Version2.0 2020-02-13T10:00:50Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 29-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCCOc1cccc(c1)[C@@H]2c3c(=O)c4cc(c(cc4oc3C(=O)N2c5nnc(s5)CC)C)Cl C40056498 RHF 6-31G(d) (6D,7F) CCCCCOc1cccc(c1)[C@@H]2c3c(=O)c4cc(c(cc4oc3C(=O)N2c5nnc(s5)CC)C)Cl C01[X(C27H26Cl1N3O4S1)] 180 C1 600 CCCCCOc1cccc(c1)[C@H]1N(c2nnc(s2)CC)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C CCCCCOc1cccc(c1)[C@H]1N(c2nnc(s2)CC)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C CCCCCOc1cccc(c1)[C@H]2N(C(=O)C3=C2C(=O)c4cc(Cl)c(C)cc4O3)c5sc(CC)nn5 InChIKey=GTWPMVQZSUYQSY-HSZRJFAPSA-N InChI=1S/C27H26ClN3O4S/c1-4-6-7-11-34-17-10-8-9-16(13-17)23-22-24(32)18-14-19(28)15(3)12-20(18)35-25(22)26(33)31(23)27-30-29-21(5-2)36-27/h8-10,12-14,23H,4-7,11H2,1-3H3/t23-/m1/s1 InChI=1/C27H26ClN3O4S/c1-4-6-7-11-34-17-10-8-9-16(13-17)23-22-24(32)18-14-19(28)15(3)12-20(18)35-25(22)26(33)31(23)27-30-29-21(5-2)36-27/h8-10,12-14,23H,4-7,11H2,1-3H3/t23-/m1/s1 CCCCCOc1cccc(c1)[C@@H]2c3c(=O)c4cc(c(cc4oc3C(=O)N2c5nnc(s5)CC)C)Cl C01[X(C27H26Cl1N3O4S1)] 180 C01 600 CCCCCOc1cccc(c1)[C@H]1N(c2nnc(s2)CC)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C CCCCCOc1cccc(c1)[C@H]1N(c2nnc(s2)CC)C(=O)c2c1c(=O)c1c(o2)cc(c(c1)Cl)C CCCCCOc1cccc(c1)[C@H]2N(C(=O)C3=C2C(=O)c4cc(Cl)c(C)cc4O3)c5sc(CC)nn5 InChIKey=GTWPMVQZSUYQSY-HSZRJFAPSA-N InChI=1S/C27H26ClN3O4S/c1-4-6-7-11-34-17-10-8-9-16(13-17)23-22-24(32)18-14-19(28)15(3)12-20(18)35-25(22)26(33)31(23)27-30-29-21(5-2)36-27/h8-10,12-14,23H,4-7,11H2,1-3H3/t23-/m1/s1 InChI=1/C27H26ClN3O4S/c1-4-6-7-11-34-17-10-8-9-16(13-17)23-22-24(32)18-14-19(28)15(3)12-20(18)35-25(22)26(33)31(23)27-30-29-21(5-2)36-27/h8-10,12-14,23H,4-7,11H2,1-3H3/t23-/m1/s1 4000.7509529282 -2357.3721597 1-A 29301.8291 137 463 600 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -104.83740 -91.99023 -20.67014 -20.58295 -20.57426 -20.56398 -15.64051 -15.59564 -15.59110 -11.39531 -11.35775 -11.35661 -11.35021 -11.34778 -11.31530 -11.31409 -11.30737 -11.29687 -11.29013 -11.27997 -11.27568 -11.27401 -11.26961 -11.26239 -11.25015 -11.24780 -11.24501 -11.23772 -11.22810 -11.22692 -11.22662 -11.22402 -11.22110 -11.21865 -11.21856 -11.21082 -10.57064 -9.00141 -8.04002 -8.03670 -8.03665 -6.68360 -6.68275 -6.68088 -1.51211 -1.44276 -1.41439 -1.41226 -1.37850 -1.31661 -1.21826 -1.17075 -1.15580 -1.14331 -1.12453 -1.09373 -1.08938 -1.06798 -1.05818 -1.03672 -1.03400 -1.03030 -0.99705 -0.99073 -0.96977 -0.92812 -0.92471 -0.89817 -0.88376 -0.86153 -0.84660 -0.84290 -0.83195 -0.79875 -0.79687 -0.79116 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1388.8633 1396.0839 1408.5009 1417.1325 1426.3178 1435.0825 1446.7875 1450.2560 1461.5040 1462.6654 1486.3113 1490.0211 1495.8660 1531.5829 1554.4164 1559.2256 1565.2268 1567.8979 