Version2.1 2021-01-21T12:03:33Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 10-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(=CC3)C4=c5ccccc5=[NH+]C4 C64173460 RHF 6-31G(d) (6D,7F) c1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(=CC3)C4=c5ccccc5=[NH+]C4 C01[X(C25H28N3O3S1)] 174 C1 540 O=C(N1CCC(=CC1)C1=c2ccccc2=[NH+]C1)C1CCN(CC1)S(=O)(=O)c1ccccc1 O=C(N1CCC(=CC1)C1=c2ccccc2=[NH+]C1)C1CCN(CC1)S(=O)(=O)c1ccccc1 O=C(C1CCN(CC1)[S](=O)(=O)c2ccccc2)N3CCC(=CC3)C4=C5C=CC=CC5=[NH+]C4 InChIKey=DUXJYCQRLKPQPF-UHFFFAOYSA-O InChI=1S/C25H27N3O3S/c29-25(20-12-16-28(17-13-20)32(30,31)21-6-2-1-3-7-21)27-14-10-19(11-15-27)23-18-26-24-9-5-4-8-22(23)24/h1-10,20H,11-18H2/p+1 InChI=1/C25H27N3O3S/c29-25(20-12-16-28(17-13-20)32(30,31)21-6-2-1-3-7-21)27-14-10-19(11-15-27)23-18-26-24-9-5-4-8-22(23)24/h1-10,20H,11-18H2/p+1/fC25H28N3O3S/h26H/q+1 c1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(=CC3)C4=c5ccccc5=[NH+]C4 C01[X(C25H28N3O3S1)] 174 C01 540 O=C(N1CCC(=CC1)C1=c2ccccc2=[NH+]C1)C1CCN(CC1)S(=O)(=O)c1ccccc1 O=C(N1CCC(=CC1)[C]1[C]2[CH]=[CH][CH]=[CH][C]2[NH]C1)C1CCN(CC1)S(=O)(=O)[C]1[CH][CH][CH][CH][CH]1 O=C(C1CCN(CC1)[S](=O)(=O)[C]2[CH][CH][CH][CH][CH]2)N3CCC(=CC3)[C]4CN[C]5C=CC=C[C]45 InChIKey=ZOJICKJUCRWOAI-UHFFFAOYSA-N InChI=1S/C25H28N3O3S/c29-25(20-12-16-28(17-13-20)32(30,31)21-6-2-1-3-7-21)27-14-10-19(11-15-27)23-18-26-24-9-5-4-8-22(23)24/h1-10,20,26H,11-18H2 InChI=1/C25H28N3O3S/c29-25(20-12-16-28(17-13-20)32(30,31)21-6-2-1-3-7-21)27-14-10-19(11-15-27)23-18-26-24-9-5-4-8-22(23)24/h1-10,20,26H,11-18H2 3238.9888838800 -1748.1786742 1-A 26580.9087 119 421 540 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.25198 -20.61699 -20.59812 -20.59767 -15.77625 -15.68753 -15.65332 -11.48506 -11.46108 -11.44504 -11.43921 -11.42153 -11.40717 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0.2912 0.2432 0.6546 0.7534 0.8558 0.6206 0.5547 0.4914 0.4753 0.8564 0.5382 0.5500 0.8570 0.8116 0.3045 0.8336 0.2054 0.2756 0.2658 0.2067 0.4905 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 57 58 59 60 6 6 6 6 6 6 16 8 8 7 6 6 6 6 6 6 8 7 6 6 6 6 6 6 6 6 6 6 6 6 7 1 6 1 1 1 1 1 1 1 1 1 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 31.97207 15.99491 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 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 4858.9781 46305.1942 47579.9348 0.99999 0.00382 -0.00059 -0.00383 0.99964 -0.02662 0.00049 0.02662 0.99965 1 0.01783 0.00187 0.00182 0.37142 0.03897 0.03793 10.48 22.55 31.71 42.97 52.23 57.38 89.88 107.62 128.07 141.57 151.51 228.23 248.26 259.26 283.82 289.71 321.82 354.27 371.72 386.66 407.51 423.53 443.14 483.16 509.51 527.52 565.76 583.49 612.49 626.87 631.80 648.51 673.40 724.59 726.91 740.79 753.17 762.06 788.52 798.76 821.34 841.16 876.11 897.03 914.25 946.11 968.60 976.83 1016.51 1092.55 1118.86 1122.48 1140.26 1171.44 1197.68 