Version2.0 2020-02-03T17:00:51Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 09-Nov-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC1=c2cc(ccc2=[NH+][C@@H]1C(=O)N(Cc3ccc(cc3)OCCN4CCOCC4)C[C@@H]5CCCO5)Cl C64066823 RHF 6-31G(d) (6D,7F) CC1=c2cc(ccc2=[NH+][C@@H]1C(=O)N(Cc3ccc(cc3)OCCN4CCOCC4)C[C@@H]5CCCO5)Cl C01[X(C28H35Cl1N3O4)] 207 C1 614 Clc1ccc2=[NH+][C@@H](C(=c2c1)C)C(=O)N(Cc1ccc(cc1)OCCN1CCOCC1)C[C@@H]1CCCO1 Clc1ccc2=[NH+][C@@H](C(=c2c1)C)C(=O)N(Cc1ccc(cc1)OCCN1CCOCC1)C[C@@H]1CCCO1 CC1=C2C=C(Cl)C=CC2=[NH+][C@@H]1C(=O)N(C[C@@H]3CCCO3)Cc4ccc(OCCN5CCOCC5)cc4 InChIKey=CTIUYARABAHRAL-IGKIAQTJSA-O InChI=1S/C28H34ClN3O4/c1-20-25-17-22(29)6-9-26(25)30-27(20)28(33)32(19-24-3-2-13-35-24)18-21-4-7-23(8-5-21)36-16-12-31-10-14-34-15-11-31/h4-9,17,24,27H,2-3,10-16,18-19H2,1H3/p+1/t24-,27-/m0/s1 InChI=1/C28H34ClN3O4/c1-20-25-17-22(29)6-9-26(25)30-27(20)28(33)32(19-24-3-2-13-35-24)18-21-4-7-23(8-5-21)36-16-12-31-10-14-34-15-11-31/h4-9,17,24,27H,2-3,10-16,18-19H2,1H3/p+1/t24-,27-/m0/s1/fC28H35ClN3O4/h30H/q+1 CC1=c2cc(ccc2=[NH+][C@@H]1C(=O)N(Cc3ccc(cc3)OCCN4CCOCC4)C[C@@H]5CCCO5)Cl C01[X(C28H35Cl1N3O4)] 207 C01 614 Clc1ccc2=[NH+][C@@H](C(=c2c1)C)C(=O)N(Cc1ccc(cc1)OCCN1CCOCC1)C[C@@H]1CCCO1 ClC1=CC2=C(C)[C@H](N[C@@H]2C=C1)C(=O)N(Cc1ccc(cc1)OCCN1CCOCC1)C[C@@H]1CCCO1 CC1=C2C=C(Cl)C=C[C@H]2N[C@@H]1C(=O)N(C[C@@H]3CCCO3)Cc4ccc(OCCN5CCOCC5)cc4 InChIKey=QFDBXEVKRKNVMA-OIKPOIBNSA-N InChI=1S/C28H36ClN3O4/c1-20-25-17-22(29)6-9-26(25)30-27(20)28(33)32(19-24-3-2-13-35-24)18-21-4-7-23(8-5-21)36-16-12-31-10-14-34-15-11-31/h4-9,17,24,26-27,30H,2-3,10-16,18-19H2,1H3/t24-,26+,27-/m0/s1 InChI=1/C28H36ClN3O4/c1-20-25-17-22(29)6-9-26(25)30-27(20)28(33)32(19-24-3-2-13-35-24)18-21-4-7-23(8-5-21)36-16-12-31-10-14-34-15-11-31/h4-9,17,24,26-27,30H,2-3,10-16,18-19H2,1H3/t24-,26+,27-/m0/s1 3866.6313423891 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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| 6.5567 11.0267 14.7007 16.2002 19.4696 26.3901 30.1678 34.6637 47.2168 48.8381 59.2929 70.8602 86.4724 108.9843 112.9502 121.1950 129.4383 157.5890 165.7881 170.7416 176.7340 206.5131 232.5639 244.8631 257.7205 263.2004 274.3261 291.2450 306.3915 328.6265 339.7630 352.2303 367.1549 377.6366 382.3567 411.0137 425.1574 442.2126 446.1608 459.3683 466.5181 469.0505 495.1181 516.6622 523.1908 534.4709 536.0241 544.8861 569.4178 584.4226 608.9998 615.9789 649.0156 663.5825 670.8359 679.0139 700.1853 728.1900 760.4991 769.2581 795.7881 816.6667 835.8259 842.4756 852.9560 859.8328 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15.99491 34.96885 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 15098.1525 48415.1260 60151.5770 0.99976 -0.02175 -0.00099 0.02174 0.99976 -0.00361 0.00107 0.00359 0.99999 1 0.00574 0.00179 0.00144 0.11953 0.03728 0.03000 9.43 15.86 21.15 23.31 28.01 37.97 43.40 49.87 67.93 70.27 85.31 101.95 124.41 156.80 162.51 174.37 186.23 226.74 238.53 245.66 254.28 297.13 334.61 352.30 370.80 378.69 394.69 419.04 440.83 472.82 488.84 506.78 528.25 543.33 550.13 591.36 611.71 636.25 641.93 660.93 671.22 674.86 712.36 743.36 752.75 768.98 771.22 783.97 819.27 840.85 876.21 886.26 933.79 954.75 965.18 976.95 1007.41 1047.70 1094.19 1106.79 1144.96 1175.00 1202.57 1212.13 1227.21 1237.11 1258.20 1304.59 1325.90 1340.01 1349.14 1351.84 1362.17 1375.67 1382.94 1391.21 1406.73 1433.37 1436.20 1439.79 1452.91 1464.46 1494.84 1510.80 1523.92 1534.24 1566.18 1582.96 1587.05 1598.34 