1571.2708 1589.8466 1617.1957 1625.3808 1627.2827 1629.2096 1635.1663 1638.4019 1640.9503 1641.6208 1644.1934 1647.4055 1647.4474 1649.1069 1657.0807 1664.8652 1680.8631 1733.2917 1748.9314 1768.6120 1788.9947 1818.6478 1819.8462 1882.7582 1977.6631 2016.4653 3177.7775 3192.5725 3196.3710 3198.7754 3199.7550 3211.2939 3215.5227 3222.0141 3222.1018 3223.5143 3230.6508 3258.1790 3262.9587 3265.5465 3270.0490 3283.4802 3284.0812 3295.0674 3297.9040 3304.1069 3360.3200 3379.7092 3398.7215 3399.3663 3408.9996 3421.6332 5.1386 6.2039 3.9652 3.0791 5.1214 4.1135 4.2825 2.3293 5.5646 5.1966 5.6914 3.7018 6.2456 5.4671 6.8284 1.8311 4.3597 4.1467 2.5617 1.3901 2.9202 5.5978 3.6529 2.7031 4.7581 3.6474 3.6276 1.2318 3.6977 3.5689 3.8884 4.5255 4.3225 6.3844 6.2403 5.8625 3.7360 8.4078 5.6959 7.5528 6.6220 3.5326 3.7449 4.4355 4.5517 4.5415 5.0858 7.8450 9.3100 6.3143 6.0708 6.1565 6.4860 6.9368 5.7982 7.1446 6.8459 7.2200 7.5684 3.8771 3.4465 3.2574 1.0824 6.2972 4.5266 1.1352 9.1303 6.1273 1.7074 2.3132 2.3316 5.3121 5.4097 1.1837 2.1875 4.0490 1.4122 1.4783 1.7056 3.7392 2.3061 1.4299 1.1372 6.0097 4.5190 2.9234 1.4484 1.6623 5.0995 2.2580 2.3881 2.0540 1.5309 2.2374 2.3102 1.8457 3.7653 2.9816 4.7517 3.0549 3.4789 3.1421 1.8327 2.4059 1.6922 3.1617 1.7746 2.4056 1.3556 6.3622 1.3314 1.3033 6.1603 1.3527 1.1955 2.8101 1.8619 1.0496 1.0978 4.8499 1.4413 1.3868 1.5335 3.7580 1.4158 4.1093 1.2378 1.3521 1.3482 1.5482 2.8137 1.0749 1.0437 2.8399 1.0650 1.0868 1.6482 1.0420 1.0419 1.0883 1.0730 3.0196 1.1039 2.0742 1.1829 12.1661 7.9886 10.3266 5.4251 6.1962 6.2943 11.5968 12.9802 12.9681 1.0589 1.0577 1.0541 1.0429 1.1032 1.0361 1.0607 1.0372 1.0668 1.1052 1.1081 1.1053 1.1022 1.1066 1.1023 1.1018 1.1024 1.1021 1.0868 1.1042 1.0879 1.0952 1.0930 1.0932 1.0936 1.0936 0.0001 0.0015 0.0017 0.0014 0.0029 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CCCCCOc1cccc(c1)[C@@H]2c3c(=O)c4cc(c(cc4oc3C(=O)N2c5nnc(s5)CC)C)Cl C40056498 RHF 6-31G(d) (6D,10F) C1 523.133256 |X|Y|Z| 132.597524 104.241774 29.212410 73.911984 24 6 7 8 16 19 3 1 1 |36.858105| |12.467186|36.858105| |7.473368|12.452428|36.858105| |4.864915|7.470870|12.455237|36.858105| |3.748269|4.882145|7.519852|12.547447|36.858105| |3.050147|3.878647|5.096060|8.066380|13.555703|73.516695| |2.557706|3.081281|3.884538|5.226276|7.981261|25.167226|36.858105| |2.435718|2.828229|3.593711|4.394754|6.691656|14.000757|13.768542|36.858105| |2.070853|2.344008|2.848487|3.334338|4.497210|9.253442|7.957620|13.690651|36.858105| |1.883415|2.135428|2.517084|2.973609|3.779596|8.213852|6.850443|7.899134|13.841144|36.858105| |1.939467|2.240283|2.613388|3.199661|3.977293|9.427697|7.915722|6.849866|7.964816|13.657792|36.858105| |2.225494|2.646387|3.146121|4.090083|5.250413|14.612348|13.655058|7.927749|6.