1206.50 1230.63 1235.79 1285.37 1291.12 1323.94 1338.07 1354.84 1373.22 1381.64 1384.56 1458.05 1465.01 1487.54 1501.89 1519.60 1528.27 1536.31 1544.12 1567.06 1569.57 1596.36 1604.83 1615.71 1616.91 1623.49 1638.42 1640.42 1641.99 1664.20 1675.13 1700.15 1702.25 1712.17 1726.90 1749.71 1768.37 1786.28 1793.34 1822.76 1826.41 1840.24 1873.67 1877.99 1890.16 1893.92 1903.50 1929.38 1939.42 1945.75 1968.22 2013.33 2020.41 2027.86 2039.36 2078.35 2081.70 2097.78 2107.55 2113.50 2136.36 2147.73 2168.55 2179.61 2184.34 2198.32 2204.08 2220.76 2239.32 2258.84 2264.79 2277.64 2296.97 2305.08 2318.80 2335.63 2339.39 2343.58 2353.80 2365.09 2369.18 2377.99 2385.09 2397.25 2483.40 2530.68 2567.97 2582.60 2626.63 2655.84 2793.17 4561.36 4582.15 4601.69 4610.15 4610.85 4635.98 4638.33 4655.62 4666.60 4671.95 4699.19 4722.36 4743.24 4755.24 4800.08 4821.12 4850.42 4852.04 4855.63 4869.52 4878.55 4884.33 4900.38 4902.75 4908.24 4918.64 4929.30 5575.74 0.537176 0.563082 0.564026 0.476287 -1747.641499 -1747.615592 -1747.614648 -1747.702387 2.942780D-04 MUNgauss RevisionA2.0 retrievium 21-Jan-2021 DUDE c1ccc(cc1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC(=CC3)C4=c5ccccc5=[NH+]C4 C64173460 RHF 6-31G(d) (6D,10F) C1 450.185139 |X|Y|Z| 42.753710 34.110371 153.586972 60.730223 29 6 7 16 25 3 1 |36.858105| |13.707807|36.858105| |7.941986|13.799392|36.858105| |6.924152|7.975719|13.708820|36.858105| |7.939275|6.847307|7.877139|13.762334|36.858105| |13.770838|7.912653|6.849458|7.974512|13.730181|36.858105| |4.216515|4.748396|6.982246|10.779767|6.980849|4.741917|388.023441| |3.702943|3.823628|4.925384|7.339068|6.582651|4.451411|94.467095|73.516695| |3.697084|4.332312|6.196212|7.283974|5.084970|3.893254|94.686112|13.676175|73.516695| |3.681120|4.222260|5.861717|7.097309|5.155484|3.930993|81.526388|13.354595|13.693372|53.358707| |3.526402|3.794609|4.772321|5.846018|4.977695|3.890848|51.359158|11.608616|8.919972|17.690697|36.858105| |3.075527|3.346499|3.975223|4.318626|3.773135|3.221239|34.184703|7.656978|6.890035|10.597553|12.495097|36.858105| |2.566629|2.825199|3.348592|3.543956|3.067866|2.649260|29.945861|6.741549|6.575725|8.970183|7.581909|12.445457|36.858105| |2.640830|3.011675|3.706824|3.818610|3.134786|2.679263|34.187051|7.131603|8.098038|10.613458|6.560260|7.611461|12.376803|36.858105| |2.920914|3.335871|4.338136|4.772931|3.746947|3.042054|51.320312|10.000271|12.061753|17.681229|7.766502|6.536216|7.541515|12.494773|36.858105| |2.271256|2.486994|2.826334|2.876128|2.554558|2.295258|22.773646|5.190985|5.204596|6.045601|4.926995|7.569863|12.496415|7.542080|4.912523|36.858105| |2.321976|2.533637|2.808427|2.801207|2.520455|2.315905|21.077530|4.789911|4.786949|5.412036|4.490193|6.959518|8.008666|5.656560|4.079740|15.889908|73.516695| |1.971916|2.148597|2.418079|2.453723|2.199186|1.990249|19.635209|4.551930|4.646420|4.918229