1608.60 1622.57 1624.29 1641.42 1645.65 1648.73 1674.67 1682.53 1712.20 1714.39 1725.64 1735.81 1740.21 1784.01 1820.45 1825.20 1830.27 1838.65 1848.05 1856.11 1865.26 1874.05 1883.34 1903.65 1911.52 1917.43 1920.11 1932.03 1945.95 1952.44 2000.40 2007.45 2016.68 2048.67 2051.00 2058.59 2065.85 2069.60 2081.25 2086.99 2106.85 2107.20 2114.38 2121.96 2136.09 2146.45 2163.06 2169.02 2193.98 2221.47 2221.55 2232.82 2234.30 2258.64 2260.28 2263.15 2280.89 2282.10 2286.23 2297.50 2299.34 2319.63 2323.44 2352.44 2354.66 2360.78 2363.72 2370.20 2371.66 2380.02 2385.53 2396.37 2396.77 2400.44 2418.20 2446.31 2499.40 2531.90 2548.59 2616.27 2653.50 2742.26 4497.37 4502.60 4518.33 4544.98 4589.11 4601.93 4612.82 4617.28 4632.43 4649.05 4661.51 4666.62 4671.21 4676.79 4694.24 4707.12 4714.08 4726.45 4730.61 4733.35 4735.70 4743.97 4757.12 4765.32 4770.47 4788.70 4821.96 4843.47 4848.66 4890.81 4895.22 4899.49 4915.53 4922.61 5561.17 0.646527 0.678424 0.679368 0.573861 -2002.077174 -2002.045276 -2002.044332 -2002.149839 3.538722D-04 MUNgauss RevisionA2.0 retrievium 03-Feb-2020 DUDE CC1=c2cc(ccc2=[NH+][C@@H]1C(=O)N(Cc3ccc(cc3)OCCN4CCOCC4)C[C@@H]5CCCO5)Cl C64066823 RHF 6-31G(d) (6D,10F) C1 512.231610 |X|Y|Z| 158.295076 86.131182 33.802478 77.242938 33 6 7 8 27 3 3 |36.858105| |12.802364|36.858105| |7.410147|14.045125|36.858105| |5.833669|7.451288|13.222721|36.858105| |4.157944|5.152743|7.989874|14.219440|36.858105| |3.595539|4.652222|6.892370|7.849083|13.163416|36.858105| |3.809437|5.296647|7.679208|6.611850|7.729029|14.076633|36.858105| |5.118805|8.433988|13.259458|7.646584|6.831976|8.070518|13.448136|36.858105| |5.093449|8.257382|8.440099|5.289215|4.660844|5.256216|7.719395|14.477680|53.358707| |4.083815|5.819892|5.923559|4.234993|3.957131|4.646347|6.823078|9.277137|26.005483|0.500000| |7.275768|12.653181|8.184878|5.074139|4.103327|4.145727|5.188770|8.346893|17.825434|0.243230|36.858105| |6.527816|8.986044|6.309245|4.341319|3.594433|3.621269|4.405524|6.367275|12.398422|0.202078|17.605229|0.500000| |6.000065|7.565544|5.572370|4.009599|3.377589|3.416869|4.116023|5.680899|10.538341|0.188354|12.274981|0.237918|36.858105| |5.961042|7.029564|5.536190|4.179438|3.506693|3.469101|4.030112|5.336281|8.514295|0.151981|8.129739|0.164069|15.825918|73.516695| |4.517283|5.153009|4.100815|3.162005|2.767359|2.843875|3.387705|4.323113|7.910441|0.160735|7.681948|0.197106|14.296618|15.003079|53.358707| |3.638874|3.892826|3.274888|2.676998|2.394517|2.451607|2.833256|3.403474|5.699494|0.118385|4.952174|0.127454|7.894647|12.324815|17.478676|36.858105| |2.970716|3.275110|2.930642|2.446646|2.260740|2.378016|2.767157|3.181418|5.249514|0.115327|4.089010|0.104687|5.729485|9.538283|10.383106|12.601613|36.858105| |2.507634|2.725009|2.477826|2.111699|1.978444|2.090028|2.407753|2.694832|4.373841|0.097481|3.335608|0.089259|4.226524|6.920317|7.505183|7.531776|13.669411|36.858105| |2.181257|2.382192|2.231583|1.938197|1.851300|1.978870|2.265594|2.455562|3.883590|0.087591|2.841172|0.075785|3.415273|5.757528|5.577058|5.008531|7.879946|13.821073|36.858105| |2.146490|2.373958|2.274947|1.992349|1.928100|2.084385|2.386061|2.534060|3.931352|0.089085|2.786799|0.072559|3.319726|5.795796|5.097976|4.413401|6.792166|7.931792|13.680365|36.858105| |2.413397|2.709024|2.608384|2.264891|2.185768|2.369453|2.734153|2.924388|4.527924|0.102056|3.179850|0.080047|3.912654|7.090868|5.768560|5.000059|7.866997|6.892399|7.937044|13.705903|36.858