711|3.985142|3.078628|3.793531|3.900360|3.181076|2.739158|3.666119|5.558198|3.358615|5.559895|4.993077|7.843256|6.875743|7.910617|13.806045|36.858105| |2.391303|2.391290|4.253337|2.313302|3.947391|2.229457|0.067467|1.918209|1.781362|1.745634|1.970345|2.953193|0.056342|2.483679|2.814497|4.747070|3.705973|4.908567|4.980984|3.753968|3.150740|4.245110|7.501087|4.159098|6.670356|7.536567|13.805332|8.062453|6.949535|8.057579|13.810920|36.858105| |2.181824|2.222598|3.924394|2.172955|3.785436|2.084165|0.061984|1.797594|1.675285|1.664981|1.883530|2.818132|0.054360|2.394770|2.665252|4.512240|3.672313|4.992261|5.624049|4.147365|3.310859|4.294727|7.037602|3.818541|5.991998|6.746741|8.148191|5.312872|4.674347|5.331961|8.201202|14.276646|97.533100| |1.976359|1.872483|3.369728|1.789799|2.987139|1.780565|0.054205|1.617031|1.541588|1.474996|1.598959|2.300638|0.043887|1.815397|2.039049|3.094982|2.307232|2.596016|2.590731|2.295535|2.098838|2.854967|3.755819|2.512454|4.365274|3.078995|4.075621|4.610871|6.702256|10.084054|6.723796|4.630840|8.318156|2539.412838| |17.570914|8.936058|10.184006|4.285338|7.011249|3.369249|0.093130|3.132032|2.526388|2.258944|2.334417|3.784289|0.076756|2.703607|2.547091|3.529225|2.244294|2.309842|2.024324|1.800194|1.786558|2.675163|3.759894|3.044054|6.610239|2.941516|2.732726|2.933272|2.588490|2.232021|2.134112|2.324332|4.815720|65.444450|0.500000| |17.587535|8.868965|12.864513|4.938245|7.387057|4.016766|0.118189|3.580360|2.867366|2.510814|2.642670|4.311992|0.083971|3.098101|3.031881|4.208586|2.601348|2.670717|2.284813|2.009888|2.001854|3.041688|4.473941|3.749566|8.651961|3.463814|3.278986|3.712975|3.199534|2.635633|2.459133|2.684256|5.387657|75.559135|0.300776|0.500000| |17.581361|8.851225|12.815759|4.909942|7.396774|3.992447|0.110702|3.921937|3.057157|2.602056|2.615787|4.206281|0.084203|2.852021|2.690382|3.574027|2.232901|2.232350|1.943263|1.754086|1.772027|2.686577|3.573688|2.995022|6.572077|2.676614|2.529864|2.783001|2.495376|2.131216|2.005973|2.155445|4.432933|63.428391|0.301098|0.300355|0.500000| |8.801906|17.653351|16.535939|7.312698|12.544855|4.754135|0.126480|3.886783|2.999408|2.775215|3.025200|5.347210|0.109415|3.978421|3.524443|4.934535|2.980819|3.024218|2.535807|2.224468|2.233089|3.442559|5.111572|4.421963|10.338208|3.804392|3.210578|3.282607|2.724967|2.347094|2.311717|2.633938|5.547486|66.332444|0.211238|0.211711|0.172865|0.500000| |8.791831|17.641901|16.472584|7.243911|12.645462|4.720190|0.117529|4.338688|3.220138|2.901941|2.987797|5.156732|0.110116|3.498726|3.019940|3.991484|2.461485|2.428734|2.092234|1.892604|1.927807|2.953244|3.877971|3.309535|7.234966|2.826847|2.499123|2.587947|2.249861|1.969952|1.923928|2.129895|4.522725|57.668933|0.211127|0.172934|0.210968|0.300973|0.500000| |3.627916|4.425471|10.532046|7.350997|11.213145|8.852264|0.173597|17.521712|8.871282|6.881239|5.695161|9.137486|0.200877|4.491106|3.671730|4.156274|2.519219|2.283542|1.967505|1.870492|2.011635|3.181253|3.390600|3.015147|6.119404|2.265627|2.063