Version2.3 2021-04-02T09:21:28Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 19-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@@H](CNC(=O)[C@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccccc4Cl C39666523 RHF 6-31G(d) (6D,7F) C[C@@H](CNC(=O)[C@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccccc4Cl C01[X(C24H32Cl1N4O3)] 186 C1 548 C[C@H](Oc1ccccc1Cl)CNC(=O)[C@H]1CN(CC21CC[NH2+]CC2)C(=O)c1cccn1C C[C@H](Oc1ccccc1Cl)CNC(=O)[C@H]1CN(CC21CC[NH2+]CC2)C(=O)c1cccn1C C[C@@H](CNC(=O)[C@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccccc4Cl InChIKey=DVDVJURMGREWIN-ZWKOTPCHSA-O InChI=1S/C24H31ClN4O3/c1-17(32-21-8-4-3-6-19(21)25)14-27-22(30)18-15-29(16-24(18)9-11-26-12-10-24)23(31)20-7-5-13-28(20)2/h3-8,13,17-18,26H,9-12,14-16H2,1-2H3,(H,27,30)/p+1/t17-,18+/m0/s1 InChI=1/C24H31ClN4O3/c1-17(32-21-8-4-3-6-19(21)25)14-27-22(30)18-15-29(16-24(18)9-11-26-12-10-24)23(31)20-7-5-13-28(20)2/h3-8,13,17-18,26H,9-12,14-16H2,1-2H3,(H,27,30)/p+1/t17-,18+/m0/s1/fC24H32ClN4O3/h26-27H/q+1 C[C@@H](CNC(=O)[C@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccccc4Cl C01[X(C24H32Cl1N4O3)] 186 C01 548 C[C@H](Oc1ccccc1Cl)CNC(=O)[C@H]1CN(CC21CC[NH2+]CC2)C(=O)c1cccn1C C[C@H](O[C]1[CH][CH][CH][CH][C]1Cl)CNC(=O)[C@H]1CN(CC21CC[NH2]CC2)C(=O)[C]1[CH][CH][CH][N]1C C[C@@H](CNC(=O)[C@H]1CN(CC12CC[NH2]CC2)C(=O)[C]3[CH][CH][CH]N3C)O[C]4[CH][CH][CH][CH][C]4Cl InChIKey=INUOODVYUDWUPQ-ZWKOTPCHSA-N InChI=1S/C24H32ClN4O3/c1-17(32-21-8-4-3-6-19(21)25)14-27-22(30)18-15-29(16-24(18)9-11-26-12-10-24)23(31)20-7-5-13-28(20)2/h3-8,13,17-18H,9-12,14-16,26H2,1-2H3,(H,27,30)/t17-,18+/m0/s1 InChI=1/C24H32ClN4O3/c1-17(32-21-8-4-3-6-19(21)25)14-27-22(30)18-15-29(16-24(18)9-11-26-12-10-24)23(31)20-7-5-13-28(20)2/h3-8,13,17-18H,9-12,14-16,26H2,1-2H3,(H,27,30)/t17-,18+/m0/s1/f/h27H 3560.9647964240 -1829.159255 1-A 19117.2834 122 426 548 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0.1508 0.6302 0.2573 0.1671 0.8007 0.8016 0.8090 0.8517 0.8356 0.8569 0.8543 0.7694 0.8425 0.7862 0.8381 0.3155 0.2225 0.8539 0.6349 0.1995 0.3501 0.7729 0.2948 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 61 62 63 64 6 6 1 6 7 6 8 6 1 6 7 6 6 6 6 7 1 1 6 6 6 8 6 6 6 6 7 6 8 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 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 1.00783 12.00000 14.00307 12.00000 15.99491 12.00000 1.00783 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 6459.9242 30005.0398 32845.2456 0.99999 0.00416 -0.00273 -0.00416 0.99999 -0.00049 0.00273 0.00050 1.00000 1 0.01341 0.00289 0.00264 0.27937 0.06015 0.05495 22.99 35.50 36.84 47.15 59.47 77.01 85.36 93.45 129.43 145.14 162.43 164.26 196.54 228.97 246.64 257.54 266.77 301.78 303.31 327.13 332.83 334.96 349.57 365.50 380.97 405.02 407.94 425.92 442.33 505.11 522.69 547.39 588.07 