105| |2.880755|3.248699|3.025767|2.554142|2.401208|2.563939|2.991005|3.352228|5.361522|0.118679|3.926616|0.096548|5.306229|9.705140|8.015764|7.540847|13.735321|8.001758|6.904376|7.929030|13.733496|36.858105| |1.878746|2.065311|2.011082|1.794464|1.760696|1.910511|2.157635|2.235759|3.387428|0.076414|2.371331|0.062339|2.716164|4.768117|4.059128|3.369657|4.599115|5.307010|8.219640|14.214526|7.874246|5.204587|73.516695| |1.783926|1.961606|1.943403|1.761089|1.749767|1.906010|2.126462|2.157961|3.187711|0.071210|2.203018|0.057350|2.485170|4.464369|3.579538|2.910010|3.765147|3.983959|5.255960|7.980945|6.665536|4.492091|24.076747|36.858105| |1.565092|1.703578|1.693405|1.554079|1.552543|1.684309|1.854174|1.864026|2.723257|0.060374|1.889734|0.049856|2.086189|3.724310|2.999346|2.402397|2.965502|3.204354|4.095708|5.228780|4.383932|3.331976|14.304655|12.543591|36.858105| |1.479006|1.586665|1.562209|1.438873|1.427079|1.527698|1.667602|1.693135|2.472393|0.054167|1.748647|0.046423|1.941967|3.474843|2.813698|2.291954|2.788443|3.068239|3.881451|4.599142|3.813894|3.031881|11.530743|7.696365|13.161558|53.358707| |1.351473|1.443463|1.422002|1.315711|1.307342|1.397154|1.518107|1.536591|2.238180|0.048952|1.585492|0.042524|1.735511|3.077220|2.518618|2.022432|2.399040|2.665373|3.284862|3.633711|3.046568|2.532119|8.502136|5.116415|7.871755|17.827891|36.858105| |1.283262|1.355088|1.326273|1.231125|1.216765|1.287402|1.390003|1.416490|2.060036|0.044639|1.479110|0.039838|1.623499|2.884994|2.362732|1.913516|2.229596|2.483301|2.976115|3.150022|2.684519|2.305878|6.856416|3.929518|5.084059|10.660092|12.534111|36.858105| |1.255011|1.318823|1.293325|1.208034|1.194782|1.258089|1.348737|1.372237|1.979980|0.042590|1.425758|0.038210|1.568243|2.818265|2.259448|1.835723|2.117651|2.303020|2.695210|2.896406|2.560486|2.216439|6.113601|3.657934|4.544193|9.214225|7.917393|13.616402|73.516695| |1.349735|1.419344|1.390206|1.295985|1.278947|1.345298|1.444060|1.473796|2.127072|0.045684|1.534193|0.040801|1.707277|3.097963|2.453485|2.019578|2.356796|2.533912|2.977883|3.292650|2.942866|2.510666|6.932891|4.279929|5.078728|10.651753|6.794307|8.206657|24.227986|36.858105| |1.432394|1.524505|1.504327|1.398445|1.387986|1.474541|1.591712|1.613020|2.327872|0.050389|1.656220|0.043741|1.842537|3.348808|2.633247|2.153286|2.565405|2.730812|3.288396|3.866426|3.456067|2.821349|8.658622|6.008826|7.859902|17.834585|7.978568|6.801657|14.087193|12.531164|36.858105| |3.885429|4.410814|3.636010|2.854821|2.544451|2.649477|3.166341|3.931696|7.260934|0.155909|6.521646|0.203250|7.673228|9.394167|17.746614|7.601082|5.925369|5.190573|3.959191|3.476966|3.669572|4.597802|5.063541|2.474734|2.120176|2.708477|1.813628|1.700504|2.854863|1.717275|1.834888|36.858105| |3.855769|4.022535|3.257221|2.637724|2.327219|2.357638|2.718602|3.321989|5.687377|0.115449|5.298447|0.180608|5.639453|7.586672|10.324276|5.632565|4.329827|4.031342|3.196485|2.802733|2.893329|3.477661|4.228422|2.095593|1.841496|2.393422|1.626431|1.548319|2.608493|1.556461|1.636365|12.478233|36.858105| |4.666723|4.721482|3.654765|2.924506|2.521167|2.505568|2.865664|3.585434|6.052920|0.116792|6.070165|0.225274|5.893175|7.914319|9.325324|4.930442|3.779929|3.415360|2.789429|2.523462|2.656366|3.185873|3.851200|1.945812|1.715501|2.225851|1.513181|1.441536|2.445965|1.460572|1.536076|8.868348|17.481197|0.500000| |3.070845|3.216449|2.751192|2.298610|2.077548|2.126857|2.431388|2.854891|4.733330|0.098853