Version2.0 2020-01-20T22:07:00Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 11-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C=C(c1ccc(cc1)[N+](=O)[O-])NNC(=O)CSc2nnc(n2c3ccc(cc3)Cl)c4ccc(cc4)Cl C01818290 RHF 6-31G(d) (6D,7F) C=C(c1ccc(cc1)[N+](=O)[O-])NNC(=O)CSc2nnc(n2c3ccc(cc3)Cl)c4ccc(cc4)Cl C01[X(C24H18Cl2N6O3S1)] 156 C1 588 O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)NNC(=C)c1ccc(cc1)[N+](=O)[O-] O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)NNC(=C)c1ccc(cc1)[N+](=O)[O-] [O-][N+](=O)c1ccc(cc1)C(=C)NNC(=O)CSc2nnc(n2c3ccc(Cl)cc3)c4ccc(Cl)cc4 InChIKey=FJPSIADOYHOIQN-UHFFFAOYSA-N InChI=1S/C24H18Cl2N6O3S/c1-15(16-4-10-21(11-5-16)32(34)35)27-28-22(33)14-36-24-30-29-23(17-2-6-18(25)7-3-17)31(24)20-12-8-19(26)9-13-20/h2-13,27H,1,14H2,(H,28,33) InChI=1/C24H18Cl2N6O3S/c1-15(16-4-10-21(11-5-16)32(34)35)27-28-22(33)14-36-24-30-29-23(17-2-6-18(25)7-3-17)31(24)20-12-8-19(26)9-13-20/h2-13,27H,1,14H2,(H,28,33)/f/h28H C=C(c1ccc(cc1)[N+](=O)[O-])NNC(=O)CSc2nnc(n2c3ccc(cc3)Cl)c4ccc(cc4)Cl C01[X(C24H18Cl2N6O3S1)] 156 C01 588 O=C(CSc1nnc(n1c1ccc(cc1)Cl)c1ccc(cc1)Cl)NNC(=C)c1ccc(cc1)[N+](=O)[O-] O=C(NNC(=C)c1ccc(cc1)N(O)O)CS[C@@H]1NN=C(N1c1ccc(cc1)Cl)c1ccc(cc1)Cl ON(O)c1ccc(cc1)C(=C)NNC(=O)CS[C@@H]2NN=C(N2c3ccc(Cl)cc3)c4ccc(Cl)cc4 InChIKey=DCNKFZUMXGLMRM-XMMPIXPASA-N InChI=1S/C24H22Cl2N6O3S/c1-15(16-4-10-21(11-5-16)32(34)35)27-28-22(33)14-36-24-30-29-23(17-2-6-18(25)7-3-17)31(24)20-12-8-19(26)9-13-20/h2-13,24,27,30,34-35H,1,14H2,(H,28,33)/t24-/m1/s1 InChI=1/C24H22Cl2N6O3S/c1-15(16-4-10-21(11-5-16)32(34)35)27-28-22(33)14-36-24-30-29-23(17-2-6-18(25)7-3-17)31(24)20-12-8-19(26)9-13-20/h2-13,24,27,30,34-35H,1,14H2,(H,28,33)/t24-/m1/s1/f/h28H 3810.9329744529 -2786.9040416 1-A 43341.0086 139 449 588 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0.8426 0.8491 0.5868 0.8571 0.8207 0.8488 0.8099 0.7305 0.7269 0.8290 0.8266 0.6691 0.2887 0.8247 0.7951 0.6031 0.8559 0.8554 0.8362 0.7693 0.2986 0.7074 0.8245 0.6801 0.7675 0.4485 0.6182 0.4439 0.7120 0.4436 0.8277 0.8321 0.8540 0.8430 0.7173 0.3200 0.7764 0.5293 0.8571 0.5640 0.8532 0.8386 0.4177 0.8551 0.8193 0.8285 0.7889 0.7210 0.8201 0.5434 0.8545 0.6611 0.3462 0.3669 0.1997 0.3929 0.1606 0.8001 0.2211 0.5279 0.8538 0.6788 0.5108 0.8526 0.4507 0.2284 0.7166 0.8570 0.8396 0.6422 0.5823 0.7691 0.7929 0.1434 0.8542 0.8446 0.7433 0.7869 0.2892 0.8312 0.6654 0.7138 0.2992 0.8504 0.3994 0.6497 0.5716 0.8341 0.2707 0.3077 0.7827 0.8403 0.7951 0.6061 0.4544 0.8364 0.4380 0.2957 0.8540 0.5241 0.6466 0.8218 0.7567 0.8565 0.5140 0.7185 0.4058 0.1294 0.4344 0.7199 0.2582 0.5895 0.7921 0.3808 0.4751 0.4194 0.6804 0.3506 0.5449 0.7898 0.4271 0.7913 0.5525 0.3830 0.6083 0.6092 0.5408 0.3811 0.3806 0.2043 0.0567 0.8489 0.2606 0.6864 0.8322 0.7958 0.7874 0.4714 0.6191 0.6508 0.0823 0.3410 0.2816 0.3562 0.3706 0.8179 0.2715 0.3379 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 6 6 6 6 6 6 6 6 7 8 8 7 7 6 8 6 16 6 7 7 6 7 6 6 6 6 6 6 17 6 6 6 6 6 6 17 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 15.99491 