107|2.153096|1.929164|1.708961|1.658289|1.799762|3.835006|51.323922|0.086227|0.093213|0.105856|0.107184|0.127957|0.500000| |4.237097|4.778080|12.401053|6.962944|9.167772|8.969563|0.218468|17.603041|8.786914|5.525285|4.900680|7.572020|0.143462|4.095165|3.704111|4.252400|2.550454|2.342327|2.005972|1.884619|2.007278|3.169498|3.544682|3.178253|6.669093|2.393884|2.233575|2.407853|2.169272|1.883732|1.791985|1.926818|4.022418|56.612500|0.096058|0.112345|0.129252|0.111205|0.127550|0.303496|0.500000| |2.723509|2.999602|6.682853|4.130340|6.439961|5.467558|0.136610|8.883144|17.590484|8.832107|5.530141|6.593878|0.128545|3.533127|3.234332|3.610868|2.262058|2.029091|1.781868|1.730070|1.881674|2.949141|2.922027|2.534421|4.926502|1.946815|1.834707|1.939469|1.788741|1.597025|1.533460|1.630252|3.458452|49.074630|0.066254|0.073432|0.080697|0.075289|0.083202|0.216811|0.210747|0.500000| |2.858320|3.125982|7.250255|4.461644|6.618136|6.675413|0.190363|8.822847|17.527451|8.841477|6.879746|7.777243|0.134613|4.189768|4.109126|4.388038|2.680095|2.360009|2.037953|1.972620|2.166028|3.464931|3.403682|3.026844|5.882690|2.220222|2.105997|2.254975|2.068574|1.823120|1.737460|1.850016|3.879139|55.472906|0.068472|0.079940|0.082953|0.079772|0.082789|0.173586|0.213349|0.303479|0.500000| |2.494805|2.904785|6.316081|4.360639|7.517064|5.691403|0.129568|6.879361|8.819679|17.526279|8.856932|9.243895|0.203132|4.569568|3.758963|4.049922|2.542318|2.215565|1.940291|1.912009|2.124802|3.381446|3.120357|2.718835|5.113349|2.027452|1.854177|1.897872|1.721304|1.557478|1.528989|1.652938|3.575877|47.240279|0.061907|0.066898|0.070582|0.076218|0.081872|0.203514|0.140200|0.213578|0.173208|0.500000| |2.255655|2.529607|5.481276|3.584661|5.941044|4.821983|0.123503|5.522141|8.782727|17.577131|8.993701|7.566865|0.143230|4.140549|3.808374|4.029665|2.567323|2.208162|1.945620|1.942716|2.186662|3.486116|3.055947|2.643925|4.869969|1.970204|1.838103|1.898421|1.743557|1.580205|1.541144|1.649309|3.547125|48.334564|0.056020|0.062053|0.063928|0.066914|0.069320|0.140509|0.123100|0.209776|0.213252|0.303595|0.500000| |2.374146|2.775497|5.992419|4.215993|7.396324|5.567612|0.139074|4.900216|5.511020|8.770853|17.620502|12.426376|0.225296|7.270860|5.860086|5.654238|3.514752|2.855258|2.453995|2.469710|2.878522|4.833102|3.867863|3.436567|6.076254|2.383972|2.142201|2.147933|1.918880|1.743884|1.735591|1.904103|4.151655|51.991798|0.059219|0.065725|0.064704|0.076642|0.075108|0.127883|0.107928|0.123207|0.140177|0.213462|0.212757|0.500000| |2.598616|2.967076|6.696308|4.528566|7.197656|6.799107|0.194849|5.754297|6.899931|8.859671|17.633679|12.387675|0.181198|7.072318|7.243881|6.386133|3.775784|3.056513|2.573500|2.545170|2.941650|5.016123|4.225722|3.883513|7.005505|2.582863|2.371819|2.446582|2.187343|1.950896|1.906739|2.077678|4.426411|57.960118|0.063512|0.073672|0.071295|0.080729|0.077689|0.132349|0.129084|0.140918|0.204437|0.173693|0.216352|0.301663|0.500000| |3.433685|4.436926|9.566038|7.477278|14.293699|7.122440|0.181108