|3.809808|5.025567|7.628021|6.099875|4.203981|13.832749|15.170376|53.358707| |1.786273|1.934338|2.125068|2.123053|1.931023|1.784403|16.446548|3.834244|3.933919|3.934174|3.033426|3.857333|4.974540|4.297042|3.226907|7.839981|12.648660|17.871666|36.858105| |1.643134|1.747172|1.897427|1.921781|1.785263|1.658114|14.794206|3.539570|3.502724|3.448533|2.733127|3.385980|4.109664|3.440080|2.758653|5.752133|9.761161|10.620747|12.478271|36.858105| |1.572248|1.662949|1.819552|1.871578|1.744751|1.604803|14.725747|3.586208|3.498548|3.394540|2.681131|3.194254|3.956772|3.357304|2.770669|4.962965|7.743716|9.293871|7.643791|12.525335|36.858105| |1.642152|1.746829|1.940314|2.013037|1.857325|1.684965|16.275476|3.966939|3.887996|3.793776|2.954005|3.465056|4.555371|3.929188|3.215639|5.375594|7.699793|10.631916|6.874372|7.654118|14.299231|36.858105| |1.836554|1.986053|2.247630|2.321837|2.092182|1.875800|19.165466|4.549475|4.600707|4.664356|3.542577|4.268643|6.349960|5.584766|4.169627|7.571783|9.485815|17.974812|7.888670|6.447019|7.608517|12.621218|36.858105| |1.427914|1.493657|1.617163|1.669443|1.578953|1.462925|13.010102|3.216880|3.092568|2.915930|2.308994|2.662051|3.120248|2.703441|2.333308|3.666641|6.000047|6.119467|4.957072|7.437921|13.031610|7.859569|4.958185|36.858105| |1.317987|1.375042|1.486249|1.536792|1.458348|1.352416|12.017000|2.992725|2.885178|2.641142|2.060782|2.305562|2.671471|2.396187|2.121653|3.001356|4.902863|4.898381|3.838482|4.993105|7.409134|6.112227|4.128388|13.934753|36.858105| |1.275333|1.335633|1.449312|1.497244|1.413894|1.307353|11.819062|2.940806|2.876631|2.573792|1.968081|2.161563|2.528135|2.347138|2.100270|2.769091|4.456303|4.550366|3.472527|4.102392|5.768625|5.640834|4.011256|7.401122|13.226194|36.858105| |1.177600|1.227414|1.324872|1.369400|1.301426|1.208321|10.756750|2.693448|2.628813|2.302169|1.752427|1.891965|2.164495|2.036081|1.861207|2.322039|3.791057|3.687355|2.793858|3.206930|4.123414|4.068684|3.158586|5.118040|7.949986|14.179890|36.858105| |1.121434|1.161010|1.244284|1.287354|1.234154|1.152391|10.006323|2.519430|2.430216|2.126084|1.633248|1.759046|1.969396|1.834028|1.690328|2.109507|3.506776|3.264964|2.491161|2.907172|3.585960|3.396363|2.698924|4.634583|6.878224|7.872917|13.206114|36.858105| |1.143178|1.179505|1.259597|1.303798|1.255266|1.175549|10.059701|2.535104|2.421473|2.147245|1.670378|1.815886|2.013915|1.841651|1.688839|2.181436|3.669758|3.345452|2.583202|3.123090|3.812134|3.433692|2.700651|5.280935|7.665218|6.627311|7.724207|14.043198|36.858105| |1.237338|1.280313|1.371432|1.419242|1.361323|1.271644|10.962987|2.750060|2.621730|2.376095|1.866182|2.066822|2.317229|2.076912|1.872113|2.567186|4.309691|3.999117|3.135159|4.015146|5.135128|4.309224|3.216336|8.398286|13.236141|7.669696|6.826080|8.073362|13.471171|36.858105| |1.271594|1.311109|1.397672|1.445281|1.392669|1.306530|11.050