915526|7.944230|13.849216|36.858105| |1.724512|1.972291|2.227253|2.670193|3.111981|7.033573|5.020541|4.427605|5.020207|7.508188|12.517079|7.617460|36.858105| |1.757587|2.028042|2.262941|2.746827|3.113557|7.150299|4.806849|3.996802|4.205125|5.586388|8.898376|7.411272|17.632809|0.500000| |1.599669|1.807786|2.021241|2.371427|2.719938|5.895187|4.043840|3.754086|4.315571|6.044279|7.535329|5.396912|12.623879|0.246173|36.858105| |1.621442|1.833150|2.038593|2.385778|2.699138|5.780358|3.818846|3.515053|3.848240|4.851851|5.758402|4.817728|7.094063|0.174785|12.986812|36.858105| |1.758275|2.011560|2.239380|2.663803|2.992930|6.521087|4.195076|3.691792|3.811549|4.543180|5.600121|5.266783|6.145400|0.166469|8.070297|15.931364|73.516695| |1.462156|1.626882|1.789327|2.040179|2.273947|4.674347|3.007659|2.888932|3.195885|3.849894|4.141089|3.543271|4.874794|0.121930|7.814025|12.842810|14.295695|36.858105| |1.432695|1.584980|1.727980|1.947624|2.136467|4.300272|2.683915|2.584677|2.775407|3.165181|3.350466|3.037085|3.700728|0.096583|5.083521|7.618798|11.810604|13.634907|36.858105| |1.308567|1.431115|1.548137|1.716653|1.866567|3.681225|2.272261|2.226564|2.397341|2.682263|2.761180|2.513721|3.020773|0.079087|3.940040|5.069653|8.000057|7.937514|13.919674|36.858105| |1.224584|1.332348|1.440786|1.588999|1.732228|3.402688|2.114876|2.098562|2.299804|2.596221|2.624940|2.341571|2.916386|0.075394|3.791973|4.433915|6.691213|6.771848|7.863654|13.549184|36.858105| |1.243132|1.357318|1.476144|1.638541|1.803548|3.580165|2.263253|2.252067|2.522331|2.935521|2.957203|2.551945|3.397554|0.085767|4.606462|5.034739|7.078765|7.874539|6.882784|7.988239|13.815361|36.858105| |1.349974|1.488837|1.632509|1.839666|2.048489|4.153963|2.678766|2.633821|2.986598|3.626153|3.741543|3.119277|4.503378|0.110274|6.929982|7.609690|9.396905|13.740301|7.978339|6.943012|7.921494|13.719502|36.858105| |1.345533|1.485157|1.634132|1.846349|2.070736|4.225667|2.767644|2.736445|3.181520|4.020901|4.115908|3.278558|5.252626|0.123223|8.012710|6.599399|8.296992|7.926085|5.215355|4.645358|5.274403|8.157564|14.022505|73.516695| |1.454547|1.621877|1.799592|2.066695|2.347743|4.916831|3.306869|3.210073|3.783944|5.141933|5.561656|4.121573|8.171282|0.173266|14.397364|7.863665|9.601430|7.079955|4.662541|3.905531|4.065495|5.389618|8.346791|25.580045|36.858105| |1.435472|1.597456|1.772644|2.030059|2.308064|4.814879|3.243461|3.174668|3.779939|5.170893|5.477901|4.020967|7.988819|0.171236|8.225255|5.131512|7.245323|4.562551|3.419108|3.002965|3.153629|3.978783|5.184804|13.808198|12.803618|36.858105| |1.333021|1.469371|1.619312|1.826952|2.055934|4.190035|2.761809|2.753784|3.250741|4.171243|4.194449|3.274482|5.389470|0.126560|5.505410|3.974167|5.824904|3.780627|2.971879|2.717446|2.935635|3.701363|4.462943|11.595764|7.894