|4.013380|0.135460|3.990028|5.723119|6.683191|4.069475|3.501202|3.501816|2.920238|2.544899|2.541186|2.903897|3.949799|1.954422|1.751907|2.282519|1.576184|1.502675|2.510348|1.478689|1.547989|7.433214|12.308127|0.242811|36.858105| |2.632111|2.672108|2.316601|1.986318|1.809343|1.840563|2.066481|2.373846|3.811571|0.079551|3.184852|0.101084|3.336576|5.017805|5.601144|3.802890|3.319172|3.472380|2.899330|2.467179|2.407355|2.713238|3.859790|1.896274|1.717878|2.276759|1.583092|1.529754|2.550592|1.496395|1.545374|5.461003|7.871799|0.166010|12.405034|36.858105| |2.894327|2.829073|2.393390|2.053644|1.843628|1.845113|2.052528|2.387357|3.798929|0.077377|3.305304|0.103051|3.610603|5.499109|6.090486|4.285368|3.490193|3.516591|2.858482|2.449255|2.437132|2.815242|3.788254|1.874877|1.686092|2.250747|1.550949|1.509733|2.544673|1.506512|1.547544|5.393523|8.275077|0.183889|8.024429|12.513238|36.858105| |3.491259|3.453486|2.829490|2.361368|2.091358|2.094893|2.364171|2.824409|4.629438|0.093619|4.221190|0.131194|4.900617|7.125990|9.010947|6.048015|4.430940|4.207364|3.254763|2.794254|2.853075|3.441306|4.204085|2.073692|1.827811|2.415766|1.640244|1.581889|2.674707|1.600780|1.662169|7.987637|13.594587|0.260518|8.045711|8.225432|13.491021|73.516695| |3.254730|3.639846|4.753765|7.099089|11.027832|7.013543|4.761173|4.222012|4.459474|0.081135|3.015261|0.076167|2.619590|4.874113|3.033519|1.991332|1.897059|1.689414|1.599630|1.667802|1.866133|2.010938|2.749871|1.552751|1.398107|1.760779|1.192680|1.115597|1.958389|1.175222|1.268817|2.072323|1.936526|0.057831|1.760267|1.563818|1.595565|3.156846|448.794386| |17.631328|8.898705|6.892438|6.436303|4.436957|3.620317|3.638892|4.620175|5.849238|0.097830|5.421309|0.139296|4.542098|8.275200|4.905581|3.030703|2.561323|2.202698|1.951568|1.935631|2.163490|2.522163|3.054551|1.648268|1.458990|1.879158|1.266847|1.204990|2.102334|1.268614|1.343877|3.201131|3.204728|0.105244|2.668829|2.324523|2.527973|5.234282|28.774147|0.500000| |17.546238|9.087794|6.046958|4.985104|3.737798|3.289339|3.481927|4.531320|6.263375|0.106007|6.400293|0.153220|6.390990|12.603532|6.470163|4.004798|3.192686|2.642453|2.279261|2.247470|2.555251|3.103052|3.469893|1.854482|1.617146|2.089881|1.394397|1.328336|2.319635|1.412195|1.495649|3.847091|3.762458|0.122123|2.944548|2.593915|2.918635|6.348678|24.163815|0.300039|0.500000| |17.570067|8.939656|5.703114|4.600072|3.503543|3.133863|3.361056|4.401062|6.312567|0.106810|6.764850|0.194889|5.615088|9.144776|6.237022|3.643499|2.921965|2.512167|2.165716|2.093057|2.310070|2.747448|3.259346|1.723301|1.521108|1.966676|1.328078|1.265915|2.192181|1.319937|1.392942|4.145564|4.410036|0.157907|3.468969|2.938757|3.277132|7.020285|22.730736|0.300315|0.301709|0.500000| |6.158731|6.574055|8.696036|17.764214|9.040686|5.583773|4.818436|5.496708|5.830611|0.098084|4.420904|0.108663|3.650286|6.853766|3.988050|2.525728|2.280679|1.979714|1.812549|1.850859|2.088309|2.354763|2.972178|1.640249|1.456409|1.851423|1.247360|1.175071|2.056695|1.240358|1.328911|2.644938|2.511105|0.077993|2.189998|1.916060|2.005042|4.065628|53.539910|0.214886|0.146027|0.133018|0.500000| |2.995308|3.685824|4.965110|5.656050|8.809357|17.738409|9.071285|5.694787|5.708679|0.108462|3.392597|0.084480|2.905536|5.253421|3.392552|2.196240|2.165905|1.932132|1.856440|1.968692|2.217903|2.346931|3.255740|1.847158|1.648164|2.028836|1.368486|1.258044|2.188690|1.312481|1.441743|2.350016|2.104735|0.061452|1.929868|1.688