|4.619893|3.877768|4.147307|5.624319|12.419615|0.229215|17.752328|8.811136|10.403484|5.259622|4.422042|3.423071|3.131993|3.437218|5.957970|6.741121|6.992853|12.934200|3.912622|3.157052|3.058208|2.536779|2.246766|2.275551|2.637277|5.736605|63.327338|0.084492|0.096098|0.086577|0.136012|0.112596|0.121410|0.111305|0.089634|0.102482|0.110393|0.096965|0.147657|0.144702|0.500000| |2.653932|3.227503|6.778301|4.955359|9.421750|5.573744|0.141857|4.140661|3.886204|4.678782|7.090423|12.424342|0.234867|17.621939|8.771817|8.774857|5.118501|3.964409|3.234853|3.173679|3.715612|6.623641|5.369091|4.965537|8.297743|3.129910|2.643397|2.551043|2.194335|1.991719|2.027167|2.303367|5.096715|57.492316|0.066650|0.074007|0.069319|0.094650|0.085509|0.110245|0.096656|0.089961|0.102145|0.124832|0.112364|0.223576|0.173297|0.302905|0.500000| |2.480888|2.827573|6.005497|3.944344|6.629188|4.799739|0.145930|3.686963|3.714732|4.194890|6.202697|8.391980|0.136581|8.750797|17.653212|12.728627|7.295082|4.852906|3.836895|3.852140|4.827371|9.866069|6.154132|5.759528|8.781971|3.386150|3.005084|2.958688|2.562400|2.309129|2.322598|2.612883|5.639879|66.232759|0.061883|0.072166|0.065328|0.081785|0.072269|0.091216|0.090634|0.085525|0.107997|0.101737|0.108452|0.173746|0.207874|0.175949|0.223854|0.500000| |3.081730|3.511421|7.979751|5.138188|7.812613|6.759896|0.247761|4.684032|4.450615|4.504401|6.340242|9.805994|0.146865|8.738257|17.616772|12.627882|5.902336|4.581661|3.515251|3.285288|3.732586|6.786021|6.673807|7.118275|12.393795|3.751866|3.373590|3.505723|2.971502|2.562213|2.500001|2.805792|5.824100|72.490204|0.074364|0.091708|0.080963|0.099773|0.086422|0.108610|0.117582|0.098905|0.134685|0.105972|0.110959|0.149343|0.221420|0.194212|0.175068|0.302292|0.500000| |2.074397|2.203032|4.016876|2.322383|4.106485|2.280948|0.067462|1.930170|1.823343|1.865820|2.175410|3.232435|0.061977|2.884078|3.300420|5.923407|5.654821|8.874392|17.755059|8.812971|5.623877|6.652006|8.854959|4.550632|6.464079|6.106361|5.526216|4.084767|3.491237|3.612486|4.476411|5.955694|17.219424|94.108141|0.055472|0.062042|0.052473|0.067887|0.055905|0.050791|0.052033|0.045931|0.051982|0.049336|0.049220|0.060495|0.063366|0.083800|0.077740|0.088659|0.084469|0.500000| |1.725037|1.845127|3.431525|2.030780|3.618046|2.063814|0.060311|1.781118|1.735367|1.823610|2.131601|3.033405|0.058353|2.684591|3.076666|5.093854|5.123725|5.717890|8.868851|17.753780|8.962021|7.743529|5.567623|3.433720|5.020035|3.547920|3.328857|2.825668|2.565860|2.642398|3.031328|3.476034|8.881445|75.430403|0.045911|0.050668|0.044598|0.055484|0.047807|0.047046|0.047331|0.043890|0.049487|0.048233|0.049065|0.060981|0.062323|0.074326|0.075733|0.088969|0.077228|0.212089|0.500000| |1.731925|1.884259|3.611859|2.199878|3.916604|2.324652|0.067638|1.999961|1.998484|2.169560|2.609240|3.576120|0.067986|3.217657|3.788141|5.852003|5.991233|5.055159|5.626537|8.924813|17.744968|12.657769|5.068713|3.505524|5.134429|3.021025|2.783024|2.512836|2.276343|2.245006|2.424338|2.714395|6.