Version2.0 2019-11-24T22:45:05Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 02-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1c(ccc([nH+]1)N)CNC(=O)[C@@H]2C=CCn3n2c(=O)n(c3=O)[C@@H](CSc4ccccc4)C(=O)OC C13489264 RHF 6-31G(d) (6D,7F) Cc1c(ccc([nH+]1)N)CNC(=O)[C@@H]2C=CCn3n2c(=O)n(c3=O)[C@@H](CSc4ccccc4)C(=O)OC C01[X(C24H27N6O5S1)] 183 C1 598 COC(=O)[C@@H](n1c(=O)n2n(c1=O)[C@@H](C=CC2)C(=O)NCc1ccc([nH+]c1C)N)CSc1ccccc1 COC(=O)[C@@H](n1c(=O)n2n(c1=O)[C@@H](C=CC2)C(=O)NCc1ccc([nH+]c1C)N)CSc1ccccc1 COC(=O)[C@H](CSc1ccccc1)N2C(=O)N3CC=C[C@H](N3C2=O)C(=O)NCc4ccc(N)[nH+]c4C InChIKey=PFZIJAVARPSGTC-OALUTQOASA-O InChI=1S/C24H26N6O5S/c1-15-16(10-11-20(25)27-15)13-26-21(31)18-9-6-12-28-23(33)29(24(34)30(18)28)19(22(32)35-2)14-36-17-7-4-3-5-8-17/h3-11,18-19H,12-14H2,1-2H3,(H2,25,27)(H,26,31)/p+1/t18-,19-/m0/s1 InChI=1/C24H26N6O5S/c1-15-16(10-11-20(25)27-15)13-26-21(31)18-9-6-12-28-23(33)29(24(34)30(18)28)19(22(32)35-2)14-36-17-7-4-3-5-8-17/h3-11,18-19H,12-14H2,1-2H3,(H2,25,27)(H,26,31)/p+1/t18-,19-/m0/s1/fC24H27N6O5S/h26-27H,25H2/q+1 Cc1c(ccc([nH+]1)N)CNC(=O)[C@@H]2C=CCn3n2c(=O)n(c3=O)[C@@H](CSc4ccccc4)C(=O)OC C01[X(C24H27N6O5S1)] 183 C01 598 COC(=O)[C@@H](n1c(=O)n2n(c1=O)[C@@H](C=CC2)C(=O)NCc1ccc([nH+]c1C)N)CSc1ccccc1 COC(=O)[C@@H](n1c(=O)n2n(c1=O)[C@@H](C=CC2)C(=O)NCC1=C(C)N[C@H](CC1)N)CSc1ccccc1 COC(=O)[C@H](CSc1ccccc1)N2C(=O)N3CC=C[C@H](N3C2=O)C(=O)NCC4=C(C)N[C@@H](N)CC4 InChIKey=NRQSMADRDTXKCI-SLFFLAALSA-N InChI=1S/C24H30N6O5S/c1-15-16(10-11-20(25)27-15)13-26-21(31)18-9-6-12-28-23(33)29(24(34)30(18)28)19(22(32)35-2)14-36-17-7-4-3-5-8-17/h3-9,18-20,27H,10-14,25H2,1-2H3,(H,26,31)/t18-,19-,20+/m0/s1 InChI=1/C24H30N6O5S/c1-15-16(10-11-20(25)27-15)13-26-21(31)18-9-6-12-28-23(33)29(24(34)30(18)28)19(22(32)35-2)14-36-17-7-4-3-5-8-17/h3-9,18-20,27H,10-14,25H2,1-2H3,(H,26,31)/t18-,19-,20+/m0/s1/f/h26H 4414.7367940595 -2022.9555051 1-A 15805.4020 134 464 598 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.04669 -20.70022 -20.64491 -20.64311 -20.63920 -20.63439 -15.79713 -15.73849 -15.73661 -15.72714 -15.72057 -15.69009 -11.50898 -11.49816 -11.48981 -11.47304 -11.45432 -11.45274 -11.40655 -11.40103 -11.39469 -11.38989 -11.37692 -11.37521 -11.37319 -11.36538 -11.36401 -11.36352 -11.36111 -11.34610 -11.34131 -11.34118 -11.33940 -11.33796 -11.33006 -11.32811 -9.05673 -6.73991 -6.73844 -6.73653 -1.57213 -1.56431 -1.51044 -1.50279 -1.49969 -1.46318 -1.46055 -1.38208 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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| 18.2581 20.1970 26.6915 33.7797 40.9891 44.0951 59.6221 63.4957 65.0311 70.6850 81.8082 88.5741 94.0700 113.6565 123.3356 137.3416 146.5143 150.0158 162.8132 177.7155 182.6556 201.5389 215.7883 223.6641 249.3727 253.1274 263.1753 