Version2.1 2021-01-08T14:41:39Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 25-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cn1c2ccccc2c(c(c1=O)C(=O)C[C@@H](c3ccccc3O)[NH2+]Cc4ccncc4)O C03846551 RHF 6-31G(d) (6D,7F) Cn1c2ccccc2c(c(c1=O)C(=O)C[C@@H](c3ccccc3O)[NH2+]Cc4ccncc4)O C01[X(C25H24N3O4)] 162 C1 528 Oc1ccccc1[C@H](CC(=O)c1c(O)c2ccccc2n(c1=O)C)[NH2+]Cc1ccncc1 Oc1ccccc1[C@H](CC(=O)c1c(O)c2ccccc2n(c1=O)C)[NH2+]Cc1ccncc1 CN1C(=O)C(=C(O)c2ccccc12)C(=O)C[C@H]([NH2+]Cc3ccncc3)c4ccccc4O InChIKey=NHKXRCDVIKWJAY-IBGZPJMESA-O InChI=1S/C25H23N3O4/c1-28-20-8-4-2-7-18(20)24(31)23(25(28)32)22(30)14-19(17-6-3-5-9-21(17)29)27-15-16-10-12-26-13-11-16/h2-13,19,27,29,31H,14-15H2,1H3/p+1/t19-/m0/s1 InChI=1/C25H23N3O4/c1-28-20-8-4-2-7-18(20)24(31)23(25(28)32)22(30)14-19(17-6-3-5-9-21(17)29)27-15-16-10-12-26-13-11-16/h2-13,19,27,29,31H,14-15H2,1H3/p+1/t19-/m0/s1/fC25H24N3O4/h27H/q+1 Cn1c2ccccc2c(c(c1=O)C(=O)C[C@@H](c3ccccc3O)[NH2+]Cc4ccncc4)O C01[X(C25H24N3O4)] 162 C01 528 Oc1ccccc1[C@H](CC(=O)c1c(O)c2ccccc2n(c1=O)C)[NH2+]Cc1ccncc1 O=C1N(C)[C]2[CH][CH][CH][CH][C]2[C]([C]1[C]([O])C[C@@H]([C]1[CH][CH][CH][CH][C]1O)[NH2]C[C]1[CH][CH][N][CH][CH]1)[OH] CN1[C]2[CH][CH][CH][CH][C]2[C](O)[C]([C]([O])C[C@H]([NH2]C[C]3[CH][CH][N][CH][CH]3)[C]4[CH][CH][CH][CH][C]4O)C1=O InChIKey=KIXJQSBVQIIPLY-IBGZPJMESA-N InChI=1S/C25H24N3O4/c1-28-20-8-4-2-7-18(20)24(31)23(25(28)32)22(30)14-19(17-6-3-5-9-21(17)29)27-15-16-10-12-26-13-11-16/h2-13,19,29,31H,14-15,27H2,1H3/t19-/m0/s1 InChI=1/C25H24N3O4/c1-28-20-8-4-2-7-18(20)24(31)23(25(28)32)22(30)14-19(17-6-3-5-9-21(17)29)27-15-16-10-12-26-13-11-16/h2-13,19,29,31H,14-15,27H2,1H3/t19-/m0/s1 3058.0570987287 -1423.3379066 1-A 18228.4778 113 415 528 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.71700 -20.71502 -20.68360 -20.61866 -15.81671 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34.7648 26.4056 68.0916 13.9710 26.2590 77.5075 84.2161 89.2975 80.9051 53.1524 225.9050 184.8721 215.7122 36.6516 91.0163 100.8749 121.3807 18.9767 22.9618 95.0929 0.7500 0.7464 0.7500 0.7484 0.7494 0.7496 0.7006 0.7499 0.6938 0.7159 0.6882 0.7494 0.6194 0.2090 0.6651 0.7470 0.4622 0.7443 0.6410 0.7499 0.7500 0.4208 0.3940 0.7359 0.3257 0.4839 0.7499 0.7453 0.4400 0.3864 0.5158 0.5511 0.7408 0.6922 0.7495 0.1647 0.3874 0.1164 0.7462 0.7425 0.5653 0.5930 0.7486 0.2237 0.7268 0.7486 0.1138 0.7412 0.6312 0.6816 0.6010 0.0852 0.0234 0.7301 0.1146 0.7136 0.7499 0.7399 0.4519 0.1344 0.7402 0.1188 0.5774 0.1414 0.1156 0.7197 0.7455 0.5914 0.7415 0.6198 0.4950 0.7298 0.2738 0.1847 0.7432 0.7448 0.7301 0.7463 0.5369 0.1880 0.6297 0.0721 0.1838 0.7288 0.6072 0.1641 0.6508 0.5962 0.3064 0.3619 0.5253 0.7487 0.4560 0.3779 0.6320 0.7218 0.5473 0.1443 0.0957 0.7200 0.2692 0.3254 0.4211 0.1346 0.2365 0.2742 0.6008 0.7036 0.3448 0.5509 0.2839 0.7470 0.3846 0.6706 0.7402 0.5410 0.6177 0.6379 0.4439 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0.4242 0.4911 0.5926 0.2372 0.3825 0.4303 0.7506 0.8260 0.5128 0.7104 0.4422 0.8552 0.5555 0.8028 0.8507 0.7022 0.7637 0.7789 0.6148 0.7664 0.3708 0.4152 0.7983 0.2553 0.8571 