624.12 629.61 651.17 672.87 694.37 710.63 717.85 730.00 745.05 770.77 796.40 835.94 869.43 921.44 952.61 965.74 980.06 991.85 1055.12 1077.47 1099.68 1156.82 1195.90 1213.45 1218.86 1228.39 1230.71 1238.40 1247.18 1249.14 1268.68 1365.10 1370.75 1380.86 1389.97 1395.03 1402.04 1416.42 1450.62 1461.72 1468.43 1509.59 1526.74 1545.61 1554.62 1569.99 1590.67 1606.03 1618.28 1629.24 1636.23 1638.61 1644.46 1661.85 1667.95 1672.44 1718.66 1733.51 1745.96 1751.60 1771.86 1787.48 1791.84 1810.34 1815.07 1835.07 1856.30 1867.09 1896.02 1906.95 1914.85 1924.56 1941.74 1958.67 1989.12 2010.59 2019.78 2027.36 2053.76 2062.51 2083.86 2092.71 2096.79 2116.08 2126.05 2144.46 2168.19 2190.92 2206.34 2211.46 2222.20 2232.47 2248.65 2255.16 2259.38 2262.01 2264.57 2277.83 2301.00 2309.12 2319.11 2338.01 2349.30 2350.00 2359.60 2361.85 2366.85 2368.54 2375.94 2389.09 2392.45 2393.11 2412.19 2433.68 2482.25 2495.53 2554.55 2583.58 2639.47 2725.70 2794.27 4614.42 4624.10 4635.43 4638.47 4648.39 4662.19 4686.74 4701.54 4704.19 4706.13 4718.23 4719.50 4737.20 4738.97 4757.08 4770.78 4776.40 4795.67 4799.15 4808.29 4816.19 4818.48 4865.10 4881.73 4901.12 4916.61 4939.56 4963.91 4977.76 5210.29 5352.64 5583.70 0.588907 0.617337 0.618281 0.527247 -1828.570348 -1828.541918 -1828.540974 -1828.632008 3.053295D-04 MUNgauss RevisionA2.1 retrievium 02-Apr-2021 DUDE C[C@@H](CNC(=O)[C@H]1CN(CC12CC[NH2+]CC2)C(=O)c3cccn3C)Oc4ccccc4Cl C39666523 RHF 6-31G(d) (6D,10F) C1 459.216294 |X|Y|Z| 123.283819 52.454890 34.157952 60.449767 27 6 7 8 22 4 1 |36.858105| |12.510388|36.858105| |8.834485|17.550595|0.500000| |7.589869|12.496195|0.247686|36.858105| |5.006069|7.713781|0.196326|13.162172|53.358707| |3.941216|5.327738|0.133512|7.755458|19.223758|36.858105| |3.801054|4.755357|0.113990|6.794094|11.542770|15.846145|73.516695| |3.112190|4.034156|0.108579|5.007858|10.668011|12.516128|14.247636|36.858105| |3.076708|4.028912|0.114199|4.830084|10.382360|8.864339|10.469984|17.529834|0.500000| |2.585744|3.145344|0.084593|3.865685|7.103815|7.455542|11.545211|12.440139|0.247345|36.858105| |2.255819|2.700166|0.073643|3.119916|5.452302|5.148574|8.250737|8.130883|0.192677|13.033300|53.358707| |2.340424|2.847898|0.078288|3.161693|5.555964|5.044813|7.801591|8.069016|0.201289|7.886422|17.855692|36.858105| |2.841560|3.601262|0.096608|4.051839|7.507803|7.351878|10.710654|12.242783|0.247779|7.862568|11.013441|12.391300|36.858105| |2.769159|3.373867|0.086811|3.778350|6.347899|6.319951|11.328967|7.385553|0.152171|6.193202|8.460006|7.502526|12.318861|36.858105| |2.457164|2.900531|0.075618|3.058216|4.839445|4.292208|7.670102|4.832727|0.113055|4.295114|6.410837|5.999472|7.446846|12.505361|36.858105| |2.614187|3.118909|0.082259|3.114030|4.853309|4.002972|6.829397|4.365412|0.108749|3.628305|5.262427