271.8111 288.9154 301.8954 322.2456 335.7371 338.0516 376.2055 383.1003 403.3546 416.4672 420.5668 444.2281 447.7433 456.0357 459.7382 464.6885 483.2339 489.8564 498.1527 528.1956 551.0348 575.8978 580.5906 598.8558 605.9712 619.6295 674.8816 678.2264 682.6044 714.6098 726.2453 760.2549 767.0373 778.3682 780.1929 782.9785 791.5830 799.3611 820.3966 822.4617 832.8189 857.6596 865.4405 875.9782 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26.27 29.06 38.40 48.60 58.97 63.44 85.78 91.36 93.57 101.70 117.70 127.44 135.35 163.53 177.45 197.60 210.80 215.84 234.25 255.69 262.80 289.97 310.47 321.80 358.79 364.19 378.65 391.08 415.68 434.36 463.64 483.05 486.38 541.28 551.20 580.34 599.20 605.10 639.15 644.20 656.13 661.46 668.58 695.27 704.79 716.73 759.96 792.82 828.59 835.34 861.62 871.86 891.51 971.00 975.82 982.12 1028.16 1044.90 1093.84 1103.60 1119.90 1122.52 1126.53 1138.91 1150.10 1180.37 1183.34 1198.24 1233.98 1245.18 1260.34 1284.10 1300.43 1337.48 1349.69 1375.96 1402.38 1436.72 1452.90 1490.23 1503.69 1525.65 1538.20 1551.23 1564.51 1579.04 1590.02 1611.15 1612.30 1614.86 1622.52 1635.70 1640.61 1646.06 1678.72 1685.76 1695.32 1700.69 1712.47 1736.90 1748.57 1763.22 1793.87 1813.16 1855.81 1862.05 1864.68 1878.58 1891.81 1914.99 1919.99 1931.34 1942.56 1962.73 2005.59 2026.54 2032.40 2045.83 2047.39 2079.92 2113.82 2128.47 2133.55 2149.94 2169.13 2187.16 2203.50 2216.90 2227.23 2228.00 2256.78 2269.73 2304.86 2321.59 2329.67 2339.20 2348.78 2350.19 2357.40 2360.16 2365.80 2367.15 2370.03 2380.19 2484.31 2510.90 2546.35 2570.03 2610.87 2636.46 2665.72 2739.36 2786.13 2815.39 2898.12 2917.31 4630.75 4651.77 4697.65 4702.70 4712.51 4713.83 4758.77 4766.29 4767.75 4769.89 4780.69 4827.31 4846.02 4853.57 4856.92 4860.99 4862.34 4869.86 4880.22 4890.62 4894.73 4907.63 4933.57 5467.89 5510.86 5533.14 5640.76 0.545013 0.576731 0.577675 0.479009 -2022.410492 -2022.378774 -2022.377830 -2022.476496 3.309274D-04 MUNgauss RevisionA1.9 retrievium 24-Nov-2019 DUDE Cc1c(ccc([nH+]1)N)CNC(=O)[C@@H]2C=CCn3n2c(=O)n(c3=O)[C@@H](CSc4ccccc4)C(=O)OC C13489264 RHF 6-31G(d) (6D,10F) C1 511.176317 |X|Y|Z| 85.146057 80.339528 45.837177 67.936613 27 6 7 16 21 5 1 |36.858105| |12.659651|36.858105| |7.492108|13.998207|36.858105| |5.009562|8.030610|13.466538|36.858105| |4.457383|6.864571|7.817134|13.952508|36.858105| |5.123041|7.933695|6.818373|8.017266|13.624512|36.858105| |7.812156|13.938726|8.112721|7.128167|8.133902|14.218287|53.358707| |7.534917|9.396338|5.886494|5.188895|5.871951|9.476058|25.955425|0.500000| |4.031181|5.301926|4.613107|5.251879|7.891953|14.233448|11.258128|0.214736|53.358707| |6.276336|7.550683|12.537982|7.485185|4.993361|4.418821|6.889013|0.116415|4.591969|36.858105| |5.406658|5.856981|7.