0.5549 0.7619 0.4945 0.5082 0.6690 0.8544 0.3897 0.6098 0.8181 0.6725 0.7624 0.4485 0.8559 0.1040 0.0778 0.0555 0.8571 0.6466 0.0791 0.5601 0.8265 0.6644 0.5810 0.8500 0.7273 0.7479 0.8401 0.2174 0.4841 0.2440 0.6978 0.3341 0.3134 0.3198 0.8566 0.4908 0.4509 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 6 7 6 6 6 6 6 6 6 6 6 8 6 8 6 6 1 6 6 6 6 6 6 8 7 1 1 6 6 6 6 7 6 6 8 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 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 9688.4877 25164.8544 31922.9758 1.00000 -0.00225 -0.00176 0.00223 0.99995 -0.00948 0.00178 0.00948 0.99995 1 0.00894 0.00344 0.00271 0.18628 0.07172 0.05653 23.06 28.68 34.16 37.05 52.42 75.45 82.17 104.76 117.13 149.89 177.40 200.26 210.67 248.55 256.60 265.62 317.32 343.73 351.73 414.05 430.76 440.90 459.45 504.12 511.62 526.84 531.32 599.93 625.83 632.00 638.11 676.48 686.49 695.66 705.87 760.86 790.00 796.53 824.16 842.17 850.05 876.69 890.70 928.09 937.21 962.22 1039.79 1057.12 1075.03 1099.15 1121.21 1176.96 1191.63 1197.46 1212.76 1218.89 1236.44 1237.87 1262.28 1274.61 1298.85 1318.71 1341.14 1356.59 1382.38 1401.34 1404.14 1406.55 1417.83 1518.42 1553.20 1558.31 1570.84 1574.23 1587.15 1595.82 1618.81 1625.56 1634.63 1637.79 1640.76 1652.52 1665.47 1677.87 1688.86 1703.37 1720.53 1732.46 1758.08 1797.98 1811.93 1816.91 1824.67 1871.25 1872.90 1897.30 1905.93 1917.70 1918.28 1945.33 1956.12 1984.32 1989.94 2018.13 2028.19 2045.42 2096.05 2126.45 2128.21 2141.14 2157.71 2161.44 2213.45 2234.86 2250.68 2265.29 2271.24 2275.06 2296.96 2299.80 2326.10 2344.10 2368.98 2382.06 2391.64 2411.14 2417.52 2419.94 2488.60 2555.64 2561.81 2580.98 2597.74 2605.12 2611.31 2620.72 2640.27 2719.81 4664.86 4701.92 4746.87 4759.76 4798.71 4819.70 4837.89 4839.74 4847.32 4847.65 4848.99 4866.41 4877.65 4881.18 4887.08 4894.51 4900.71 4908.08 4928.74 4949.68 5188.75 5352.06 5501.57 5898.35 0.491442 0.517062 0.518007 0.431716 -1422.846464 -1422.820844 -1422.819900 -1422.906190 2.894181D-04 MUNgauss RevisionA2.0 retrievium 08-Jan-2021 DUDE Cn1c2ccccc2c(c(c1=O)C(=O)C[C@@H](c3ccccc3O)[NH2+]Cc4ccncc4)O C03846551 RHF 6-31G(d) (6D,10F) C1 430.176681 |X|Y|Z| 67.399894 112.829727 30.905650 61.712558 27 6 7 24 3 |36.858105| |13.015391|53.358707| |7.745885|18.735950|36.858105| |6.727889|10.683627|13.598145|36.858105| |4.528623|7.052412|7.920683|13.852617|36.858105| |3.745241|6.179099|6.773516|7.867525|13.642435|36.858105| |3.892232|7.005784|7.821643|6.857502|8.009596|13.927850|36.858105| |5.078877|10.730719|13.606736|7.922442|6.917428|7.910543|13.562450|36.858105| |4.477721|9.290601|7.807936|5.128161|4.546019|5.117030|7.710910|13.260310|36.858105| |5.052910|10.658358|6.766384|4.518408|3.783143|3.917468|5.097038|7.760045|13.710406|36.858105| |7.841298|18.825235|7.848817|5.142399|3.942363|3.755502|4.483197|6.696612|7.720633|12.997603|36.858105| |7.111839|11.543225|5.414214|4.076505|3.229956|3.050039|3.491052|4.700687|5.330481|8.136993|15.761643|73.516695| |3.836088|6.881888|4.465062|3.361624|2.953255|3.094284|3.867882|5.039071|7.758436|13.124586|7.508713|11.850