|5.057793|6.468630|7.697447|12.662853|53.358707| |2.363515|2.743290|0.072892|2.700246|4.097014|3.304236|5.715496|3.564855|0.090971|3.090746|4.541469|4.228733|4.909514|5.680328|9.173296|25.700924|0.500000| |2.936678|3.515645|0.090631|3.433031|5.202426|4.203080|7.283062|4.264806|0.105796|3.461543|4.768578|4.341521|5.829016|7.079397|9.191297|25.582555|0.327613|0.500000| |2.644555|3.247393|0.089075|3.210355|5.212928|4.150228|6.588165|4.849083|0.128888|3.838514|5.684757|5.944362|7.447123|6.486201|7.621931|17.275272|0.255167|0.255925|36.858105| |3.047973|3.963355|0.109410|4.080223|7.282240|5.894972|8.497017|7.460656|0.200257|5.017678|6.973250|7.414548|12.390816|7.579010|6.503295|10.501685|0.157993|0.197114|12.502356|36.858105| |1.954328|2.281238|0.062849|2.585700|4.320795|3.817209|6.306138|5.243766|0.137870|7.493177|18.921024|7.935737|5.221966|4.426850|3.752151|4.314285|0.079155|0.079802|3.407403|3.889868|36.858105| |1.815451|2.106115|0.058540|2.323444|3.816977|3.250479|5.353649|4.324826|0.118349|5.318151|11.665702|7.283550|4.640399|3.949076|3.599488|4.247711|0.079589|0.077176|3.422045|3.720394|15.779557|73.516695| |1.839042|2.106263|0.057799|2.415708|3.926881|3.421435|5.845189|4.303223|0.113319|6.309091|10.595852|5.065962|3.976301|3.599356|3.066531|3.567309|0.066347|0.067738|2.740357|3.100466|12.953002|14.432396|36.858105| |1.870702|2.118692|0.057372|2.474901|3.949476|3.487601|6.219578|4.108772|0.104499|6.133062|8.438091|4.226164|3.657679|3.494075|2.922136|3.371004|0.062644|0.065250|2.517186|2.854534|7.364302|9.359537|13.868146|36.858105| |1.679830|1.868842|0.050878|2.153663|3.340592|2.832850|5.066040|3.198585|0.084085|4.295572|5.884447|3.268771|2.888140|2.780217|2.413857|2.854331|0.053884|0.055621|2.130792|2.369348|5.158854|7.467503|8.484887|13.547829|36.858105| |1.574794|1.754179|0.048304|1.986807|3.089435|2.566674|4.480911|2.958464|0.080101|3.827239|5.582570|3.197840|2.732629|2.568792|2.283506|2.741668|0.052155|0.052965|2.080741|2.289308|5.286000|8.175422|8.627381|8.585577|13.940417|36.858105| |1.646285|1.859315|0.051471|2.096297|3.328436|2.785872|4.758051|3.362426|0.091945|4.420219|7.029878|3.914206|3.157244|2.879187|2.556918|3.060550|0.057952|0.058329|2.362888|2.610185|7.679480|11.866627|13.842334|8.577950|8.576679|14.143318|53.358707| |1.540593|1.736639|0.048584|1.918508|3.029015|2.471662|4.161621|2.982636|0.084009|3.647004|5.944096|3.634999|2.889815|2.595850|2.379609|2.916832|0.055874|0.055214|2.291784|2.483700|6.269496|11.961776|7.482445|5.229332|5.265596|7.710271|17.811095|36.858105| |7.829681|13.402592|0.258061|8.082922|9.226762|5.372226|8.676771|4.213292|0.113183|3.207162|3.852565|3.099132|4.082451|3.938673|3.454386|5.292878|0.093384|0.128128|3.967438|4.764142|2.359598|3.907531|2.133685|2.125988|1.857322|1.748143|2.545737|1.