688676|5.637055|4.169710|3.797777|5.832991|0.102922|4.114452|13.153851|53.358707| |4.151102|4.718888|6.111222|5.412728|4.118297|3.608859|5.188551|0.091828|3.991869|7.839352|19.202902|36.858105| |3.702257|4.464288|6.068502|6.264508|4.637334|3.790571|5.140790|0.089383|4.178916|6.953677|11.595045|15.877771|73.516695| |3.482031|3.688887|4.251878|3.864985|3.232220|2.972546|4.274677|0.078949|3.444513|5.007409|10.626913|12.364403|14.056708|36.858105| |3.375463|3.411227|3.849000|3.400867|2.858363|2.673375|3.911539|0.073322|3.126293|4.750118|10.014126|8.874502|10.698365|17.589203|0.500000| |2.777753|2.991520|3.435555|3.355292|2.900144|2.622820|3.628406|0.067455|3.119745|3.860613|6.975176|7.567669|12.151491|12.653346|0.248360|36.858105| |2.518766|2.719084|3.026992|3.035336|2.739559|2.510032|3.415497|0.064240|3.054803|3.212508|5.463097|5.419244|9.348765|7.674634|0.165253|14.477199|36.858105| |2.619446|2.815106|3.016335|3.007524|2.806063|2.650239|3.616859|0.068894|3.267973|3.058782|5.123790|4.775025|8.044102|6.400134|0.140279|7.655129|12.684925|36.858105| |3.247134|3.503456|3.703430|3.568511|3.290226|3.162382|4.428267|0.083797|3.804199|3.687550|6.411725|5.923309|9.296148|7.812087|0.161087|6.944147|7.896942|13.044427|53.358707| |3.627995|3.760621|4.027649|3.637522|3.198024|3.074470|4.483239|0.084586|3.616237|4.324695|8.391237|7.664020|10.194620|13.124649|0.259717|7.933235|7.033978|7.934184|18.481782|53.358707| |4.256627|4.126659|4.116158|3.528096|3.153206|3.178968|4.859914|0.094059|3.745068|4.320657|8.070865|6.027226|8.186779|7.608453|0.194015|5.135203|4.717303|5.453252|11.522721|19.183615|36.858105| |4.777468|4.260630|4.163338|3.400458|2.993292|3.048929|4.817597|0.094252|3.573510|4.595332|8.590954|5.570091|7.462021|6.408734|0.188228|4.362227|3.853400|4.136973|7.597744|11.327086|15.852488|73.516695| |3.935383|3.886900|3.703820|3.310960|3.123665|3.255759|4.905953|0.097538|3.954791|3.598709|6.053552|4.604578|6.910269|5.343989|0.132502|4.221561|4.255521|5.466597|11.760726|11.912269|13.835931|14.678833|53.358707| |3.316066|3.481636|3.453835|3.282202|3.156158|3.197272|4.552679|0.088951|3.945951|3.303780|5.454548|4.512992|7.175692|5.336146|0.124137|4.659495|5.149663|7.785723|18.866860|11.645654|8.415690|9.889316|18.787672|36.858105| |2.907488|3.070364|3.005917|2.944884|2.941171|3.018984|4.187085|0.083205|3.869372|2.814899|4.429892|3.611841|6.025839|4.077711|0.097816|3.819759|4.376684|6.534615|11.306777|7.668633|5.579448|7.467414|11.257756|15.993675|73.516695| |3.750739|3.507123|3.186311|2.841682|2.755750|2.979345|4.565493|0.095144|3.739231|3.057907|4.847369|3.505414|5.426760|3.877707|0.102027|3.220376|3.254478|3.994754|7.207160|7.304614|7.673143|11.597444|17.927233|7.615354|11.542294|36.858105| |4.194453|3.682683