15.99491 14.00307 14.00307 12.00000 15.99491 12.00000 31.97207 12.00000 14.00307 14.00307 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 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 9144.2867 75364.4848 82526.6614 1.00000 0.00125 0.00118 -0.00125 0.99998 -0.00668 -0.00119 0.00668 0.99998 1 0.00947 0.00115 0.00105 0.19736 0.02395 0.02187 11.30 15.15 16.94 38.44 42.85 47.47 57.21 66.93 71.83 86.19 98.24 102.06 120.96 135.64 145.24 161.27 185.43 205.49 226.57 260.19 291.90 332.03 376.18 386.97 392.59 431.60 442.39 468.47 473.83 479.64 520.81 579.80 591.70 625.09 649.56 658.58 666.29 668.26 678.79 693.65 720.94 781.85 786.04 807.73 814.45 845.70 852.29 862.10 923.56 954.12 967.05 994.47 994.76 1008.21 1055.78 1104.13 1114.35 1131.40 1144.13 1150.84 1154.50 1172.81 1184.13 1190.59 1219.37 1247.66 1253.90 1290.16 1356.01 1360.22 1372.18 1375.64 1380.93 1390.17 1422.59 1451.29 1471.00 1519.61 1543.15 1568.96 1572.53 1581.61 1588.85 1589.86 1596.42 1602.09 1603.50 1610.17 1619.16 1625.52 1693.33 1713.60 1717.70 1723.40 1728.75 1737.64 1741.08 1786.96 1797.53 1799.95 1825.47 1845.86 1868.24 1873.79 1880.74 1883.13 1886.95 1984.96 2025.80 2078.63 2086.54 2087.66 2095.54 2121.87 2158.98 2216.17 2241.02 2246.14 2256.97 2273.01 2303.06 2359.94 2401.35 2404.51 2415.09 2416.72 2423.56 2468.54 2503.57 2538.19 2548.28 2555.96 2598.91 2600.16 2611.23 2682.41 2700.91 2847.46 4702.31 4776.72 4849.99 4878.71 4881.59 4885.65 4889.19 4894.58 4896.60 4908.09 4909.00 4909.76 4912.52 4948.04 4948.76 4969.33 5442.59 5567.81 0.423340 0.453487 0.454431 0.353016 -2786.480701 -2786.450555 -2786.449610 -2786.551025 3.401476D-04 MUNgauss RevisionA2.0 retrievium 20-Jan-2020 DUDE C=C(c1ccc(cc1)[N+](=O)[O-])NNC(=O)CSc2nnc(n2c3ccc(cc3)Cl)c4ccc(cc4)Cl C01818290 RHF 6-31G(d) (6D,10F) C1 540.053816 |X|Y|Z| 195.604287 65.852318 27.265853 70.554195 29 6 7 16 23 5 1 |36.858105| |14.410382|36.858105| |7.723385|12.778380|36.858105| |6.269077|7.613285|13.681094|36.858105| |4.353755|5.045401|7.899810|13.788956|36.858105| |3.751829|4.483436|6.906638|8.010184|13.779903|36.858105| |3.975406|5.043360|7.897826|6.858784|7.881611|13.781919|36.858105| |5.278016|7.606478|13.668560|7.929463|6.857448|8.008936|13.785982|36.858105| |2.927922|3.338282|4.518737|5.134658|7.781908|13.069751|7.783079|5.134396|53.358707| |2.716478|3.000350|3.898984|4.683584|7.088076|8.381720|5.424966|4.096623|21.721927|73.516695| |2.628091|3.000056|3.898893|4.096886|5.424307|8.381477|7.089417|4.683784|21.718520|16.016676|73.516695| |7.847940|13.475622|7.891788|5.287109|4.014868|3.834744|4.518125|6.622369|4.059961|4.731327|4.936705|53.358707| |6.799650|8.020054|5.175745|4.008942|3.179641|3.013975|3.407129|4.493321|3.346051|3.991928|4.110458|18.803144|53.358707| |5.440354|5.922353|4.270483|3.600507|2.909915|2.710445|2.950896|3.678545|3.074247|3.735520|3.760919|10.901840|19.051155|36.858105| |5.107998|5.707607|4.394573|3.870341|3.117519|2.845998|3.023680|3.695949|3.223458|3.949565|3.897859|9.546931|11.551843|15.945625|73.516695| |4.