946|1.683637|3.357099|54.696330|0.084301|0.077390|0.074061|0.124169|0.500000| |3.232090|4.293842|5.505156|4.818102|5.533138|8.974238|17.756387|8.745876|9.231120|0.192737|4.533321|0.110504|3.777114|6.476421|4.421894|2.757598|2.778875|2.455613|2.351578|2.502576|2.848090|3.033932|4.061738|2.260461|1.971377|2.383518|1.595309|1.447406|2.484708|1.492408|1.658222|3.105406|2.627997|0.075287|2.394547|2.041570|1.998437|4.062366|31.615734|0.085057|0.083620|0.081521|0.105282|0.216610|0.500000| |3.339840|3.438187|2.891920|2.409884|2.160283|2.194332|2.498788|2.959065|4.862593|0.100708|4.242597|0.115680|5.983771|9.314336|12.546373|17.671939|8.869220|7.216553|4.750687|3.963294|4.180180|5.605885|5.548354|2.671506|2.260520|2.988429|1.965040|1.884606|3.201674|1.964235|2.058960|7.298415|6.221138|0.143512|4.474635|4.442347|5.299132|13.874588|14.656261|0.078215|0.100983|0.096057|0.064010|0.055057|0.067707|0.500000| |3.868587|4.000177|3.347211|2.772672|2.455430|2.468350|2.799110|3.360179|5.395950|0.108106|4.752968|0.118130|7.716937|14.502771|12.516108|17.688909|8.866351|5.737666|4.241582|3.961387|4.660376|6.948092|5.519307|2.771631|2.294690|2.998528|1.935446|1.843134|3.188219|1.989108|2.112582|5.666281|4.661071|0.121509|3.458857|3.269558|3.769065|9.046048|16.477151|0.089450|0.124330|0.104900|0.073555|0.061281|0.074460|0.303309|0.500000| |2.450997|2.613321|2.346906|2.006863|1.869359|1.956016|2.235491|2.513950|4.072961|0.089550|3.184314|0.087843|3.942364|6.319350|7.184393|6.976710|8.890517|17.689919|8.989573|5.652875|4.960306|5.666766|7.634575|3.335059|2.816788|3.752421|2.467324|2.346051|3.853390|2.345219|2.466873|5.375036|4.428067|0.100705|3.919410|4.084217|4.130351|8.624810|12.890066|0.059815|0.071356|0.069539|0.052695|0.050236|0.062920|0.219832|0.146661|0.500000| |1.972457|2.132808|2.006707|1.762196|1.691089|1.803758|2.045745|2.194757|3.430633|0.076978|2.509847|0.068087|2.923392|4.911860|4.716973|4.078469|5.610666|8.890893|17.741684|8.961108|5.660761|4.970440|13.513024|4.881219|4.130210|5.527495|3.562756|3.256552|5.079359|3.079903|3.330221|3.489969|2.938367|0.071179|2.784946|2.833484|2.742141|5.354464|11.855577|0.049449|0.056841|0.054828|0.046005|0.047346|0.059128|0.112647|0.097801|0.215489|0.500000| |2.311768|2.602946|2.568618|2.269251|2.224379|2.430165|2.775660|2.888661|4.327893|0.096694|2.970758|0.074102|3.539070|6.606089|4.952900|4.093608|5.632310|4.965737|5.634392|8.865901|17.759949|8.953025|12.485639|7.359451|4.647718|5.295733|3.057344|2.656413|4.582954|2.993960|3.629501|3.165011|2.556646|0.066520|2.267343|2.139076|2.165123|4.450438|15.358945|0.058306|0.067877|0.060738|0.057954|0.063858|0.080870|0.096432|0.110696|0.107711|0.124189|0.500000| |3.203284|3.653610|3.420723|2.872184|2.679736|2.841952|3.308811|3.754166|5.878929|0.125703|4.313011|0.101636|6.011814|12.246735|8.051739|6.993056|8.928812|5.668883|4.967704|5.651971|8.958016|17.707013|7.463286|3.896816|2.975439|3.688124|2.285126|2.093720|3.630224|2.311787|2.588413|4.354138|3.356820|0.088341|2.760473|2.544232|2.676389|5.847605|17.804040|0.077616|0.097554|0.082632|0.073215|0.071446|0.091372|0.141520|0.203734|0.124262|0.107814|0.217750|0.500000| |1.808909|1.972742|1.949383|1.775216|1.757116|1.895128|2.095236|2.136950|3.130617|0.068891|2.189962|0.056561|2.504492|4.595101|3.571051|2.960138|3.801616|3.882747|4.883680|7.223914|6.856624|4.664776|16.539738|17.577385|8.796789|9.586244|4.616747|3.783958|6.609911|4.620401|6.562593|2.411697|