|3.281870|2.832523|2.703864|2.939053|4.648749|0.097816|3.644617|3.210506|5.075702|3.498093|5.317562|3.795105|0.103539|3.069400|2.997377|3.493828|6.160296|6.803038|7.549637|13.676931|12.766386|5.711535|8.577942|17.589196|0.500000| |3.681233|3.529708|3.095176|2.831360|2.871052|3.236253|4.917830|0.106432|4.216093|2.822505|4.232201|3.056496|4.939910|3.190204|0.082618|2.750765|2.815613|3.427139|5.928575|5.586664|5.156133|8.143201|10.395050|6.115555|10.956560|12.416863|0.245948|36.858105| |5.061723|4.896090|3.919261|3.499442|3.639539|4.434037|7.247643|0.167020|5.683805|3.333741|4.746441|3.290505|5.382666|3.179724|0.081668|2.685553|2.662149|3.092532|5.408580|5.259595|4.761172|7.949783|8.162151|4.954855|8.379540|6.914792|0.183505|10.433712|388.023441| |3.871995|4.112806|3.428359|3.319519|3.729763|4.715961|6.817021|0.158651|6.854098|2.841258|3.909495|2.810381|4.833559|2.682417|0.068127|2.381844|2.416892|2.803197|4.641490|4.266397|3.521439|5.769941|5.847086|4.118347|7.646092|4.593413|0.116632|6.685170|75.885972|36.858105| |3.548153|3.684885|3.049118|2.965592|3.375618|4.346847|6.250012|0.153904|6.795271|2.541840|3.403322|2.411044|4.181626|2.282284|0.058967|2.048604|2.062590|2.329055|3.728184|3.514507|2.870144|4.868088|4.530173|3.171641|5.840712|3.602985|0.095768|4.857875|49.452855|13.695348|36.858105| |2.929803|3.122862|2.689876|2.714305|3.162124|3.963122|5.279889|0.123539|6.669128|2.257770|2.998593|2.157755|3.816979|2.040943|0.052672|1.874239|1.902748|2.130682|3.312811|3.085402|2.443977|4.126503|3.791235|2.753443|5.165536|2.934565|0.077458|3.749751|33.528705|7.904632|13.707265|36.858105| |2.660101|2.917609|2.607450|2.715853|3.209436|3.863211|4.860422|0.107305|6.566421|2.195520|2.941851|2.167854|3.894331|2.059870|0.052569|1.925830|1.984425|2.239613|3.431993|3.111574|2.404750|3.978351|3.753357|2.839512|5.469864|2.822926|0.072789|3.541945|29.677148|6.847291|7.924351|13.749649|36.858105| |2.785754|3.111739|2.828151|2.973675|3.500194|4.104362|5.103062|0.108699|6.598984|2.376752|3.247026|2.441550|4.398336|2.337866|0.058712|2.193017|2.292317|2.650145|4.102071|3.595648|2.749647|4.425499|4.406494|3.459244|6.870055|3.232058|0.080819|4.098070|33.345566|7.923212|6.873226|7.937453|13.720856|36.858105| |3.305882|3.677648|3.265551|3.327286|3.816096|4.560590|5.986610|0.128101|6.761991|2.721693|3.787602|2.834317|4.997878|2.726415|0.067908|2.491360|2.592169|3.066973|4.988255|4.336172|3.405486|5.381680|5.705883|4.422460|8.748188|4.190444|0.102139|5.667364|48.727860|13.678331|7.916238|6.857715|7.917022|13.759236|36.858105| |2.917506|2.748830|2.575738|2.352764|2.284773|2.418823|3.598669|0.074712|3.095675|2.537861|4.010419|2.968747|4.664474|3.416767|0.092274|2.989782|3.104725|3.825624|6.228120|6.210015|5.751341|8.998244|10.708