144745|4.184482|3.232825|2.825473|2.372913|2.237987|2.415643|2.898015|2.611957|3.203908|3.233788|6.999999|10.773191|12.567789|14.136003|36.858105| |3.263549|3.267818|2.698806|2.480451|2.133686|1.996640|2.098994|2.426728|2.377298|2.962085|2.937472|5.089595|6.521561|7.006365|11.804653|10.510235|388.023441| |2.709849|2.664758|2.245627|2.069996|1.815710|1.721546|1.813658|2.066993|2.080788|2.597773|2.597036|4.075707|5.106212|4.696638|7.512361|7.130852|77.021458|36.858105| |2.676829|2.615505|2.194125|1.999028|1.757047|1.680146|1.785977|2.041707|2.032111|2.525865|2.550082|4.015874|5.087108|4.370909|6.656613|6.697733|49.730918|14.869986|53.358707| |2.264453|2.207658|1.897777|1.751200|1.561883|1.499974|1.585005|1.783797|1.836051|2.293124|2.313755|3.320375|4.022991|3.331604|5.284585|4.529797|35.141567|8.930678|19.025692|53.358707| |2.113482|2.066747|1.799329|1.682375|1.508722|1.443337|1.511631|1.686404|1.775878|2.230286|2.233549|3.077724|3.652629|3.085032|5.084777|4.031402|35.098043|8.846163|12.084996|20.231112|36.858105| |2.302349|2.262037|1.958001|1.836358|1.635407|1.552791|1.620372|1.815285|1.900292|2.389040|2.376872|3.383619|4.045666|3.581757|6.031497|4.755896|49.312536|13.955700|11.902901|11.916462|13.831779|53.358707| |2.142857|2.120062|1.869051|1.780044|1.598197|1.512237|1.562321|1.731157|1.862498|2.356068|2.324853|3.133901|3.633885|3.227874|5.724217|3.954434|42.542946|7.637817|7.303308|7.276036|7.508713|18.169287|36.858105| |2.175491|2.124683|1.879829|1.818657|1.630766|1.525525|1.557731|1.719518|1.879943|2.395459|2.330630|3.069443|3.509122|3.120165|5.694062|3.655985|38.795961|5.872632|5.929521|5.746241|5.375511|10.656725|13.754842|36.858105| |1.980372|1.949387|1.759765|1.725029|1.565126|1.463911|1.482184|1.616401|1.819582|2.332670|2.255392|2.789460|3.103929|2.713505|5.082752|3.019460|29.965435|4.204831|4.546076|4.452625|3.989677|7.004675|7.944598|13.761385|36.858105| |1.810513|1.808634|1.652522|1.615381|1.480527|1.398336|1.419901|1.537960|1.749677|2.239889|2.181639|2.612540|2.877290|2.484410|4.650316|2.737795|26.285312|3.728969|4.138867|4.120990|3.684386|6.203191|6.919971|7.977266|13.774567|36.858105| |1.789988|1.804235|1.644007|1.587108|1.455225|1.387362|1.422580|1.545260|1.734821|2.206683|2.175989|2.649445|2.941541|2.534293|4.660528|2.851752|27.296044|4.068708|4.522364|4.579037|4.184194|7.006266|7.948062|6.864162|7.906780|13.765378|36.858105| |1.932180|1.942650|1.742460|1.660874|1.509035|1.440820|1.490348|1.636200|1.788462|2.261576|2.245180|2.889092|3.283279|2.860130|5.126857|3.373803|33.536185|5.522564|5.878217|6.020781|5.870707|10.654420|13.753346|7.927605|6.862471|7.976514|13.773770|36.858105| |1.618213|1.622307|1.510299|1.494574|1.388273|1.313020|1.321875|1.413089|1.660516|2.140103|2.072297|2.315940|2.492716|2.106524|3.983433|2.242340|20.247583|2.794552|3.243978|3.231726|2.768399|4.381042|4.241421|4.776924|7.050595|10.957590|7.049346|4.777395|448.794386| |1.821898|1.782394|1.579917|1.491625|1.353593|1.299281|1.353566|1.491602|1.614578|2.036522|2.037075|2.618827|