878|16.019798|73.516695| |1.574470|1.773874|1.985058|2.318529|2.667013|5.742621|3.964085|3.741990|4.397287|6.322377|7.612866|5.244545|12.919093|0.252801|8.302266|5.091670|7.665033|4.104651|3.173172|2.726127|2.750525|3.290693|4.212671|9.633706|8.444709|13.893967|14.736725|53.358707| |1.578220|1.776133|1.979362|2.302683|2.622436|5.579559|3.745442|3.526026|3.993284|5.223089|6.032721|4.735155|7.642711|0.193247|5.253475|3.784538|6.074076|3.171894|2.589124|2.279071|2.300708|2.678518|3.241917|7.049939|5.292358|7.825998|11.738237|18.764172|36.858105| |1.702969|1.938695|2.160900|2.554488|2.888969|6.263808|4.111530|3.687350|3.925006|4.838633|5.953949|5.245992|6.748845|0.196336|4.512732|3.477467|5.869523|2.865605|2.403558|2.107167|2.088294|2.368746|2.827312|5.839099|4.212014|5.330615|8.183983|11.206241|14.987387|53.358707| |1.648643|1.858800|2.049571|2.374179|2.630615|5.474613|3.440319|3.174767|3.314954|3.809007|4.301119|4.024471|4.556066|0.131459|3.426844|2.785234|4.753434|2.386222|2.053537|1.837143|1.832935|2.056296|2.382149|4.854827|3.316144|4.121889|6.872317|7.396473|8.675065|18.999614|53.358707| |1.505627|1.673302|1.836820|2.083981|2.305992|4.675593|2.946858|2.829480|3.043111|3.488276|3.718023|3.358952|3.994549|0.110294|3.180258|2.581476|4.322116|2.276707|1.959771|1.779015|1.802762|2.038219|2.331120|4.827594|3.230272|4.168032|7.420393|6.933532|8.047288|11.752070|20.414104|36.858105| |1.422056|1.573191|1.734804|1.962413|2.200314|4.474728|2.904467|2.857675|3.237984|3.915444|4.038066|3.377078|4.616907|0.119114|3.789228|2.935920|4.723039|2.627576|2.204498|2.006351|2.071642|2.407797|2.784985|6.060375|4.125105|6.016093|11.615878|9.383896|10.960215|10.202356|10.217703|10.906219|388.023441| |1.419333|1.558898|1.692166|1.882543|2.047748|4.033732|2.473666|2.408212|2.547910|2.800001|2.905775|2.710089|3.038437|0.084363|2.546439|2.145609|3.628508|1.935625|1.700370|1.566034|1.591812|1.778082|1.987284|4.039674|2.601344|3.207249|5.883081|4.972866|4.941016|7.119765|10.614302|12.683727|47.399902|36.858105| |1.402013|1.524536|1.664167|1.824380|2.000724|3.858847|2.374806|2.386039|2.548233|2.724572|2.708348|2.520996|2.726633|0.073760|2.331259|1.987612|3.363037|1.812680|1.603842|1.487300|1.516062|1.687036|1.867303|3.773945|2.394065|2.906809|5.388573|4.390201|4.112753|5.697075|7.479692|7.517948|38.976828|12.430814|36.858105| |1.123904|1.211922|1.301270|1.417654|1.531757|2.964220|1.819467|1.818361|1.977290|2.184549|2.184703|1.978985|2.384545|0.062343|2.937328|3.282504|5.172848|4.409536|5.002909|7.482234|12.640312|7.605205|5.030346|7.000049|3.161481|2.613174|4.466480|3.131048|1.981775|2.465902|2.205876|1.607811|13.028845|1.442345|1.383198|36.858105| |1.264064|1.371721|1.468431|1.607025|1.719547|3.327709|2.004905|1.965135|2.066344|2.236028|2.293867|2.160536