429|6.173116|10.331369|12.436442|0.251247|7.465526|32.571232|3.551782|2.943386|2.505230|2.448184|2.768597|3.389345|36.858105| |2.652438|2.543165|2.453661|2.265870|2.176817|2.251447|3.295684|0.067241|2.867858|2.468008|3.971457|3.023483|4.742225|3.646196|0.099073|3.275858|3.475277|4.349783|6.717835|6.684917|5.731527|8.677696|9.687784|6.288120|10.332151|7.955198|0.178836|5.354794|26.586034|3.047588|2.557709|2.233237|2.220853|2.520997|3.012761|16.076600|73.516695| |2.671052|2.483249|2.294022|2.105144|2.072245|2.222735|3.307244|0.069985|2.899337|2.242331|3.435038|2.501496|4.000018|2.783666|0.076046|2.480402|2.561449|3.051015|4.774371|4.753256|4.239829|7.102734|7.240029|4.463665|7.940804|8.095845|0.198095|6.763814|30.123897|3.399505|2.922816|2.494157|2.400622|2.647567|3.167872|14.526910|15.265985|73.516695| |2.241078|2.101546|1.974719|1.834411|1.804716|1.910500|2.799694|0.058869|2.510149|1.953777|2.975639|2.187142|3.534994|2.451262|0.067760|2.249109|2.342628|2.741464|4.070570|4.044630|3.416654|5.793266|5.447340|3.604973|6.533768|5.158020|0.132762|4.546706|22.917857|2.751887|2.441402|2.151120|2.093482|2.282115|2.630280|8.142570|12.694929|23.714311|36.858105| |17.591738|8.909972|6.704980|4.576349|3.971359|4.335841|8.142870|0.158795|4.761800|6.391645|7.027716|3.875487|6.183606|3.238269|0.089478|2.615294|2.344134|2.382514|3.906996|4.415376|3.697519|7.532409|4.544120|2.868247|4.504277|3.189990|0.099189|3.081401|28.095668|3.186953|3.003317|2.559344|2.339843|2.421164|2.790598|2.587409|4.251523|4.253537|2.050476|0.500000| |17.611093|8.848608|5.570967|4.214306|4.041707|4.940483|10.297365|0.243839|5.629717|4.649169|5.691257|3.428056|5.557061|3.001029|0.080877|2.464192|2.285355|2.414482|4.022570|4.360822|3.783594|7.404197|5.025058|3.118402|4.992393|3.719477|0.115982|3.837644|39.594229|4.242820|4.043709|3.245095|2.845029|2.909334|3.447242|2.896734|4.592403|4.840028|2.273033|0.302221|0.500000| |17.589074|8.911532|6.576725|4.538911|3.979704|4.398530|8.302541|0.164124|4.844714|6.231339|8.427989|4.625894|6.942248|4.011656|0.109329|3.074923|2.765770|2.902136|5.030908|5.869686|5.408565|11.532218|6.507726|3.800073|5.736569|4.504415|0.145983|4.163165|38.998684|3.877963|3.422492|2.803001|2.575829|2.751786|3.333989|3.392152|5.448196|5.397864|2.504594|0.300850|0.302474|0.500000| |4.073538|5.707466|8.886551|17.759038|9.040526|5.687359|6.923572|0.111550|5.748273|7.012981|7.483985|5.682886|13.111757|3.962044|0.096344|3.568930|3.181728|3.036362|4.735649|4.829448|3.303440|5.629157|4.152630|3.091066|4.938658|2.596490|0.071539|2.543387|21.343609|2.863587|2.571924|2.394178|2.429730|2.665988|2.929017|2.203057|3.836703|3.496641|1.736343|0.107500|0.096472|0.106429|0.500000| |3.563994|4.951429|5.577975|8.925075|17.765477|8.894941|7.822