3.023600|2.492602|4.189105|3.071835|25.835223|5.293669|7.254386|10.645669|12.894153|10.174324|6.016469|4.650907|3.730375|3.573305|4.082388|5.376444|22.113410|36.858105| |1.683581|1.656620|1.479464|1.391668|1.271147|1.230054|1.286892|1.412291|1.535527|1.932638|1.948363|2.440618|2.792765|2.249592|3.756178|2.726203|21.675809|4.189950|6.132756|8.837957|7.738089|7.016897|4.333531|3.502147|2.975567|2.944146|3.382859|4.215365|19.133537|13.687404|36.858105| |1.504922|1.480515|1.337188|1.266671|1.165916|1.130170|1.177290|1.281214|1.420545|1.793927|1.805789|2.160203|2.431584|1.937475|3.272560|2.279565|17.949044|3.246493|4.632953|6.048550|5.088875|5.290449|3.541017|3.014645|2.676918|2.691803|3.042886|3.560247|18.123168|7.901846|13.785498|36.858105| |1.445179|1.416255|1.285062|1.227747|1.132690|1.093329|1.131256|1.225942|1.378014|1.748242|1.747230|2.046740|2.286516|1.830127|3.131532|2.123560|17.031561|2.996012|4.117980|5.141079|4.486526|4.975176|3.526993|3.117088|2.831822|2.848558|3.147523|3.544588|19.373835|6.877813|7.983095|13.768143|36.858105| |1.527125|1.489711|1.346958|1.292651|1.188059|1.139392|1.173946|1.274648|1.432309|1.821579|1.807903|2.144182|2.402842|1.949190|3.361298|2.268875|18.778314|3.317795|4.395889|5.413914|5.037715|5.768947|4.252217|3.830510|3.447307|3.395844|3.673811|4.136231|22.441275|7.904489|6.875510|7.915713|13.785807|36.858105| |1.715076|1.669806|1.492927|1.426432|1.300065|1.242089|1.282723|1.403762|1.550542|1.967431|1.951232|2.418148|2.750253|2.268462|3.892406|2.708839|23.185686|4.347925|5.616562|7.154017|7.567477|8.265727|5.883917|5.012666|4.161159|3.944061|4.318450|5.276550|24.418032|13.708111|7.947920|6.871830|7.979426|13.763746|36.858105| |1.278179|1.254186|1.150113|1.104638|1.027118|0.994231|1.025391|1.102511|1.261740|1.605171|1.603732|1.799599|1.982534|1.568110|2.700936|1.778479|14.003430|2.352956|3.231162|3.841473|3.182036|3.742830|2.720505|2.499032|2.360687|2.404547|2.598127|2.780053|17.185460|4.223401|4.775941|7.041582|10.943142|7.046249|4.774726|448.794386| |17.771969|9.077574|5.513938|4.674371|3.508456|3.108921|3.302221|4.219640|3.427727|4.192063|4.088588|9.545222|10.245990|6.137244|9.520515|4.870412|26.106173|3.063777|4.161484|3.462099|2.345396|3.476284|2.333688|2.364693|2.114053|1.912883|1.894490|2.070676|13.538853|1.995198|1.832065|1.624183|1.555060|1.648063|1.866846|10.952107|0.500000| |17.763792|9.156196|7.098699|6.694398|4.673247|3.876222|3.922985|4.915751|4.138716|5.096562|4.775386|7.651946|6.693917|4.212709|7.306259|3.405895|20.100706|2.401718|3.227418|2.787941|1.928006|2.838179|1.961502|2.011514|1.851995|1.693478|1.661984|1.776101|12.292957|1.685833|1.562117|1.408989|1.361165|1.438327|1.602544|9.738405|0.288617|0.500000| |6.695166|7.054125|8.912939|17.752666|8.955952|5.682757|4.947646|5.644452|5.670877|7.169489|6.051301|6.649049|5.372567|3.685191|7.182612|2.905237|18.454943|2.147025|2.797328|2.447838|1.736828|2.597026|1.857544|1.922598|1.824298|1.690507|1.644659|1.717479|12.543213|1.537730|1.423943|1.295427|1.261537|1.336447|1.478989