753249|73.516695| |6.191154|7.873069|0.198623|5.230954|6.486383|4.038965|6.603670|3.483648|0.095766|2.741800|3.431105|2.817651|3.569707|3.450878|3.235960|5.232153|0.095375|0.127458|3.966389|4.391555|2.145737|3.628993|1.931312|1.901989|1.679326|1.600013|2.335930|1.632812|25.214858|36.858105| |5.638320|6.518994|0.196506|4.381917|5.482461|3.363124|5.430546|3.013675|0.085882|2.430048|3.076608|2.510864|3.038259|2.852231|2.709728|4.333255|0.081212|0.100340|3.415402|3.722409|1.964859|3.358477|1.779721|1.741434|1.556711|1.497975|2.184193|1.544126|13.968965|13.700484|36.858105| |4.135578|4.431095|0.130786|3.329400|4.295007|2.763132|4.540133|2.567473|0.073089|2.129264|2.761141|2.265632|2.659215|2.528342|2.492218|4.041701|0.078270|0.092282|3.170173|3.251412|1.792548|3.107088|1.624066|1.580891|1.424505|1.380911|2.013270|1.437264|9.228044|7.900063|13.751368|36.858105| |3.518614|3.737462|0.104726|2.964961|3.887786|2.603474|4.362758|2.449552|0.068437|2.054998|2.705110|2.239883|2.621181|2.564925|2.617495|4.354073|0.086472|0.100781|3.304908|3.205809|1.759718|3.068966|1.587955|1.544827|1.390807|1.348227|1.967192|1.405739|8.169119|6.790944|7.907828|13.775064|36.858105| |3.639538|3.944885|0.105011|3.187783|4.197726|2.879353|4.900741|2.681116|0.073097|2.231959|2.935416|2.449181|2.939533|2.973641|3.083459|5.276784|0.104435|0.128628|3.801853|3.606069|1.885343|3.270430|1.691952|1.652580|1.475250|1.420405|2.074866|1.471109|9.356314|7.856082|6.882062|7.988540|13.766189|36.858105| |4.545182|5.216124|0.131372|4.075874|5.288614|3.581559|6.084296|3.204450|0.085961|2.587158|3.324940|2.769970|3.481807|3.547623|3.530681|5.991585|0.111932|0.154069|4.256569|4.291976|2.089775|3.569000|1.870626|1.838936|1.623776|1.548968|2.263937|1.586700|14.484067|13.664540|7.995102|6.942910|7.960087|13.792534|36.858105| |3.949529|4.471841|0.107420|3.966639|5.254221|3.868090|6.993551|3.417934|0.087027|2.805242|3.604891|2.986812|3.847169|4.352354|4.431472|7.352715|0.134782|0.210516|4.507013|4.424467|2.236884|3.782385|2.000960|1.989644|1.739164|1.639380|2.390203|1.653588|11.693422|6.987317|4.756368|4.235762|4.765914|7.048417|10.861627|448.794386| |17.573766|8.853789|0.173395|6.953054|6.336489|3.900270|7.056698|3.034191|0.081054|2.564196|3.038411|2.298059|2.797855|2.824152|2.506680|3.577049|0.066133|0.082761|2.580059|2.930898|1.932263|3.178103|1.828188|1.879248|1.686581|1.568635|2.219834|1.516210|12.577828|5.551270|4.723173|3.670685|3.296753|3.541125|4.458226|33.604755|0.500000| |17.567259|8.846588|0.212562|6.896321|6.318006|3.652005|6.243079|2.921716|0.081318|2.482125|2.931225|2.197898|2.609014|2.513403|2.222520|3.168548|0.058806|0.071208|2.376556|2.744500|1.886781|3.109180|1.797648|1.837048|1.664599|1.560535|2.205787|1.515810|10.065892|4.695513|4.569142|3.536111|3.011808|3.044842|3.633