2.055822|0.053361|1.892951|1.843788|1.851668|3.657461|12.564882|0.046478|0.052760|0.048288|0.046156|0.050894|0.061097|0.075081|0.080179|0.090153|0.122706|0.224453|0.114832|0.500000| |1.844153|2.056870|2.065948|1.871291|1.877587|2.075570|2.332315|2.331625|3.425960|0.077334|2.312922|0.059771|2.573878|4.622924|3.643198|2.877984|3.676418|3.744330|4.698110|6.946910|6.641095|4.517113|16.525926|17.526669|8.901816|7.642409|4.207856|3.295216|5.506367|3.515275|4.716996|2.517687|2.110100|0.054799|1.965898|1.876687|1.846135|3.650001|13.308155|0.047401|0.052932|0.049179|0.047992|0.056132|0.069861|0.072331|0.076144|0.087162|0.118566|0.223323|0.111902|0.301000|0.500000| |1.505943|1.639964|1.646576|1.525759|1.537071|1.671553|1.824662|1.811173|2.609748|0.057563|1.798510|0.047293|1.963927|3.533408|2.777552|2.195222|2.648920|2.780354|3.396774|4.251740|3.848647|3.007043|10.282486|8.931186|17.419083|12.255538|6.540315|4.474022|7.548444|4.704886|7.366554|1.955808|1.708801|0.044640|1.625483|1.585157|1.559298|3.001610|11.197214|0.039243|0.043150|0.040469|0.039715|0.045805|0.054019|0.057166|0.058906|0.068503|0.093569|0.118016|0.076788|0.206265|0.223263|0.500000| |1.541257|1.684000|1.674764|1.532459|1.533282|1.671793|1.849639|1.855485|2.725505|0.060921|1.880793|0.050028|2.052929|3.612536|2.971890|2.346103|2.880971|3.173964|4.083578|4.978893|4.057778|3.158511|13.488353|9.024727|17.588053|12.530863|7.692449|4.852694|7.252928|4.240907|5.737840|2.142299|1.860907|0.047952|1.793566|1.756259|1.700995|3.258295|11.063044|0.039893|0.043918|0.041815|0.039801|0.045503|0.055016|0.061724|0.061419|0.078465|0.118172|0.115568|0.077931|0.174832|0.213000|0.302470|0.500000| |1.286898|1.375707|1.364969|1.271326|1.271004|1.360987|1.470803|1.475466|2.130972|0.046517|1.500673|0.040219|1.626491|2.891728|2.335537|1.852201|2.167674|2.361629|2.839710|3.160450|2.746740|2.305867|7.175903|4.527396|6.974913|12.235853|17.415295|8.885301|12.498472|5.862939|7.040951|1.682242|1.513884|0.039385|1.470419|1.468533|1.437222|2.698305|9.364065|0.033670|0.036777|0.035048|0.033478|0.037253|0.043043|0.049813|0.049504|0.060888|0.083856|0.078083|0.058709|0.114529|0.109199|0.187698|0.191993|0.500000| |1.369843|1.468263|1.443872|1.329451|1.319915|1.415468|1.546921|1.568237|2.299969|0.050627|1.625397|0.043841|1.771740|3.107483|2.592593|2.068368|2.462012|2.788561|3.486161|3.762359|3.069714|2.560730|8.892848|4.967088|7.231728|12.478536|17.565104|8.905488|10.173213|5.058233|5.731286|1.892628|1.694082|0.043531|1.656955|1.665405|1.613887|3.023285|9.626429|0.035584|0.039086|0.037542|0.034930|0.038462|0.045336|0.056061|0.054319|0.072180|0.108270|0.083931|0.063581|0.118629|0.116037|0.160406|0.235348|0.300418|0.500000| |1.205165|1.270012|1.244960|1.159637|1.148147|1.213778|1.306239|1.327480|1.925051|0.041651|1.381862|0.037397|1.503034|2.661025|2.182966|1.749612|2.009527|2.231069|2.624900|2.731052|2.358808|2.060587|5.802799|3.300469|4.177779|7.685660|8.844642|17.609976|16.912768|5.892448|5.058960|1.584274|1.454509|0.037697|1.423835|1.452639|1.426732|2.636285|8.486205|0.031533|0.034521|0.033107|0.030792|0.033034|0.037794|0.048100|0.046774|0.059294|0.079995|0.064811|0.052358|0.087570|0.079611|0.106013|0.115827|0.217426|0.210570|0.500000| |1.329604|1.399941|1.360051|1.256011|1.234047|1.301804|1.410404|1.449344|2.122631|0.045991|1.535851|0.041482|1.698442|3.006643|2.498582|2.046650|2.395558|2.723148|3.290329|3.376817|2.815092|2.435273|7.233985|3.907362|4.