855|36.858105| |3.141126|5.438566|3.802225|2.985002|2.734382|2.960509|3.731942|4.520672|6.857176|8.153446|5.208622|8.301778|15.490479|73.516695| |3.619449|5.909421|3.636848|2.882379|2.516053|2.554139|3.021869|3.770086|4.935539|7.321501|6.317311|12.621562|12.515448|14.410407|36.858105| |2.813376|4.410987|2.867474|2.372917|2.137766|2.198463|2.563713|3.027705|3.827838|4.881231|4.215848|8.098986|7.473667|12.470838|12.425870|36.858105| |2.681380|4.241321|2.828800|2.350318|2.142596|2.229009|2.613705|3.046089|3.869659|4.724844|3.949584|7.248359|7.030071|12.890883|8.888796|17.690650|0.500000| |2.565197|3.828932|2.469407|2.103007|1.894956|1.917075|2.174750|2.523994|3.016731|3.719691|3.511848|7.066130|4.880856|8.019825|7.467290|12.585507|0.248319|36.858105| |2.598912|3.760399|2.383822|2.051584|1.833934|1.828640|2.045610|2.376297|2.766971|3.414695|3.410673|7.172667|4.208153|6.704834|6.272440|7.486095|0.155458|13.673934|36.858105| |2.307434|3.245920|2.080630|1.831382|1.648366|1.633372|1.797728|2.053388|2.324657|2.774661|2.827635|5.870133|3.244982|5.284829|4.367521|4.989431|0.116460|7.868477|13.789799|36.858105| |2.076497|2.925528|1.908287|1.695378|1.541757|1.534881|1.682949|1.897505|2.135583|2.492851|2.502747|5.045966|2.895737|4.835275|3.725110|4.430609|0.111268|6.837012|7.979510|13.740613|36.858105| |2.055739|2.951345|1.947296|1.720907|1.574655|1.583008|1.748920|1.965696|2.238438|2.597127|2.535871|4.997509|3.079510|5.247438|3.921864|5.017984|0.133584|7.883076|6.898468|7.926620|13.783967|36.858105| |2.253810|3.322195|2.189133|1.899777|1.734082|1.758921|1.974758|2.243464|2.625214|3.099368|2.931210|5.730140|3.865494|6.631082|5.129030|7.577115|0.204980|13.658627|7.960550|6.861525|7.948891|13.736749|36.858105| |2.152041|3.221993|2.171468|1.886312|1.742624|1.790404|2.022242|2.270047|2.674401|3.072621|2.809360|5.284326|3.843128|6.917567|4.677958|6.878569|0.230793|8.110920|5.270382|4.614726|5.226149|7.957215|14.086332|73.516695| |2.503120|3.920015|2.629104|2.203751|2.021744|2.108104|2.461297|2.835152|3.576339|4.284896|3.612429|6.690000|6.302552|12.491622|7.647496|12.537858|0.256080|7.647678|5.862831|4.240410|3.771362|4.126742|5.578961|9.484195|53.358707| |2.503382|3.857740|2.559057|2.159238|1.971381|2.035487|2.351013|2.710344|3.344370|4.025293|3.538090|6.716733|5.569116|10.245411|6.965381|9.122531|0.181686|7.064908|6.341918|4.517070|3.818346|3.948475|5.008333|7.969391|25.703563|0.500000| |2.601718|4.183554|2.857073|2.364348|2.180955|2.308118|2.747760|3.172462|4.149141|4.885970|3.867009|6.854266|7.548455|17.621944|7.477344|9.344334|0.226323|5.717728|4.647755|3.525110|3.174270|3.447875|4.479214|8.016577|25.578227|0.324744|0.500000| |2.101693|3.226444|2.215496|1.905452|1.780061|1.865987|2.146687|2.392764|2.915124|3.291639|2.841077|5.199042|4.386567|8.967404|4.919924|7.422503|0.196794|6.174591|4.786097|3.841387|3.663222|4.173211|5.483900|10.110554|17.278483|0.256807|0.256459|36.858105| |1.925201|2.941450|2.054632|1.788855|1.691509|1.784626|2.041681|2.232277|2.675672|2.916279|2.528761|4.559173|3.690102|7.653632|3.862465|4.930274|0.130309|4.280