933|26.007102|0.300483|0.500000| |17.600251|8.780222|0.210248|5.502104|5.605030|3.356658|5.730413|2.775088|0.076931|2.324237|2.824007|2.179929|2.611890|2.547537|2.324400|3.433698|0.064240|0.078846|2.559438|2.869111|1.815169|3.033375|1.701290|1.716689|1.550493|1.465481|2.089440|1.450064|12.430049|6.642523|6.685618|4.892990|4.018989|4.009453|4.838343|31.417896|0.301508|0.302079|0.500000| |7.039029|8.926667|0.213935|17.560013|12.416124|6.109013|9.814863|4.320919|0.119599|3.551091|3.902777|2.834479|3.454056|3.203311|2.641520|3.622911|0.065269|0.079926|2.760273|3.424200|2.436027|3.890172|2.326170|2.402959|2.125281|1.960067|2.783296|1.870901|10.274336|4.235155|3.814088|2.986525|2.639533|2.764928|3.383179|26.151734|0.174584|0.210752|0.142560|0.500000| |6.916946|8.871162|0.174557|17.668637|12.669812|7.603648|14.367653|4.756841|0.119971|3.827855|4.194092|3.083786|3.969473|3.962460|3.180666|4.303380|0.076212|0.098059|3.120746|3.848497|2.550239|4.050575|2.403248|2.506527|2.175876|1.981499|2.822079|1.879342|13.019227|4.849725|3.917561|3.077544|2.834938|3.131151|4.031602|33.980316|0.208252|0.169582|0.141314|0.302126|0.500000| |4.557706|6.896017|0.205010|9.032901|26.074390|9.408586|10.875152|7.498291|0.243964|4.995250|5.419602|4.138872|5.347271|4.221228|3.335192|4.656473|0.080972|0.099698|3.863358|5.502040|3.204347|5.102443|2.880481|2.825831|2.409242|2.269437|3.363766|2.284371|10.678375|4.582194|4.102766|3.226459|2.865614|3.013198|3.692320|28.092689|0.113166|0.120314|0.108346|0.210589|0.179975|0.500000| |2.494895|2.996816|0.081969|3.706556|6.670202|6.293040|9.692588|8.734410|0.222848|17.624019|12.270155|5.954461|5.687404|4.600438|3.461230|4.145905|0.073735|0.081581|3.264431|4.167580|6.927013|8.844231|6.695050|6.634687|4.747612|4.222665|6.548302|3.887306|5.241095|2.533579|2.295255|2.013943|1.922127|2.054250|2.356188|20.004843|0.068104|0.067858|0.062203|0.098582|0.099856|0.135062|0.500000| |2.576979|3.068206|0.080435|3.823913|6.640951|7.211226|13.319416|8.846051|0.175712|17.635487|12.241320|6.148780|6.585760|6.361502|4.328481|4.797403|0.083954|0.094942|3.521316|4.383143|6.159814|8.063019|5.780259|6.421883|4.436896|3.741422|5.589731|3.318463|5.579968|2.662634|2.331433|2.046519|1.991638|2.184850|2.543145|22.804908|0.072496|0.068593|0.063961|0.097502|0.110220|0.122744|0.302106|0.500000| |2.279671|2.779101|0.078378|3.022597|5.297610|4.481450|6.737859|6.857488|0.203603|6.342439|12.327649|17.525183|8.751905|5.500466|4.783062|6.090784|0.107086|0.108112|5.726673|7.132541|7.037502|12.866098|4.649968|3.782552|3.043107|3.074098|5.180988|3.719190|5.306316|2.762999|2.525369|2.293193|2.244239|2.405968|2.680478|22.293708|0.061249|0.059855|0.059475|0.076266|0.079864|0.114902|0.150135|0.136113|0.500000| |2.138048|2.544335|0.069547|2.763792|4.635654|4.101996|6.704