|2.432764|0.065039|2.970228|3.679843|6.323730|4.768238|7.098896|10.917581|6.974980|4.765653|4.244170|5.793376|2.892431|2.362592|3.868848|3.002708|1.905027|2.445457|2.169830|1.541419|12.095299|1.377483|1.315129|6.192345|448.794386| |17.550176|8.775472|5.455140|4.040418|3.174037|4.786507|2.287330|2.166487|1.871440|1.725363|1.785798|2.033424|1.610416|0.045819|1.500575|1.523805|2.933410|1.381429|1.358573|1.246015|1.166927|1.181614|1.277970|2.261376|1.369619|1.351683|2.238862|2.009668|1.482188|2.175104|2.114619|1.422579|9.543004|1.347828|1.326955|1.075048|9.709540|0.500000| |17.535529|8.773702|6.770227|4.495815|3.633694|5.233254|2.504715|2.422325|2.066770|1.868498|1.906623|2.171192|1.691754|0.047569|1.585219|1.618814|3.123410|1.467919|1.447276|1.324858|1.236645|1.249822|1.352854|2.384549|1.442695|1.414591|2.335414|2.098161|1.532406|2.229954|2.145852|1.447791|9.827185|1.361610|1.349228|1.136820|10.329383|0.301713|0.500000| |17.535557|8.773750|6.770246|4.495854|3.633720|5.233239|2.505056|2.422475|2.067185|1.868984|1.907351|2.172041|1.691628|0.047681|1.561130|1.566944|2.993755|1.415480|1.379240|1.263305|1.189573|1.212785|1.316100|2.346310|1.428053|1.420642|2.355347|2.122432|1.574901|2.315097|2.261444|1.522247|10.169492|1.444218|1.437237|1.093699|9.754426|0.301713|0.301648|0.500000| |8.860078|17.516001|8.861898|6.875993|4.553528|6.738440|3.011976|2.724254|2.275598|2.098663|2.224085|2.632391|1.976379|0.056770|1.829266|1.879866|3.707015|1.668745|1.639145|1.476689|1.364929|1.382400|1.515340|2.666109|1.632613|1.592296|2.595335|2.397463|1.747242|2.585431|2.456733|1.624621|10.945059|1.506547|1.463152|1.240245|11.434766|0.212760|0.210663|0.172935|0.500000| |8.860063|17.516122|8.861957|6.876133|4.553585|6.738413|3.012567|2.724469|2.276151|2.099348|2.225233|2.633893|1.976180|0.056961|1.792804|1.800541|3.497052|1.593427|1.542890|1.393445|1.302858|1.333134|1.464592|2.613380|1.611645|1.600873|2.622558|2.433580|1.810514|2.719703|2.633225|1.731099|11.420113|1.619838|1.576413|1.185245|10.674254|0.212759|0.172934|0.210665|0.304006|0.500000| |6.882886|8.865216|17.494816|8.842620|6.899943|8.381359|3.752840|3.595809|2.865416|2.501864|2.555030|3.026628|2.170071|0.060805|1.955010|1.942743|3.737416|1.712973|1.642815|1.479768|1.389303|1.431159|1.579897|2.835905|1.758163|1.752948|2.864897|2.674642|1.982736|2.950957|2.836883|1.875294|12.494541|1.741255|1.730589|1.258765|11.217854|0.140585|0.169267|0.204188|0.173832|0.211949|0.500000| |6.882838|8.865177|17.494689|8.842458|6.899838|8.381488|3.751723|3.595337|2.864327|2.500715|2.553303|3.024363|2.170344|0.060573|2.002632|2.043630|3.997460|1.807732|1.760670|1.580773|1.465423|1.492716|1.644236|2.903738|1.785525|1.741697|2.829482|2.626870|1.900402|2.781454|2.619404|1.741885|11.879216|1.602598|1.583755|1.325335|12.