400|2.770062|2.618664|2.405413|1.915328|2.147193|2.368967|2.082239|1.868443|2.662091|4.566458|4.060460|3.229894|4.303227|5.135914|4.084575|3.128843|8.249262|8.430762|5.294201|4.654858|5.255188|7.727889|14.452272|53.358707| |1.223476|1.255161|1.329940|1.374673|1.333140|1.257420|10.424138|2.620999|2.466578|2.249323|1.794149|1.996766|2.161697|1.907523|1.728770|2.404511|4.184820|3.582466|2.836306|3.656228|4.111990|3.390584|2.714844|5.813824|5.914707|4.237295|3.952466|4.643380|6.825151|9.256439|26.023795|0.500000| |1.393241|1.443953|1.545804|1.595442|1.527491|1.428523|12.210128|3.035387|2.875283|2.710502|2.180140|2.513565|2.813025|2.407377|2.109585|3.285899|5.650473|5.094273|4.162692|6.186239|7.369205|5.144086|3.815912|12.655951|8.186860|5.073435|4.098095|4.149388|5.202039|8.365993|17.956545|0.244393|36.858105| |17.721716|8.914418|5.652852|4.978843|5.648464|8.932929|24.221512|5.472988|5.468121|4.176399|2.991316|2.697404|2.286002|2.331521|2.522255|2.068492|3.794443|2.468164|1.665434|1.541776|1.470540|1.523801|1.687424|1.344398|1.243646|1.201996|1.113934|1.065107|1.087385|1.173794|1.645214|0.032429|1.319498|0.500000| |8.896632|17.730756|8.941902|5.661125|4.939729|5.636615|27.882314|5.696960|6.700759|4.976552|3.291578|3.038138|2.631820|2.825883|3.033348|2.378622|4.350725|2.824128|1.893757|1.702717|1.608746|1.680105|1.906672|1.445673|1.331973|1.295372|1.191636|1.127227|1.144468|1.240920|1.729431|0.033816|1.398355|0.214969|0.500000| |5.641501|8.909406|17.747223|8.900254|5.625071|4.942258|47.435890|8.049339|12.049598|8.330738|4.623939|4.014206|3.532944|4.133763|4.809890|2.989630|5.230440|3.500163|2.250480|1.974961|1.888414|2.025624|2.382639|1.663668|1.528506|1.498229|1.365026|1.274063|1.284725|1.400443|1.934293|0.037411|1.575858|0.124124|0.214728|0.500000| |5.639505|4.942156|5.627725|8.934476|17.759395|8.871332|47.463918|13.739005|8.476479|6.667510|4.970622|3.668846|3.012923|3.021006|3.649872|2.489928|4.318262|2.941092|1.890501|1.768353|1.748787|1.868521|2.085750|1.592644|1.476412|1.431540|1.320965|1.255205|1.276773|1.381767|1.921895|0.037577|1.542284|0.124001|0.107359|0.124096|0.500000| |8.915059|5.633569|4.940866|5.663449|8.922399|17.731051|27.852941|6.946072|5.835745|4.537115|3.406022|2.877150|2.392296|2.379581|2.664846|2.101166|3.779654|2.503201|1.662876|1.564019|1.518844|1.586104|1.742705|1.397555|1.296373|1.250853|1.161382|1.113564|1.138298|1.227260|1.719727|0.033924|1.374035|0.215174|0.123999|0.107361|0.213897|0.500000| |4.159439|4.316713|5.307681|6.849059|6.244450|4.769483|49.498045|11.550330|8.328780|12.445563|17.624228|8.900474|5.528951|4.924221|5.650086|4.098407|7.055248|4.409302|2.692460|2.466161|2.394260|2.576240|2.990146|2.102090|1.885540|1.793980|1.612903|1.518619|1.559736|1.732415|2.436306|0.047017|2.021490|0.096179|0.100716|0.132916|0.171368|0.114550|0.500000| |3.097464|3.233595|3.940457|4.897834