|9.094819|0.139776|0.210484|0.500000| |3.752140|4.103576|5.623537|8.894914|17.788464|8.937520|5.634014|4.949652|9.783501|14.182368|8.832917|4.569411|3.780443|2.609583|5.008629|2.171938|14.201676|1.709925|2.242664|2.009174|1.435509|2.117718|1.532468|1.575887|1.524845|1.441825|1.407637|1.448906|10.947722|1.296230|1.215865|1.120327|1.093808|1.149549|1.253496|7.993079|0.086645|0.114075|0.214605|0.500000| |3.342773|4.101503|5.622045|4.950275|5.634150|8.939242|17.788058|8.893587|9.786909|8.835293|14.190280|5.305129|4.156379|2.660461|4.792024|2.229351|13.842326|1.706191|2.299895|2.055979|1.439443|2.086065|1.477181|1.463890|1.395779|1.346303|1.355915|1.419324|10.093897|1.295781|1.240043|1.137948|1.091240|1.126970|1.226090|7.968876|0.079808|0.091105|0.107530|0.124348|0.500000| |4.954953|7.040950|8.902734|5.643089|4.946733|5.682883|8.957602|17.753085|5.671604|6.051614|7.171627|9.855046|6.650070|3.825928|6.568058|3.043520|17.661328|2.137562|2.908859|2.532522|1.742561|2.536896|1.759552|1.727095|1.612497|1.540058|1.561874|1.666878|11.289359|1.535989|1.462427|1.322232|1.256933|1.300542|1.433578|9.054863|0.115519|0.123012|0.124122|0.107515|0.214663|0.500000| |6.014929|9.461387|7.472915|5.277238|4.126585|3.986552|4.689139|6.630608|4.227566|4.908311|5.144171|25.917808|13.204743|7.566772|13.543709|4.837838|26.609308|2.933109|3.851705|3.207085|2.216240|3.351660|2.320265|2.270248|2.086735|1.972707|2.003421|2.166818|14.111324|1.894090|1.763875|1.565132|1.486596|1.558906|1.755328|10.511171|0.149621|0.130598|0.133456|0.095806|0.112571|0.194860|0.500000| |5.659680|6.286192|4.425537|3.471008|2.847024|2.761698|3.159060|4.083502|3.119672|3.713272|3.889849|12.890907|26.055206|9.292204|10.884222|7.489472|31.476604|3.735501|5.317239|4.201482|2.732001|4.013142|2.593369|2.461869|2.165627|2.020997|2.089530|2.354128|14.034344|2.259027|2.113385|1.832995|1.706059|1.776133|2.028319|11.862016|0.177957|0.120004|0.093848|0.069549|0.080595|0.128269|0.198530|0.500000| |3.634341|3.779059|3.011076|2.603102|2.227395|2.144428|2.347587|2.799631|2.522986|3.075652|3.161146|6.525740|9.621465|8.866760|10.948287|17.610939|56.402937|6.766677|9.614821|6.486944|4.089448|6.274749|3.763568|3.338732|2.791921|2.604528|2.787191|3.334450|17.212479|3.119234|2.841172|2.356187|2.155038|2.262782|2.682952|14.472480|0.114947|0.084222|0.072827|0.056483|0.061106|0.083558|0.126935|0.211428|0.500000| |4.315492|4.091869|3.122944|2.748262|2.302905|2.160599|2.319883|2.777135|2.526750|3.111284|3.123446|6.442000|9.677629|8.878123|10.933395|17.620714|56.315794|6.752477|9.593478|6.466342|4.075540|6.258323|3.723967|3.515089|2.877813|2.570029|2.644146|3.115971|16.997261|3.107040|2.755633|2.303993|2.146933|2.295078|2.741376|14.421086|0.149302|0.099052|0.079229|0.058796|0.059428|0.080742|0.118057|0.199080|0.303698|0.500000| |2.333598|2.237661|1.958545|1.899520|1.689669|1.568712|1.597700|1.772257|1.924311|2.455290|2.375347|3.191193|3.675861|3.269640|5.917133|3.849750|39.959305|5.963100|6.132676|5.812694|5.189231|9.794012|8.926875|17.735607|8.917176