111970|0.140585|0.204186|0.169266|0.211948|0.173832|0.303658|0.500000| |4.520089|6.826943|8.820174|17.540675|8.948919|13.151342|4.930084|4.046965|3.155026|2.884677|3.162393|4.053862|2.686926|0.077576|2.426063|2.497304|5.065592|2.128782|2.054534|1.799835|1.647621|1.685920|1.893779|3.338455|2.093216|2.023323|3.221082|3.124604|2.244951|3.363825|3.087516|1.994934|13.514336|1.794463|1.723749|1.465536|13.614420|0.108278|0.119276|0.110963|0.206006|0.170488|0.173226|0.210952|0.500000| |4.520073|6.826854|8.820078|17.540983|8.949144|13.150820|4.932632|4.047657|3.156494|2.886452|3.165684|4.059329|2.686411|0.078066|2.342707|2.319437|4.564838|1.978400|1.873535|1.654663|1.541491|1.598630|1.797222|3.236428|2.049470|2.041038|3.273674|3.206004|2.384455|3.677546|3.462851|2.203222|14.442854|1.996180|1.918424|1.376917|12.378716|0.108278|0.110962|0.119277|0.170483|0.206007|0.210954|0.173224|0.303399|0.500000| |3.643238|4.524087|6.836555|8.835962|17.532497|16.533706|7.096828|6.785758|4.601451|3.756104|3.810199|4.792132|2.979927|0.081855|2.577510|2.498380|4.797448|2.130535|1.987144|1.754527|1.649002|1.728336|1.954014|3.556963|2.268107|2.275961|3.642447|3.585154|2.645639|3.980943|3.703175|2.395543|16.051118|2.145668|2.127805|1.466921|12.936832|0.085407|0.097056|0.102523|0.111883|0.120428|0.205902|0.170168|0.174159|0.213138|0.500000| |3.643481|4.524401|6.837410|8.836468|17.532042|16.532791|7.088408|6.781994|4.596627|3.751949|3.804159|4.782658|2.980466|0.081283|2.690668|2.726991|5.394912|2.323655|2.209310|1.932216|1.782127|1.841192|2.081077|3.694837|2.328250|2.251179|3.569701|3.471327|2.457289|3.588343|3.251010|2.132421|14.794448|1.898956|1.869032|1.576499|14.381453|0.085411|0.102529|0.097063|0.120433|0.111890|0.170191|0.205931|0.213134|0.174166|0.300880|0.500000| |2.642512|3.035542|3.991418|4.663550|7.396091|12.470448|8.876083|17.765912|8.927652|5.646256|4.943978|5.628128|3.544380|0.090903|3.118170|2.989208|5.596755|2.541370|2.328695|2.040526|1.925327|2.040564|2.335409|4.269619|2.740175|2.713991|4.288904|4.229677|2.986420|4.252694|3.804013|2.528307|17.938682|2.211480|2.225560|1.692065|14.734458|0.064305|0.073665|0.073657|0.079874|0.079863|0.113434|0.113464|0.115327|0.115295|0.225509|0.225741|0.500000| |1.974523|2.190262|2.643612|2.975663|3.897574|7.457908|5.663457|8.936989|17.714006|8.959586|5.655297|4.973788|4.087062|0.096455|3.708281|3.360561|5.826921|2.929036|2.584401|2.283815|2.217894|2.423985|2.802670|5.298331|3.417449|3.437094|5.443336|5.175991|3.509497|4.602940|4.035248|2.807049|21.459967|2.408602|2.469110|1.933085|15.941018|0.049599|0.055139|0.055149|0.058780|0.058793|0.074809|0.074784|0.077899|0.077927|0.113504|0.113411|0.216863|0.500000| |1.707366|1.908027|2.211166|2.547921|3.125875|6.515278|4.940577|5.632542|8.954382|17.720279|8.849082|5.643