827|3.723491|3.142177|2.972703|3.226567|3.870893|7.026508|10.545017|0.201174|0.200368|12.630630|36.858105| |1.871715|2.889545|2.064663|1.803528|1.729342|1.853248|2.133567|2.290035|2.747568|2.880558|2.445754|4.290484|3.556869|7.728863|3.456727|4.118153|0.114172|3.462840|3.035796|2.602021|2.482971|2.694299|3.188352|5.986556|7.989900|0.148571|0.177372|7.562040|13.735391|36.858105| |1.713597|2.615879|1.886238|1.672415|1.618066|1.734015|1.970585|2.080615|2.431863|2.501749|2.168586|3.796987|2.951312|6.180815|2.851551|3.229002|0.088353|2.829346|2.585187|2.275352|2.168853|2.302322|2.627575|4.841988|5.831697|0.116120|0.127507|5.042468|7.996726|13.747001|36.858105| |1.623249|2.441259|1.746056|1.560928|1.504934|1.594658|1.789090|1.893129|2.176625|2.263991|2.013012|3.574695|2.631799|5.297069|2.617816|2.941750|0.078645|2.682297|2.527883|2.264122|2.147477|2.235885|2.491509|4.473278|5.216010|0.109282|0.108911|4.448632|6.866671|7.998765|14.435769|53.358707| |1.656564|2.471902|1.740995|1.552284|1.481378|1.552895|1.737260|1.862689|2.143831|2.282486|2.057619|3.720420|2.685661|5.283956|2.777070|3.192231|0.083310|3.000237|2.869501|2.577922|2.427559|2.501371|2.768472|4.849612|5.758597|0.125420|0.113836|5.042326|7.995549|7.046193|8.417289|19.666073|36.858105| |1.794755|2.690410|1.870254|1.648888|1.558231|1.627716|1.834177|1.996844|2.335054|2.545811|2.282879|4.176245|3.099962|6.101035|3.321000|4.040307|0.103439|3.812194|3.561846|3.119419|2.923016|3.051551|3.466546|6.003237|7.799789|0.171179|0.144017|7.566701|13.746244|8.004475|7.047301|10.888151|13.734945|36.858105| |3.430514|6.339893|5.302911|4.033169|3.885681|4.660951|7.004963|8.215555|14.635883|8.025488|5.166570|7.199708|6.719023|13.239902|4.375718|3.698416|0.107131|2.882421|2.592405|2.190674|2.040924|2.167893|2.555379|4.747209|4.940239|0.092259|0.120908|3.048764|2.851928|3.039756|2.681039|3.186784|2.258541|2.439506|73.516695| |17.606950|12.352817|6.915214|6.803916|4.645312|3.739498|3.756736|4.679128|4.026544|4.338788|6.069248|9.930387|3.388073|5.078782|3.182027|2.534204|0.066820|2.323022|2.376805|2.129658|1.914444|1.882987|2.047642|3.475063|3.155509|0.065104|0.067129|1.964414|1.829690|1.788419|1.657397|2.149467|1.606387|1.721907|5.649582|0.500000| |17.750247|12.537695|5.718635|4.902943|3.622366|3.139143|3.318750|4.248383|4.055016|4.876097|7.794048|15.575504|3.915882|5.599565|3.929051|3.011385|0.078255|2.802329|2.904150|2.577207|2.284329|2.230318|2.432136|4.048143|3.585598|0.073926|0.074760|2.192779|1.989442|1.905180|1.736780|2.253423|1.707796|1.865467|5.655148|0.300956|0.500000| |17.607757|12.356729|6.893696|6.796204|4.632240|3.724634|3.739525|4.657514|4.012372|4.340722|6.063588|9.887971|3.398593|5.067612|3.223233|2.586217|0.069745|2.386935|2.394245|2.159539|1.977270|1.970159|2.143107|3.673648|3.114865|0.062935|0.065763|1.956642|1.788735|1.744490|1.598963|2.059430|1.540647|1.666117|5.627321|0.299326|0.300955|0.500000| |7.659568|9.671363|8.839677|17.808915|9.015709|5.637056|4.951704|5.628367|4.150474|3.918159|4.696419|7.022196|3.025988|4.748231|2.699585|2.234346|0.061022|2.020507|1.998592