413557|65.516590|0.045414|0.050397|0.045306|0.055825|0.049160|0.052551|0.052057|0.050030|0.057087|0.056849|0.059098|0.076947|0.077220|0.084253|0.094394|0.119740|0.091545|0.123556|0.215492|0.500000| |3.671470|3.903569|6.709990|3.605287|6.181374|3.197483|0.095776|2.589302|2.269383|2.206150|2.540587|4.118803|0.078901|3.577181|3.823157|6.726433|4.485569|5.676367|4.521997|3.438230|3.154302|4.697583|12.694257|7.483381|13.352406|17.650924|8.911569|6.961102|4.676755|3.989205|4.245378|5.768874|11.577648|97.722334|0.097468|0.115959|0.085826|0.131373|0.091621|0.067747|0.071937|0.056614|0.064026|0.058483|0.055909|0.067027|0.072533|0.115530|0.087889|0.090487|0.104229|0.127478|0.083334|0.074426|0.500000| |2.759147|2.935641|5.117360|2.864464|5.067842|2.639477|0.077824|2.189349|1.980360|1.973999|2.279349|3.572773|0.069128|3.157934|3.420022|6.168401|4.746105|6.906232|6.199299|4.284520|3.622571|5.066426|12.554137|5.872301|8.927332|17.644380|8.868748|5.595644|4.181164|3.980945|4.741762|7.202271|17.749665|97.574577|0.074646|0.083899|0.067020|0.095163|0.072415|0.057870|0.059925|0.049788|0.055844|0.052598|0.050846|0.061762|0.065156|0.098529|0.081420|0.085072|0.089754|0.195105|0.104330|0.083948|0.303115|0.500000| |3.699685|3.556618|6.571303|3.341921|5.307783|3.206575|0.102989|2.676149|2.395613|2.240797|2.528159|3.919048|0.072509|3.192343|3.682255|5.945651|3.873678|4.431314|3.666401|2.983001|2.828902|4.242395|8.181633|5.912080|11.494094|6.999615|8.937166|17.713285|8.954800|5.668557|4.953124|5.703629|9.607277|130.438584|0.093953|0.126999|0.090556|0.106851|0.082349|0.067412|0.077036|0.059836|0.070339|0.057800|0.057501|0.064817|0.075117|0.095276|0.076908|0.088629|0.111208|0.101190|0.073394|0.068285|0.204061|0.141532|0.500000| |2.767063|2.559166|4.684487|2.408651|3.887755|2.391306|0.075236|2.127051|1.982303|1.849801|2.020490|2.973138|0.055721|2.334510|2.666497|4.053865|2.836236|3.154480|2.888220|2.481880|2.337987|3.351897|4.960662|3.480976|6.359375|4.079506|5.616204|8.910723|17.763278|8.914895|5.641469|4.995266|8.326325|219.980349|0.072563|0.091114|0.071583|0.073624|0.062110|0.054001|0.061837|0.050781|0.058901|0.047779|0.048689|0.052349|0.060366|0.067088|0.058334|0.068151|0.080398|0.082101|0.063665|0.058314|0.110513|0.096212|0.215305|0.500000| |1.958983|1.923960|3.422874|1.859646|3.177433|1.820163|0.054670|1.614842|1.527323|1.495255|1.654840|2.415596|0.046395|1.974959|2.213375|3.529691|2.768939|3.356850|3.595501|3.028416|2.585396|3.385673|4.721744|2.892159|4.780694|4.091247|5.622133|4.957911|5.619889|8.859772|17.770408|8.949455|16.816112|218.428449|0.053395|0.060256|0.050219|0.057364|0.048518|0.042269|0.045277|0.039356|0.044217|0.039414|0.039778|0.044631|0.048509|0.057034|0.051698|0.058711|0.061875|0.116516|0.082565|0.064509|0.098265|0.113264|0.107603|0.123754|0.500000| 3996.123195 -17016.309221 5524.616400 -280.135073 -7775.704699 3775.210048 -4000.494651 2.001094 408B00000000002F 44D391DFA8A2A71C 445331E629D18F4F 4232ECD59F400000 3C4622D6F0000002 43CCFDB3B2A69A3A