036|6.923723|0.140024|6.207980|4.764353|7.454557|3.999916|3.219950|2.777875|2.762697|3.208348|3.975727|8.203987|5.899660|6.117186|8.820667|9.244031|5.356960|6.216830|4.987788|3.514045|30.003643|2.826090|2.777110|2.321575|18.277012|0.043748|0.047173|0.047187|0.052162|0.052181|0.061304|0.061272|0.068980|0.069026|0.087019|0.086923|0.124403|0.216289|0.500000| |2.237631|2.694495|3.119524|4.129837|4.884682|13.574248|8.968006|5.664664|4.976696|5.635266|8.905430|17.746445|7.036200|0.227272|5.084931|4.690797|9.499787|3.437504|2.985474|2.466051|2.280662|2.464935|2.996196|5.538659|3.873545|3.760881|5.489644|6.626519|4.505041|7.098800|5.473569|3.284336|22.889636|2.665392|2.424284|1.932207|17.162700|0.057335|0.060106|0.060144|0.075438|0.075513|0.082067|0.081972|0.117287|0.117566|0.120865|0.120550|0.124261|0.107923|0.123700|0.500000| |1.514234|1.683345|1.832483|2.074283|2.259708|4.551119|2.795183|2.650668|2.770497|3.091988|3.326958|3.131821|3.562172|0.095184|4.633606|7.101820|13.176391|8.946127|17.763837|8.943564|5.605822|4.960751|5.677820|7.485444|4.027835|3.081789|4.753310|4.048251|2.469907|3.190303|2.731979|1.893842|14.841410|1.648273|1.554214|4.074995|54.162575|0.039883|0.042594|0.040228|0.048755|0.045319|0.047934|0.052062|0.061595|0.055055|0.057596|0.065292|0.066624|0.071048|0.084813|0.086589|0.500000| |1.179536|1.281791|1.390991|1.534719|1.686292|3.324465|2.097828|2.104709|2.369957|2.745665|2.727458|2.348911|3.127235|0.078957|4.047848|4.119431|5.939526|5.642421|4.959876|5.649104|8.909455|17.746046|8.978799|13.439481|4.962261|3.925078|6.829065|4.306866|2.621178|3.122485|2.745391|2.030260|17.277948|1.784355|1.700011|7.008952|31.416886|0.031184|0.032894|0.032093|0.036110|0.035066|0.037678|0.038984|0.043571|0.041768|0.045288|0.047633|0.053271|0.063995|0.084604|0.062894|0.107706|0.500000| |1.320413|1.443621|1.554887|1.720741|1.856381|3.644845|2.223815|2.164288|2.297398|2.538259|2.636809|2.446556|2.825766|0.078729|2.431963|2.059612|3.461453|1.883968|1.658720|1.539503|1.576228|1.763824|1.954399|3.983390|2.526741|3.114457|5.866859|4.651484|4.452878|6.109496|8.187402|8.964593|44.418369|17.543249|8.824326|1.436289|10.875544|0.034989|0.035279|0.037208|0.038959|0.041583|0.044210|0.041091|0.045948|0.050446|0.053534|0.048206|0.055386|0.060676|0.072055|0.067360|0.044452|0.049541|0.500000| |1.464909|1.612898|1.739390|1.936086|2.078790|4.082561|2.454283|2.353497|2.429564|2.628727|2.773458|2.667643|2.866145|0.081389|2.394763|2.050483|3.517885|1.840008|1.630735|1.498813|1.511083|1.671591|1.865102|3.733098|2.397651|2.869933|5.142799|4.498437|4.346612|6.715915|10.313925|9.138787|36.438679|17.597567|8.815991|1.371093|10.668172|0.038741|0.038793|0.041470|0.043192|0.046951|0.049810|0.045383|0.051111|0.057712|0.060598|0.053031|0.060420|0.063391|0.072201|0.074