|4.456312|3.495962|45.611086|12.313479|8.195492|12.302172|17.513005|8.789431|6.779089|5.712354|6.944422|4.515899|7.116423|4.992332|2.915151|2.698971|2.730939|3.051713|3.581708|2.379006|2.138917|2.045997|1.825604|1.702333|1.739026|1.938776|2.696462|0.051485|2.239636|0.074232|0.078647|0.105735|0.132123|0.087774|0.302697|0.500000| |3.332290|3.723724|4.370091|4.451856|3.816582|3.362344|32.414508|6.917929|6.718375|9.525433|8.873243|17.609627|8.858033|6.868510|5.739539|6.986657|13.138896|6.364079|3.778952|3.239784|2.952304|3.124192|3.817754|2.472493|2.146235|2.015379|1.772871|1.653496|1.707421|1.935788|2.746202|0.052406|2.356058|0.081249|0.095200|0.124152|0.098986|0.082261|0.217115|0.173316|0.500000| |2.865899|3.010919|3.426116|3.743324|3.469923|3.038257|28.469933|6.789875|5.797614|7.671001|8.896045|17.567123|8.808885|5.515418|4.892011|6.880906|12.151973|6.452416|3.786419|3.500159|3.290364|3.468412|4.041655|2.784656|2.383989|2.192127|1.919265|1.804573|1.886325|2.162570|3.107176|0.059229|2.694542|0.071059|0.076298|0.093711|0.095809|0.077352|0.213972|0.214568|0.303510|0.500000| |2.375328|2.560318|3.010174|3.281074|2.915636|2.499822|28.587303|6.839293|6.264808|7.970335|6.965140|8.943455|17.519195|8.868377|6.903530|8.878736|10.827236|9.506530|4.620032|4.083805|4.222173|5.104934|6.940683|3.354741|2.888253|2.737061|2.332294|2.113103|2.156443|2.486689|3.431930|0.063501|2.980913|0.059015|0.065880|0.086709|0.081773|0.063578|0.141945|0.204361|0.174775|0.215473|0.500000| |2.785466|3.268093|4.015412|3.898233|3.144069|2.744472|32.457763|6.514421|7.885185|9.559920|5.766464|6.891208|8.844760|17.554489|8.888278|6.967792|10.391598|7.542879|4.206550|3.287915|3.083396|3.464171|4.714875|2.505844|2.220730|2.168479|1.893854|1.717136|1.729016|1.943705|2.669001|0.050213|2.264142|0.068412|0.086802|0.129219|0.081849|0.067042|0.129598|0.132448|0.203967|0.140568|0.174060|0.500000| |2.317467|2.617016|3.142746|3.212747|2.701225|2.344740|28.502846|6.184418|7.127113|7.686646|4.901627|5.502645|8.717531|17.551023|8.928422|6.812400|8.906899|8.995982|4.582377|3.594913|3.606553|4.397272|6.698667|2.860744|2.559745|2.557708|2.199942|1.948390|1.933755|2.178523|2.926598|0.054259|2.477344|0.057617|0.069186|0.097299|0.073057|0.058606|0.108066|0.127726|0.140064|0.122851|0.211867|0.302740|0.500000| |2.641385|2.917967|3.666623|4.175705|3.467782|2.812709|45.405317|10.328405|10.561480|12.270233|6.948406|5.704271|6.777099|8.835413|17.473450|4.517555|6.573613|5.511257|3.102527|2.730622|2.837597|3.370085|4.294211|2.411784|2.214992|2.208533|1.959877|1.773369|1.763468|1.948820|2.626447|0.049459|2.163208|0.064020|0.073632|0.108528|0.097650|0.069872|0.142383|0.204885|0.132155|0.127732|0.203344|0.173778|0.216112|0.500000| |2.886785|3.368138|4.426263|4.662798|3.585565|2.949420|49.566672|9.198005|14.523646|12.477152|5.659608|4.916171|5.504051|8.866133|17.687639