|1.803715|1.667529|1.677428|1.830732|3.201559|2.810228|0.056650|0.060685|1.792969|1.681657|1.680320|1.563646|2.003960|1.473477|1.564906|5.954522|0.231570|0.149037|0.233013|0.500000| |3.958882|5.715211|5.649905|9.015692|17.723892|8.895572|5.683940|4.975575|3.618072|3.132149|3.297682|4.993452|2.537473|4.211628|2.217499|1.914386|0.053258|1.722448|1.677551|1.524730|1.432205|1.457439|1.589212|2.834795|2.473344|0.049427|0.053979|1.618197|1.545018|1.577463|1.486904|1.894131|1.370508|1.434423|5.687662|0.115594|0.089919|0.115404|0.219521|0.500000| |3.107916|4.920625|4.902703|5.620700|8.860095|17.749742|8.955639|5.625291|4.145610|3.272570|3.110651|4.635608|2.702327|4.699537|2.266189|1.994664|0.056430|1.753445|1.671637|1.504889|1.423397|1.470174|1.624572|2.954436|2.630947|0.051838|0.058620|1.737792|1.677060|1.754314|1.656416|2.074705|1.475603|1.534749|7.151738|0.086904|0.074254|0.086591|0.124328|0.214119|0.500000| |3.261819|5.696921|5.610650|4.948353|5.668386|8.963803|17.770588|8.912051|7.130555|4.697887|3.915494|5.587883|3.801878|6.873623|2.938260|2.559227|0.073351|2.151904|2.001530|1.757598|1.655426|1.733681|1.966679|3.624455|3.406617|0.065794|0.078574|2.210471|2.122022|2.257951|2.088579|2.550557|1.798635|1.889561|14.249113|0.087419|0.079965|0.087039|0.107574|0.124465|0.214762|0.500000| |3.947264|6.287633|3.734487|2.973753|2.555748|2.546308|2.964340|3.719645|4.640433|6.809247|6.736123|14.627420|8.886182|10.824398|17.656017|8.936419|0.209774|7.037827|6.111806|4.462689|3.861895|4.054978|5.167466|8.271559|7.591471|0.143821|0.148540|4.073597|3.246442|2.935842|2.473517|3.121794|2.428324|2.858075|7.081826|0.093284|0.122146|0.099112|0.078422|0.062774|0.062511|0.078694|0.500000| |3.735037|5.911214|3.554219|2.847458|2.465399|2.468372|2.875240|3.575827|4.491423|6.491102|6.266100|13.703540|8.950791|11.330679|17.586600|8.695768|0.172983|6.636900|6.658946|4.570927|3.687208|3.672815|4.528569|7.039213|9.375810|0.203515|0.183276|4.506124|3.732397|3.302911|2.798737|3.579968|2.825423|3.350263|6.984909|0.092995|0.115553|0.089936|0.075057|0.060705|0.060862|0.076886|0.309616|0.500000| |2.832859|4.095215|2.555062|2.182705|1.933631|1.918445|2.149616|2.525015|2.943462|3.701853|3.773685|8.173332|4.515948|6.983597|6.818214|6.908891|0.140304|8.888797|17.712011|8.995202|5.677744|4.965115|5.647743|7.547518|7.941838|0.190105|0.133258|4.460749|3.652509|3.023012|2.609015|3.490908|2.900815|3.538610|4.825419|0.072410|0.088987|0.071013|0.059145|0.048973|0.048447|0.058034|0.176095|0.235273|0.500000| |2.262258|3.122415|1.997194|1.775214|1.595677|1.569824|1.712531|1.949412|2.173695|2.573058|2.676625|5.589980|2.922943|4.744848|3.799602|4.072554|0.096353|5.618100|8.926558|17.745803|8.893968|5.639985|4.948274|6.510951|4.935681|0.109883|0.086282|3.287636|2.816425|2.369004|2.116357|2.904022|2.427595|2.865479|3.622079|0.058617|0.070668|0.058665|0.048963|0.041212|0.040229|0.046297|0.107799|0.114569|0.217228|0.500000| |1.909635|2.655840|1.744229|1.568821|1.433050|1.421879|1.544733|1.725884|1.914390|2.200398|2.228279|4.457577|2.496168|4.192788|3.095143|3.544931|0.091135|4.