050|0.044266|0.046299|0.302616|0.500000| |1.338459|1.444895|1.563182|1.695438|1.835906|3.496755|2.117985|2.126110|2.242362|2.363848|2.353136|2.223438|2.368303|0.064630|2.063008|1.788880|3.043543|1.646437|1.471906|1.374031|1.400943|1.547369|1.694641|3.387817|2.116260|2.513043|4.669679|3.725881|3.361561|4.685767|5.950554|5.501582|30.395167|8.818964|17.564148|1.288457|9.836470|0.035341|0.035739|0.038213|0.038485|0.041599|0.045245|0.041313|0.044531|0.049580|0.054213|0.047750|0.055785|0.060780|0.066712|0.059897|0.039712|0.043404|0.212672|0.212500|0.500000| |1.504178|1.638790|1.804480|1.978958|2.189745|4.201262|2.590712|2.626058|2.784385|2.917311|2.869678|2.702345|2.793611|0.075238|2.357955|2.018199|3.442691|1.824118|1.617148|1.491994|1.510113|1.672905|1.859597|3.729775|2.381624|2.851823|5.158943|4.396983|4.086363|5.847351|7.616792|6.836607|35.453422|8.785683|17.570335|1.373580|10.615381|0.039341|0.040126|0.043043|0.043387|0.047112|0.052569|0.047530|0.051386|0.057942|0.065631|0.056460|0.068339|0.074996|0.081315|0.071392|0.043766|0.046507|0.172894|0.210818|0.301138|0.500000| |1.348025|1.460935|1.599544|1.748943|1.932214|3.724280|2.321033|2.368185|2.587949|2.792087|2.715424|2.469881|2.752277|0.073010|2.390854|2.025006|3.386471|1.865529|1.643334|1.531277|1.574390|1.764500|1.946810|3.976618|2.505659|3.087926|5.885828|4.532502|4.165057|5.420347|6.607864|6.734258|42.561357|8.736640|17.557121|1.438627|10.814241|0.035406|0.036249|0.038306|0.039070|0.041660|0.046068|0.042632|0.046103|0.050547|0.056854|0.050694|0.061242|0.070564|0.081033|0.065248|0.043915|0.049775|0.210035|0.172383|0.301792|0.301264|0.500000| |1.093865|1.178780|1.257260|1.367963|1.464438|2.830357|1.719058|1.701845|1.827343|2.009103|2.036294|1.869615|2.229344|0.059240|2.704826|3.036729|4.890125|3.955599|4.587513|6.665612|8.871981|5.915143|4.311721|6.153225|2.863574|2.401186|4.105835|2.917048|1.866141|2.343865|2.106669|1.531108|12.275376|1.379816|1.317490|17.572357|51.162137|0.029169|0.030706|0.029510|0.033613|0.032073|0.033705|0.035509|0.039426|0.036997|0.038869|0.041740|0.044114|0.049385|0.058622|0.051262|0.107827|0.152448|0.038271|0.036608|0.034218|0.036285|0.037888|0.500000| |1.082483|1.164681|1.250613|1.359580|1.470969|2.842506|1.749965|1.757969|1.925864|2.134654|2.118575|1.904082|2.324462|0.060512|2.832333|3.041806|4.746109|3.964631|4.173572|5.549352|8.892924|7.353043|4.789427|7.081715|3.142132|2.652309|4.636053|3.125514|1.988964|2.453477|2.207296|1.624712|13.292853|1.462623|1.405965|17.604526|36.826275|0.028769|0.030354|0.029368|0.032971|0.031728|0.033769|0.035283|0.038812|0.036822|0.039395|0.041883|0.045462|0.052601|0.063758|0.051491|0.095864|0.225117|0.040658|0.038432|0.036410|0.038599|0.040843|0.300972|0.500000| 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