089|0.127989|9.681525|4.072000|4.814853|3.632030|7.478193|2.940263|0.072235|2.741823|2.637481|2.686891|4.145647|3.937299|2.795189|4.672988|3.809333|2.905744|4.924137|2.482674|0.066924|2.597450|22.525512|3.373296|3.097064|3.014579|3.159245|3.444905|3.587980|2.105933|3.599858|3.413981|1.692509|0.090380|0.091957|0.090599|0.215801|0.500000| |3.383166|4.331278|4.035306|4.823377|7.313968|9.480144|8.117245|0.153402|26.040634|3.064191|3.785758|2.768762|5.260911|2.409107|0.060481|2.231994|2.209692|2.356285|3.653376|3.415714|2.544039|4.271229|3.660985|2.754692|4.876290|2.524492|0.067591|2.825822|25.630843|4.412425|4.350295|4.547725|4.829027|4.897717|4.682647|2.132472|3.551706|3.551017|1.748990|0.083520|0.094893|0.085123|0.113319|0.215833|0.500000| |3.983192|4.885926|4.069087|4.327333|5.779529|9.339175|10.201317|0.229387|25.968562|3.085872|3.852507|2.728258|4.962599|2.413887|0.061339|2.178628|2.148915|2.332091|3.707366|3.518990|2.732413|4.647692|4.013929|2.906693|5.135189|2.871606|0.077676|3.352827|33.228923|6.138200|6.569809|6.454196|5.917735|5.580994|5.687262|2.366021|3.842312|3.989885|1.930640|0.094816|0.118787|0.098584|0.098965|0.145361|0.314729|0.500000| |4.722436|5.671912|8.935299|7.215240|4.766309|3.989720|5.804793|0.099217|4.248700|17.631714|12.546078|7.184926|13.023925|4.625528|0.121984|3.810220|3.146483|2.901408|4.564313|5.209598|3.654499|6.735123|4.226955|2.952651|4.554455|2.655530|0.076299|2.472212|20.267375|2.522602|2.284515|2.072991|2.040106|2.201284|2.465715|2.266129|3.970377|3.583860|1.784142|0.136683|0.104260|0.128035|0.220376|0.112881|0.080766|0.078357|0.500000| |6.904696|6.972176|8.837971|5.654460|4.192102|3.938352|6.375851|0.112533|4.221591|17.630697|12.632084|5.798285|9.005832|4.248605|0.118441|3.328385|2.811442|2.700634|4.369801|5.157173|3.957959|7.904999|4.507739|2.965270|4.541818|2.924381|0.087541|2.697036|22.659672|2.681585|2.448186|2.165695|2.073478|2.207031|2.513165|2.446669|4.198715|3.899736|1.917818|0.225142|0.138852|0.185885|0.145259|0.096738|0.077669|0.080329|0.304303|0.500000| |5.655611|5.420137|6.170024|4.561158|3.612001|3.457122|5.465439|0.100124|3.840198|8.961192|25.997742|9.371911|10.880979|7.483327|0.220825|4.769505|3.814187|3.674523|6.334270|8.835104|6.970354|15.190281|6.611753|4.107013|5.852312|3.936896|0.118815|3.307925|25.875221|2.881157|2.507988|2.182118|2.117115|2.325465|2.736545|3.234545|5.664646|4.892358|2.365134|0.150089|0.121868|0.197667|0.120383|0.085918|0.071658|0.075002|0.182726|0.229341|0.500000| |2.569456|2.761763|3.213407|3.168693|2.718308|2.430705|3.344265|0.062141|2.900186|3.704680|6.427096|6.613150|11.377282|8.662523|0.210646|17.742000|9.148120|5.495399|6.808981|7.683987|4.125409|6.621449|4.690452|3.693963|5.596664|2.753120|0.074154|2.396543|16.878300