934405|5.662728|8.909391|17.731225|8.958718|5.658307|7.499991|4.255558|0.088357|0.074995|3.092058|2.605918|2.213586|1.968991|2.677294|2.214595|2.606407|3.258616|0.049250|0.058184|0.050872|0.043104|0.037221|0.036797|0.042178|0.089403|0.085861|0.124686|0.214108|0.500000| |1.881629|2.691125|1.798433|1.605563|1.481135|1.491940|1.638562|1.819961|2.050965|2.331839|2.270901|4.400056|2.713166|4.694374|3.300860|4.096916|0.114381|5.621907|4.964129|5.637571|8.912214|17.703613|8.916806|12.808626|4.764495|0.092180|0.083680|3.672733|2.926856|2.496171|2.155630|2.848270|2.317711|2.774610|3.562827|0.048046|0.056179|0.050602|0.043509|0.038264|0.038718|0.045281|0.095045|0.085490|0.107712|0.123971|0.215779|0.500000| |1.989534|2.942595|1.998733|1.759260|1.635044|1.676532|1.874394|2.079111|2.403202|2.708014|2.512496|4.705044|3.262383|5.869717|3.834386|5.132860|0.165809|6.033491|4.426747|4.160906|4.984126|7.771115|9.951710|35.699114|5.774576|0.102663|0.102933|4.628932|3.447123|3.000723|2.485879|3.152186|2.497972|3.023805|4.275379|0.050382|0.058288|0.053591|0.046869|0.041831|0.043485|0.052508|0.108204|0.092650|0.100733|0.093856|0.116900|0.230903|0.500000| |2.069604|3.199492|2.224001|1.914083|1.800179|1.902088|2.197630|2.430273|2.972132|3.292501|2.795660|5.024193|4.365693|9.247098|4.671605|6.946005|0.218557|5.597547|4.189456|3.454195|3.418715|4.053591|5.420999|11.390752|12.444795|0.181385|0.222891|17.648350|8.814150|7.032683|4.685487|5.397962|4.224379|5.659454|5.636603|0.053428|0.059452|0.054065|0.049780|0.045406|0.049350|0.063412|0.110732|0.113317|0.106950|0.082105|0.080987|0.102314|0.144380|0.500000| |2.013074|3.031758|2.061708|1.790455|1.666697|1.728115|1.961737|2.185081|2.604924|2.962012|2.650169|4.957765|3.818839|7.338812|4.519523|6.835248|0.175340|6.979692|5.427789|4.477188|4.370887|5.059148|6.579415|11.303363|12.388394|0.221112|0.180752|17.673152|8.832496|5.624134|4.214087|5.406278|4.715728|7.131751|4.739972|0.052251|0.058932|0.052295|0.047268|0.042361|0.044771|0.055576|0.108461|0.117695|0.132687|0.103755|0.100717|0.121309|0.144277|0.301575|0.500000| |1.932689|3.022641|2.184278|1.897648|1.829201|1.982885|2.309704|2.466430|3.001744|3.089224|2.557782|4.409336|3.837836|8.769776|3.573699|4.220995|0.122807|3.420355|2.927036|2.497740|2.404243|2.649052|3.181572|6.180447|7.776422|0.136021|0.184453|6.926137|8.842198|17.710245|8.913225|7.763916|5.042460|5.652540|6.088577|0.051013|0.054209|0.050248|0.048709|0.046118|0.052164|0.068789|0.084546|0.091949|0.080528|0.062831|0.059467|0.068620|0.085920|0.207293|0.141415|0.500000| |1.654340|2.530225|1.850619|1.651884|1.615490|1.746748|1.982064|2.059018|2.383994|2.394371|2.069586|3.578273|2.759025|5.797074|2.598973|2.865736|0.079637|2.505746|2.295787|2.036971|1.951593|2.071525|2.347648|4.367106|4.942438|0.097482|0.110324|4.092879|5.663875|8.903271|17.724242|12.718597|5.915830|5.042982|4.749852|0.044624|0.046177|0.043042|0.042741|0.041310|0.046710|0.058985|0.063369|0.070532|0.064500|0.052926|0.049578|0.054347|0.062918|0.110618|0.096700|0.214604|0.500000| 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