718723|9.545477|8.882913|17.503346|16.551314|7.296724|5.912299|1.802103|1.643583|0.042242|1.594956|1.638410|1.619537|3.010046|9.045299|0.034547|0.038312|0.036568|0.033338|0.035160|0.040662|0.056484|0.054486|0.072043|0.102508|0.075663|0.060740|0.104980|0.089984|0.111237|0.126392|0.174016|0.217821|0.300147|0.500000| |1.304166|1.364764|1.339806|1.257308|1.242225|1.300711|1.386177|1.411554|2.021908|0.043144|1.461624|0.038798|1.622144|2.965298|2.309854|1.894741|2.175862|2.295080|2.627073|2.894883|2.676872|2.326348|5.884140|3.670468|4.174631|7.683653|5.056249|5.891461|16.918445|17.608588|8.845646|1.607861|1.466194|0.038466|1.389136|1.404257|1.421998|2.684328|9.221811|0.034194|0.037980|0.035343|0.033543|0.035321|0.039634|0.051144|0.052403|0.059262|0.074306|0.076546|0.060504|0.112513|0.086794|0.113077|0.098157|0.131559|0.110678|0.132316|0.147802|0.500000| |1.407543|1.474491|1.432518|1.328419|1.302156|1.364547|1.469539|1.513717|2.199422|0.047183|1.600595|0.042619|1.799653|3.262251|2.611526|2.184294|2.563024|2.792770|3.291690|3.561775|3.132819|2.692821|7.324533|4.267252|4.711660|9.530641|5.902057|7.290405|16.551118|17.502519|8.878618|1.822734|1.653554|0.042888|1.564873|1.595617|1.615190|3.052867|9.563015|0.036595|0.041069|0.038344|0.035371|0.036773|0.042013|0.059421|0.059706|0.071994|0.095204|0.086424|0.068111|0.129503|0.096028|0.115936|0.111471|0.134435|0.132431|0.147774|0.217893|0.300165|0.500000| |1.525670|1.625164|1.602857|1.488019|1.473877|1.563483|1.688681|1.716332|2.474465|0.053414|1.763041|0.046182|1.982602|3.644539|2.818117|2.328196|2.797603|2.915614|3.482725|4.235685|3.925149|3.155736|9.168861|6.656420|7.183915|12.416569|5.718917|5.056526|10.185670|8.921074|17.564359|1.932099|1.711292|0.044722|1.599389|1.589572|1.605158|3.095539|10.782128|0.039682|0.044520|0.040999|0.039256|0.042330|0.048694|0.061169|0.064096|0.071996|0.094684|0.117353|0.080817|0.235132|0.143294|0.189389|0.143425|0.142800|0.127677|0.110656|0.132397|0.211460|0.217698|0.500000| |1.361634|1.450821|1.443026|1.351407|1.350620|1.437909|1.542770|1.548094|2.214075|0.047844|1.564922|0.041325|1.720528|3.131687|2.433206|1.959010|2.297780|2.410562|2.842968|3.322804|3.060695|2.535806|7.280770|5.166858|6.979814|12.269774|7.061663|5.877237|12.518158|8.880083|17.411047|1.700614|1.522614|0.039949|1.446011|1.436324|1.434418|2.731545|9.978934|0.035677|0.039349|0.036701|0.035669|0.039315|0.044768|0.051925|0.053570|0.060888|0.079576|0.090988|0.065738|0.152040|0.121506|0.216152|0.147908|0.207057|0.143244|0.131789|0.134737|0.217186|0.173912|0.300940|0.500000| |3.209490|3.586711|3.096194|2.509883|2.288693|2.410188|2.858433|3.395392|6.019565|0.135010|4.915568|0.145534|5.845922|7.948778|12.621367|7.540859|6.780252|6.615258|4.816752|3.985680|4.017473|4.914792|5.710075|2.702559|2.308584|2.954116|1.978028|1.849948|3.073109|1.844959|1.972089|17.624843|8.895153|0.174224|6.909581|5.665482|5.283130|12.761652|15.229171|0.075676|0.089588|0.093577|0.064763|0.060404|0.079714|0.212549|0.148663|0.199156|0.117811|0.093423|0.121173|0.072271|0.075518|0.058335|0.065287|0.050503|0.057850|0.047736|0.054883|0.047546|0.054697|0.057418|0.050374|0.500000| |3.894765|4.697050|3.985583|3.066241|2.756267|2.931343|3.607271|4.533401|8.923410|0.201668|7.369979|0.243603|7.107569|8.785153|12.318455|5.678291|4.959139|4.422199|3.616438|3.294171|3.494973|4.213883|4.901245|2.429133|2.090748|2.635084|1.772291|1.646801|2.760269|1.652496|1.779860|17.574195|8.883336