|2.132230|1.866829|1.723293|1.767125|1.985564|2.217820|2.582048|4.983756|3.900808|2.016715|0.068595|0.063327|0.077727|0.096057|0.072109|0.057915|0.055987|0.105806|0.089665|0.120368|0.500000| |2.217605|2.391238|2.651679|2.706333|2.479537|2.265692|3.045781|0.057591|2.798692|2.796522|4.562022|4.325070|7.810729|5.507247|0.129436|9.181389|17.721778|8.671864|7.668604|6.864948|3.736271|5.646214|4.732595|4.145204|6.658541|2.790952|0.071757|2.473357|16.641539|2.174188|1.882736|1.760838|1.847903|2.119835|2.345739|2.721413|5.409615|4.088414|2.145377|0.057916|0.056455|0.066626|0.079676|0.067526|0.056832|0.054667|0.077577|0.068859|0.088401|0.219879|0.500000| |2.468886|2.701039|2.881840|2.967545|2.847932|2.679947|3.565915|0.067959|3.359523|2.833508|4.546818|4.154563|7.417641|4.973158|0.111903|5.869534|8.905480|17.637518|12.601539|7.905741|4.448344|6.222342|6.433285|6.880758|11.893433|3.633045|0.087594|3.300254|21.404058|2.852017|2.367430|2.200360|2.360792|2.839365|3.231913|3.467228|6.799176|5.063779|2.574392|0.062252|0.063930|0.074452|0.083360|0.077298|0.068309|0.066454|0.075435|0.069416|0.089092|0.128119|0.212174|0.500000| |2.416859|2.528512|2.652360|2.605117|2.453716|2.362843|3.260930|0.063151|2.955936|2.708636|4.489339|3.963621|6.544162|5.320970|0.127349|6.085194|8.891309|17.531022|12.306018|9.149873|5.105675|7.046538|7.148701|7.107316|11.250009|4.035517|0.097335|3.385870|20.782894|2.633701|2.209116|2.021016|2.112207|2.473652|2.845456|4.150101|8.929893|5.821897|3.010206|0.061438|0.062655|0.074731|0.072493|0.065293|0.059064|0.059319|0.071192|0.068039|0.092151|0.130381|0.201511|0.301529|0.500000| 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|3.715021|3.664044|2.970763|2.810778|3.120621|3.991327|6.057961|0.155309|6.002022|2.509804|3.338770|2.318762|3.975739|2.195228|0.057522|1.953301|1.945329|2.170934|3.469701|3.357876|2.786648|4.853247|4.311726|2.924600|5.270382|3.515611|0.096913|4.623548|47.430975|8.904427|17.721012|8.899218|5.640634|4.953203|5.635812|2.881671|4.417688|5.181558|2.434898|0.087804|0.122858|0.098644|0.067767|0.078681|0.105398|0.155884|0.062315|0.068472|0.069200|0.049722|0.049331|0.060465|0.057629|0.119646|0.129465|0.500000| |2.694145|2.825060|2.445749|2.460674|2.840002|3.503782|4.700367|0.110193|5.866436|2.077807|2.736036|1.955842|3.462021|1.849031|0.048169|1.704727|1.722450|1.904056|2.923408|2.759718|2.180973|3.734669|3.320030|2.393789|4.449864|2.579971|0.069234|3.197557|27.786008|5.633493|8.913311|17.719699|8.906217|5.642116|4.944371|2.245080|3.580270|4.021905|1.981575|0.066649|0.083492|0.070958|0.060793|0.075751|0.112286|0.152937|0.053362|0.055981|0.055422|0.043918|0.044561|0.054383|0.050452|0.090121|0.088369|0.215069|0.500000| 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