525|5.710565|0.143295|5.830017|12.427591|17.621581|8.604404|7.074151|6.730852|7.297782|0.128966|0.121698|5.964457|6.207149|7.138803|13.226718|4.685854|3.917349|3.099829|3.065342|5.090171|3.547556|4.983359|2.607901|2.329301|2.142998|2.157359|2.373014|2.635660|23.204076|0.058806|0.055636|0.055915|0.069144|0.076061|0.094690|0.129044|0.141213|0.304190|0.500000| |2.524827|2.994186|0.077198|3.431698|5.650663|5.707194|10.986823|6.674618|0.137474|6.838970|9.464684|7.080100|8.747320|17.603050|9.002182|7.634868|0.127154|0.144146|4.879051|5.505589|4.954303|7.537355|4.105158|4.096386|3.162925|2.856391|4.335874|2.788815|5.959206|2.940168|2.487130|2.223588|2.246916|2.563207|2.994580|29.086213|0.072113|0.064757|0.064274|0.083229|0.101401|0.104306|0.137476|0.217492|0.141078|0.192196|0.500000| |3.168964|3.889775|0.096370|4.412589|7.183434|7.248161|14.299129|6.844422|0.142263|5.451246|6.708884|5.496358|8.754165|17.613613|8.926726|9.402123|0.144637|0.206901|5.643596|6.722574|3.686437|5.840903|3.161512|3.171330|2.578394|2.357345|3.511848|2.323214|8.316995|3.929266|3.122780|2.712646|2.747344|3.248458|4.038582|42.283724|0.091517|0.078469|0.079858|0.100445|0.134206|0.125400|0.117914|0.162634|0.122766|0.141076|0.305729|0.500000| |2.187166|2.554373|0.067844|2.691356|4.268593|3.726385|6.541451|4.399116|0.106342|4.144403|6.711039|6.487982|6.629236|8.701054|17.636543|12.436982|0.224113|0.180906|6.985328|5.724910|4.085137|7.247766|3.245056|3.005858|2.485856|2.389718|3.701097|2.564177|5.255152|2.810408|2.429943|2.268663|2.374742|2.727033|3.023869|28.831797|0.061466|0.055711|0.057809|0.065969|0.076635|0.083717|0.093929|0.113536|0.143271|0.234941|0.212933|0.173114|0.500000| |2.374550|2.728465|0.070190|2.864373|4.356317|3.809876|7.153974|4.023776|0.094967|3.709595|5.350856|4.584662|5.445965|8.798993|17.627148|12.376162|0.223455|0.223716|5.592609|4.892293|3.261089|5.542049|2.780228|2.719436|2.282827|2.140684|3.198630|2.177207|5.761962|3.052934|2.549596|2.365868|2.517073|2.998749|3.404833|36.125417|0.068448|0.059587|0.062580|0.069187|0.084657|0.082246|0.085135|0.108063|0.105301|0.140761|0.212822|0.217974|0.301484|0.500000| |2.317579|2.784438|0.077149|2.796393|4.525908|3.638494|5.837206|4.423424|0.119576|3.737754|5.906087|6.447394|6.655342|5.724339|6.990552|12.428830|0.223536|0.180900|17.618488|8.735736|3.658738|6.814040|2.869971|2.573223|2.182079|2.162590|3.392748|2.458872|5.797706|3.251689|2.902008|2.745164|2.852108|3.185563|3.443161|29.134919|0.062880|0.058834|0.062385|0.068410|0.075602|0.094265|0.088992|0.094243|0.178943|0.197086|0.128659|0.131612|0.211142|0.143722|0.500000| |2.675225|3.256112|0.090713|3.078850|4.828718|3.644525|5.805704|4.038576|0.111283|3.235780|4.664612|4.545096|5.444784|4.879727|5.588596|12.379551|0.223599|0.223861|17.626045|8.776787|2.896516