|5.661805|4.948856|5.645674|31.609577|4.379912|3.325190|2.863241|2.950327|3.601260|4.677060|19.138802|0.071355|0.060039|0.056279|0.045379|0.041497|0.049285|0.064751|0.071374|0.094796|0.106384|0.500000| |1.955485|1.910763|1.735959|1.722057|1.566276|1.455359|1.461043|1.585739|1.813607|2.338851|2.239095|2.691385|2.958553|2.560790|4.846826|2.777822|26.475689|3.598215|4.011836|3.906848|3.382050|5.674865|5.647463|8.907809|17.756589|8.923247|5.637440|4.949622|53.857402|3.197405|2.613399|2.393320|2.550569|3.076675|3.586589|17.501745|0.057716|0.051296|0.050972|0.042683|0.038114|0.043620|0.055839|0.057013|0.070650|0.074469|0.214419|0.500000| |1.660774|1.685960|1.552115|1.499063|1.385694|1.329546|1.364191|1.472095|1.672491|2.127288|2.106804|2.479013|2.720805|2.308292|4.243385|2.555690|23.370327|3.449030|3.982585|4.059642|3.595285|5.675433|5.648828|4.950484|5.638271|8.922080|17.756449|8.911974|53.867322|3.606760|3.142719|2.901009|2.991690|3.373226|3.767331|20.385818|0.048451|0.042969|0.042892|0.037271|0.036308|0.041392|0.052312|0.053922|0.070470|0.065734|0.107506|0.124187|0.500000| |1.877560|1.901710|1.708410|1.614778|1.471547|1.416773|1.476082|1.620737|1.761008|2.217270|2.222682|2.859453|3.254767|2.795103|4.922212|3.324607|31.265919|5.360143|6.035068|6.347845|6.058306|9.792675|8.927979|5.646323|4.948312|5.661469|8.921518|17.739619|31.613124|5.628399|4.674632|3.866030|3.684185|4.081591|5.069304|23.016640|0.055806|0.047805|0.045996|0.039091|0.039264|0.046226|0.059571|0.065714|0.094628|0.084849|0.124289|0.107497|0.214484|0.500000| |1.729380|1.709869|1.522526|1.420564|1.296194|1.260277|1.327171|1.461395|1.570294|1.968047|1.998179|2.542752|2.926004|2.335220|3.846358|2.855683|21.942645|4.259985|6.606696|9.700851|7.215375|6.645939|3.959026|3.194075|2.717214|2.692960|3.100796|3.867212|17.681557|8.929792|17.753231|8.938775|5.668094|4.956153|5.656809|31.620427|0.052334|0.044353|0.040162|0.034288|0.035615|0.042322|0.050911|0.062273|0.084739|0.080083|0.084981|0.066684|0.080877|0.122165|0.500000| |1.424818|1.406149|1.276312|1.207286|1.115785|1.086592|1.134147|1.230510|1.369964|1.728266|1.747410|2.052402|2.295686|1.807844|3.047652|2.104398|16.191414|2.855202|4.131551|5.230057|4.142578|4.467897|3.002654|2.593491|2.339883|2.370312|2.667758|3.057012|16.327581|5.627835|8.912806|17.751912|8.922215|5.641740|4.954110|53.805556|0.042537|0.037130|0.034157|0.029770|0.030571|0.035366|0.041299|0.048320|0.060947|0.059034|0.068814|0.058759|0.071960|0.092988|0.214844|0.500000| |1.458825|1.420313|1.291544|1.247956|1.150822|1.101258|1.128917|1.220331|1.388833|1.772751|1.750844|2.028387|2.253516|1.824897|3.177450|2.089767|17.303832|2.942373|3.843550|4.538870|4.094508|4.997555|3.843895|3.662127|3.437256|3.384443|3.522159|3.755396|23.069115|5.630304|4.956086|5.641089|8.927959|17.752422|8.908434|53.840501|0.043542|0.038391|0.035935|0.031061|0.030088|0.034431|0.041039|0.045999|0.057355|0.058702|0.096125|0.087186|0.090408|0.100005|0.107625|0.124228|0.500000| 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