|0.212834|6.814848|4.726717|4.395336|10.214454|17.720667|0.090154|0.103039|0.113959|0.077322|0.071771|0.099294|0.145443|0.127480|0.122675|0.089536|0.085718|0.113005|0.065070|0.069889|0.053986|0.059140|0.046010|0.051528|0.042785|0.048076|0.043011|0.048260|0.051869|0.046201|0.306180|0.500000| |2.854904|3.094292|2.721217|2.271397|2.084836|2.175106|2.519006|2.916719|4.893230|0.105918|3.928273|0.130361|3.847752|5.525573|6.408680|3.903074|3.549676|3.630102|3.088996|2.688253|2.651774|2.977611|4.190830|2.059524|1.847274|2.385282|1.651274|1.560416|2.587808|1.518949|1.601231|7.345385|8.645922|0.182691|17.565737|8.691187|5.786157|10.696581|14.137088|0.069534|0.075793|0.087149|0.059348|0.055103|0.070152|0.115215|0.091073|0.111406|0.082322|0.065598|0.077629|0.054734|0.057882|0.047491|0.053041|0.042799|0.048585|0.041104|0.045921|0.039448|0.044492|0.045774|0.041591|0.206794|0.208865|0.500000| |3.096790|3.195431|2.741868|2.313730|2.084867|2.114689|2.390692|2.798491|4.532322|0.092667|3.843976|0.133068|3.622043|5.286539|5.671074|3.446994|2.982462|2.938900|2.516176|2.245009|2.261121|2.557963|3.535631|1.777323|1.605973|2.092231|1.451562|1.386276|2.326061|1.366162|1.428034|5.720593|8.750403|0.229674|17.580110|8.769840|6.572118|11.093147|14.251569|0.075751|0.080648|0.099183|0.061655|0.053307|0.064885|0.102822|0.084482|0.089209|0.066927|0.056971|0.068783|0.047943|0.049896|0.041730|0.045636|0.037863|0.042256|0.036649|0.040649|0.035829|0.039960|0.040929|0.037287|0.142122|0.157412|0.303034|0.500000| |2.426234|2.500098|2.200655|1.892801|1.741982|1.789633|2.016774|2.290101|3.682851|0.078347|2.997890|0.092531|3.216191|4.885756|5.501135|3.906289|3.561786|3.922986|3.272388|2.703191|2.573195|2.863611|4.223659|2.040052|1.850173|2.460333|1.714177|1.656442|2.738406|1.602847|1.653591|5.315469|6.506107|0.136136|8.774636|17.568289|8.865608|12.397583|12.113028|0.059746|0.067118|0.073557|0.050444|0.045873|0.055956|0.128006|0.091453|0.133575|0.090440|0.062783|0.072931|0.054731|0.055654|0.047001|0.052813|0.043869|0.050438|0.043632|0.049624|0.041500|0.047684|0.047067|0.042457|0.169276|0.127038|0.221352|0.174943|0.500000| |2.387896|2.402262|2.112202|1.839881|1.686054|1.709867|1.899185|2.152314|3.385476|0.070349|2.783605|0.088038|2.844782|4.368898|4.573181|3.130643|2.796330|2.930140|2.529291|2.186048|2.126178|2.353350|3.484200|1.729388|1.586682|2.110743|1.481581|1.438171|2.399087|1.397877|1.436595|4.240365|5.706791|0.134629|8.671467|17.600076|8.706258|10.372103|11.831057|0.059591|0.064906|0.074088|0.049576|0.043865|0.052169|0.099062|0.076916|0.093821|0.069626|0.053154|0.061776|0.046677|0.047562|0.040865|0.045174|0.038349|0.043310|0.038186|0.042673|0.036540|0.041253|0.040836|0.037265|0.120485|0.107499|0.191030|0.220856|0.301643|0.500000| |2.610264|2.539369|2.178745|1.894009|1.712537|1.713880|1.893245|2.173859|3.412647|0.069840|2.914216|0.087948|3.260465|5.125792|5.458184|4.141054|3.447649|3.564538|2.904736|2.459824|2.417637|2.767557|3.817165|1.882185|1.700118|2.296329|1.584714|1.557488|2.627101|1.555410|1.582655|4.533088|5.958265|0.138025|5.715428|8.655446|17.639569|16.730696|12.014502|0.064037|0.074441|0.080406|0.051547|0.043717|0.051396|0.146790|0.102664|0.119116|0.078307|0.059503|0.072424|0.051878|0.050926|0.043510|0.047481|0.040607|0.045721|0.040856|0.046726|0.040769|0.046644|0.045551|0.040562|0.129304|0.103516|0.128087|0.134393|0.218385|0.193331|0.500000| 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