|4.083769|6.236010|4.987652|2.928463|2.497542|2.503792|2.881885|3.667809|2.133093|1.965789|1.970766|1.762581|1.598164|1.585272|1.740313|2.349406|0.044500|1.928072|0.069394|0.086241|0.143241|0.095446|0.071452|0.127443|0.142638|0.129176|0.107983|0.140861|0.216603|0.214144|0.301935|0.500000| |1.684083|1.830842|2.009931|1.995255|1.809001|1.675048|15.522625|3.609444|3.789246|3.642068|2.724437|3.320493|4.236779|3.972692|3.041704|5.886693|9.414833|12.539720|17.544730|8.853435|6.775252|6.443811|7.311812|4.652963|3.805847|3.603172|2.895287|2.530421|2.569501|3.064681|4.166078|0.074629|3.787663|0.043726|0.050094|0.059596|0.049141|0.043368|0.067452|0.073025|0.090967|0.088867|0.110917|0.109012|0.122991|0.081507|0.078704|0.500000| |1.854345|2.016192|2.194177|2.160215|1.963568|1.832918|16.354005|3.770004|3.898816|3.910465|3.019305|3.906621|4.751377|4.132369|3.116201|7.593506|14.848762|12.520387|17.711477|8.827696|5.554457|4.999015|5.721534|4.064709|3.241380|2.935473|2.438301|2.220463|2.317101|2.765556|3.950438|0.072484|3.672513|0.048204|0.055251|0.064610|0.052887|0.047347|0.075676|0.078756|0.111222|0.106601|0.116771|0.118282|0.117174|0.081252|0.079062|0.301694|0.500000| |1.527054|1.620290|1.741766|1.750545|1.634109|1.532353|13.320973|3.187343|3.182196|3.042654|2.380512|2.876645|3.368027|2.939729|2.413731|4.464232|7.916986|7.692212|8.858703|17.530984|8.855041|5.811150|4.933072|6.928139|4.923692|4.039844|3.212254|2.949525|3.191652|4.086247|6.005589|0.105017|6.163232|0.040083|0.044174|0.050351|0.044861|0.040306|0.060593|0.065104|0.077949|0.082265|0.092233|0.079613|0.085453|0.066152|0.061791|0.218562|0.207540|0.500000| |1.705001|1.799467|1.943477|1.977221|1.853050|1.726584|15.041061|3.618673|3.504358|3.515341|2.866877|3.624835|4.210760|3.368720|2.735494|5.909825|10.800086|9.297627|8.866712|17.526627|8.827035|6.142805|5.441800|6.475060|4.429487|3.576601|2.892442|2.705729|2.968981|3.802951|5.850648|0.104049|6.367544|0.044489|0.048532|0.055632|0.051063|0.045383|0.072578|0.078529|0.096179|0.108223|0.115774|0.089694|0.094188|0.075000|0.068013|0.174175|0.218835|0.302101|0.500000| |1.567857|1.658125|1.841879|1.927801|1.790036|1.619355|15.730203|3.897334|3.776501|3.584857|2.772841|3.121170|3.974256|3.541346|3.044306|4.313202|6.329800|7.632180|4.964445|5.479938|9.088492|17.708301|8.647868|7.217173|6.603650|6.677687|4.714581|3.789655|3.714452|4.549115|5.557470|0.094047|4.777284|0.040433|0.044164|0.053185|0.050444|0.042529|0.067479|0.081268|0.077646|0.086828|0.127557|0.086003|0.110311|0.091089|0.076472|0.134875|0.108365|0.126711|0.131089|0.500000| |1.938360|2.091235|2.400608|2.531608|2.273380|2.004660|21.581873|5.186988|5.120306|5.342537|4.082278|4.772461|7.456569|6.427046|4.944169|7.181089|8.861948|12.398043|5.698561|4.987675|5.863553|9.006426|17.673642|4.284701|3.702411|3.633778|2.953270|2.553799|2.547819|2.977587|3.945541|0.070