|5.208168|2.396503|2.218330|1.913583|1.877735|2.871632|2.067897|7.170647|4.300246|3.789014|3.626502|3.861154|4.419008|4.735717|37.144881|0.071719|0.066383|0.073444|0.073928|0.082188|0.100845|0.078953|0.083120|0.127528|0.125507|0.107595|0.127030|0.143705|0.126647|0.300943|0.500000| |3.658060|5.014909|0.135605|4.977537|8.820460|6.608680|9.381655|6.928360|0.183794|4.551585|5.842386|5.463123|8.817414|6.763531|5.677248|9.450423|0.145048|0.208431|8.919762|17.546477|3.336858|5.582296|2.784516|2.640844|2.219681|2.120945|3.222214|2.235350|11.608520|5.783366|4.584121|3.807348|3.694317|4.244597|5.428704|43.562792|0.096922|0.088973|0.094983|0.110568|0.128522|0.179255|0.107684|0.114817|0.144954|0.130701|0.138511|0.195387|0.131952|0.127836|0.173246|0.216716|0.500000| |2.914414|3.779095|0.109422|3.843269|6.888717|5.195991|7.326603|6.772085|0.214831|4.728302|6.670784|6.942277|8.779540|5.500431|4.883082|7.641154|0.127188|0.144357|8.992101|17.563553|3.875188|6.736040|3.081369|2.779361|2.335010|2.295394|3.594862|2.563756|7.650556|4.060735|3.657989|3.221224|3.094225|3.328424|3.823413|29.665173|0.076211|0.074215|0.076803|0.092385|0.097327|0.156919|0.114875|0.110600|0.220087|0.157218|0.123042|0.137850|0.128483|0.107713|0.213441|0.212482|0.303483|0.500000| |2.015825|2.287611|0.061083|2.720695|4.342861|3.972773|7.361332|4.546655|0.110238|7.049091|8.640911|4.334182|3.965952|3.935385|3.177252|3.597084|0.066181|0.070305|2.633720|3.017618|6.390447|8.227393|8.719032|17.814690|8.622476|5.856600|7.962128|4.104133|4.090496|2.031060|1.835998|1.654439|1.618774|1.746551|1.964634|17.328765|0.056762|0.054763|0.050967|0.072826|0.077894|0.084166|0.198837|0.237753|0.104022|0.110568|0.132771|0.100522|0.088747|0.082853|0.073518|0.064104|0.078547|0.079791|0.500000| |1.629858|1.790972|0.048538|2.065130|3.139980|2.635285|4.797299|2.867998|0.075202|3.710024|4.900099|2.830303|2.585824|2.538009|2.217826|2.638773|0.050034|0.051918|1.949559|2.155455|4.051600|6.066067|5.802166|8.565886|17.801503|8.742234|7.972330|4.144767|3.145522|1.599099|1.483942|1.359060|1.326954|1.406451|1.546321|13.316030|0.045693|0.045074|0.041752|0.057072|0.058406|0.062413|0.112886|0.109531|0.073284|0.074954|0.079849|0.066638|0.062773|0.059096|0.054989|0.049041|0.056890|0.058734|0.197394|0.500000| |1.457829|1.609721|0.044496|1.804336|2.768328|2.257222|3.939617|2.557078|0.070077|3.169339|4.586018|2.751882|2.384139|2.249115|2.034286|2.476983|0.047518|0.047995|1.881413|2.047185|4.193642|6.877300|5.917782|5.824097|8.623540|17.798788|12.331616|7.027168|2.843317|1.474870|1.391331|1.290063|1.259474|1.319747|1.428936|12.060848|0.040281|0.040275|0.037869|0.049737|0.049870|0.056744|0.096469|0.086038|0.074699|0.073986|0.068478|0.057846|0.059124|0.053315|0.054366|0.047666|0.052993|0.057346|0.123624|0.197078|0.500000| |1.491394|1.678088|0.046807|1.836170|2.885675|2.361487|4.002986|2.848155|0.079290|3.415797|5.768338|3.664093|2.866477|2.614684|2.455209|2.993530|0.057860|0.056103|2.339052|2.476250|6.078732|13.013465|6.479301|4.655117|4.551349|6.094996|12.357823|17.664358|3.046387|1.607841|1.517192|1.421414|1.401116|1.471116|1.578478|13.278850|0.040887|0.040527|0.039173|0.049342|0.050206|0.060178|0.097097|0.087392|0.103373|0.103554|0.078133|0.064337|0.074894|0.062467|0.070778|0.058459|0.061407|0.070485|0.105374|0.102483|0.156917|0.500000| |1.606225|1.825697|0.051548|2.010787|3.210397|2.591251|4.271640|3.183903|0.092364|3.808629|6.229381|3.901281|3.060676|2.657791|2.424057|3.019471|0.057561|0.057095|2.426578|2.662674|6.412060|12.662208|6.720699|4.701316|4.495442|5.920954|12.372110|17.649038|3.268146|1.714227|1.629861|1.514309|1.472812|1.533638|1.654509|13.685497|0.043581|0.043923|0.042029|0.054478|0.054079|0.068308|0.114329|0.092924|0.115934|0.103058|0.077753|0.066006|0.072297|0.060846|0.072512|0.060955|0.066097|0.077992|0.106486|0.100917|0.150121|0.301799|0.500000| |1.441754|1.608985|0.045077|1.770549|2.754047|2.215891|3.756839|2.599885|0.073470|3.109714|4.822316|3.022623|2.497992|2.274754|2.100018|2.601515|0.050154|0.049677|2.031357|2.188704|4.676068|8.662471|5.650608|4.485409|4.924900|7.505714|12.585593|17.632611|2.867910|1.507307|1.434446|1.339832|1.308565|1.362636|1.462827|12.182232|0.039422|0.039618|0.037778|0.048380|0.048198|0.057668|0.093011|0.080120|0.085945|0.082040|0.067533|0.057459|0.062270|0.054006|0.060044|0.051545|0.055498|0.062774|0.099819|0.112439|0.227325|0.299602|0.300855|0.500000| |6.198669|7.165262|0.250823|4.657958|5.709321|3.367986|5.359700|2.999447|0.087231|2.427480|3.037425|2.440858|2.914895|2.681920|2.496578|3.879205|0.072484|0.087758|3.099876|3.485120|1.949645|3.318755|1.780068|1.744381|1.566148|1.508464|2.193387|1.550688|12.510955|8.895511|17.773619|8.969421|5.652578|4.961441|5.663184|31.424754|0.133947|0.145762|0.204742|0.116682|0.110737|0.122111|0.064736|0.064289|0.068822|0.062219|0.065879|0.080934|0.062875|0.065002|0.074622|0.093340|0.116937|0.097805|0.050926|0.041524|0.038989|0.042034|0.045641|0.040147|0.500000| |3.691298|3.849096|0.117091|2.976013|3.853046|2.478936|4.068711|2.331242|0.067148|1.963371|2.555890|2.079610|2.386070|2.248665|2.214345|3.526343|0.068885|0.078659|2.792930|2.867704|1.679644|2.924526|1.530986|1.487591|1.350787|1.316051|1.914554|1.374812|7.454895|5.642643|8.964715|17.730009|8.925575|5.666368|4.989282|27.446887|0.090332|0.091315|0.121313|0.076263|0.075945|0.081583|0.052173|0.052246|0.059050|0.054701|0.055675|0.066162|0.056833|0.058409|0.068802|0.087955|0.090643|0.080682|0.042973|0.035850|0.034318|0.037709|0.040314|0.035769|0.218067|0.500000| 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