800|3.443832|0.049063|0.055109|0.070361|0.063562|0.051613|0.092871|0.118431|0.112838|0.123500|0.264351|0.138530|0.213035|0.149362|0.116231|0.145246|0.127619|0.110179|0.127009|0.217282|0.500000| |1.766490|1.924332|2.178976|2.225706|1.991138|1.790871|18.423677|4.326859|4.553650|4.384907|3.184332|3.687709|5.228180|5.276906|4.018018|5.897806|7.946923|12.392583|6.782976|5.334672|6.084805|8.980316|17.486528|4.318826|3.818750|3.935093|3.140398|2.631176|2.570536|2.983805|3.864758|0.068957|3.341501|0.045172|0.051689|0.064931|0.054868|0.046130|0.075486|0.088561|0.094473|0.094958|0.151258|0.127481|0.190986|0.113994|0.102576|0.206121|0.142852|0.123189|0.122904|0.203379|0.304967|0.500000| |1.322884|1.394777|1.523103|1.569848|1.469606|1.352956|12.504416|3.088425|3.066662|2.740943|2.070326|2.276463|2.722088|2.570474|2.277050|2.981556|4.706742|5.044735|3.796613|4.273188|6.062330|6.549393|4.661222|6.551157|8.724874|17.766959|9.031853|5.595527|4.827439|5.512254|5.839444|0.098188|4.422440|0.034520|0.037600|0.044029|0.041214|0.035780|0.051952|0.059587|0.058932|0.063207|0.081802|0.065625|0.079478|0.066578|0.059568|0.112880|0.087332|0.114626|0.100421|0.221743|0.114772|0.132467|0.500000| |1.143429|1.193600|1.289422|1.331176|1.262887|1.172108|10.487294|2.624548|2.584614|2.226542|1.676046|1.790534|2.046777|1.961085|1.809015|2.167645|3.531169|3.423223|2.566027|2.841686|3.542360|3.624932|2.943810|4.093802|5.626415|9.042172|17.756761|8.778897|5.591191|4.933101|5.020300|0.089981|3.353023|0.030048|0.032226|0.036987|0.035597|0.031278|0.042867|0.048468|0.046737|0.050010|0.061068|0.050744|0.059220|0.053009|0.048021|0.074838|0.062677|0.078911|0.071242|0.116632|0.077224|0.083357|0.215858|0.500000| |1.059493|1.094437|1.169528|1.209529|1.163009|1.088737|9.375478|2.366331|2.285054|1.972394|1.508066|1.608497|1.783796|1.677228|1.562089|1.890495|3.158174|2.887761|2.190577|2.499848|2.986663|2.876085|2.366807|3.674324|4.956059|5.657272|8.805500|17.723586|9.085572|5.701950|5.714748|0.108580|3.397283|0.028013|0.029544|0.033221|0.032885|0.029294|0.039145|0.043654|0.042147|0.045720|0.052959|0.043786|0.049360|0.045514|0.041271|0.061977|0.054928|0.070557|0.065226|0.088453|0.062877|0.064689|0.124129|0.215534|0.500000| 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|1.382201|1.435373|1.527448|1.562040|1.493779|1.406960|11.820545|2.911915|2.790472|2.624642|2.101535|2.445494|2.709758|2.334792|2.030153|3.240502|5.749527|4.991973|4.316136|6.579768|6.519371|4.529776|3.562736|8.828897|6.225832|4.310815|3.575055|3.612083|4.400790|6.329140|12.362219|0.206077|17.558872|0.036499|0.038826|0.043330|0.041624|0.037566|0.054497|0.059102|0.064828|0.072632|0.077726|0.062028|0.066432|0.057035|0.051822|0.108926|0.109048|0.203741|0.191659|0.112907|0.087975|0.088021|0.108129|0.083485|0.084410|0.110802|0.500000| 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