Version2.1 2021-01-10T17:13:28Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 20-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1cc2=[NH+]CC(=c2cc1F)CCNC(=O)CNC(=O)N3CC[C@@H]4[C@@H](C3)N=C5[C@@H]4C=CC=C5 C63271448 RHF 6-31G(d) (6D,7F) c1cc2=[NH+]CC(=c2cc1F)CCNC(=O)CNC(=O)N3CC[C@@H]4[C@@H](C3)N=C5[C@@H]4C=CC=C5 C01[X(C24H27F1N5O2)] 171 C1 534 O=C(CNC(=O)N1CC[C@@H]2[C@@H](C1)N=C1[C@@H]2C=CC=C1)NCCC1=c2cc(F)ccc2=[NH+]C1 O=C(CNC(=O)N1CC[C@@H]2[C@@H](C1)N=C1[C@@H]2C=CC=C1)NCCC1=c2cc(F)ccc2=[NH+]C1 FC1=CC2=C(CCNC(=O)CNC(=O)N3CC[C@@H]4[C@@H](C3)N=C5C=CC=C[C@H]45)C[NH+]=C2C=C1 InChIKey=JKYUVZARTRCNNS-KGVIQGDOSA-O InChI=1S/C24H26FN5O2/c25-16-5-6-20-19(11-16)15(12-27-20)7-9-26-23(31)13-28-24(32)30-10-8-18-17-3-1-2-4-21(17)29-22(18)14-30/h1-6,11,17-18,22H,7-10,12-14H2,(H,26,31)(H,28,32)/p+1/t17-,18+,22-/m1/s1 InChI=1/C24H26FN5O2/c25-16-5-6-20-19(11-16)15(12-27-20)7-9-26-23(31)13-28-24(32)30-10-8-18-17-3-1-2-4-21(17)29-22(18)14-30/h1-6,11,17-18,22H,7-10,12-14H2,(H,26,31)(H,28,32)/p+1/t17-,18+,22-/m1/s1/fC24H27FN5O2/h26-28H/q+1 c1cc2=[NH+]CC(=c2cc1F)CCNC(=O)CNC(=O)N3CC[C@@H]4[C@@H](C3)N=C5[C@@H]4C=CC=C5 C01[X(C24H27F1N5O2)] 171 C01 534 O=C(CNC(=O)N1CC[C@@H]2[C@@H](C1)N=C1[C@@H]2C=CC=C1)NCCC1=c2cc(F)ccc2=[NH+]C1 O=C(CNC(=O)N1CC[C@@H]2[C@@H](C1)N=C1[C@@H]2C=CC=C1)NCCC1=[C]2[C]([NH]C1)[CH]=[CH][C](=C2)F FC1=CC2=C(CCNC(=O)CNC(=O)N3CC[C@@H]4[C@@H](C3)N=C5C=CC=C[C@H]45)CN[C]2C=C1 InChIKey=GMWNTPQPBYJVQN-KGVIQGDOSA-N InChI=1S/C24H27FN5O2/c25-16-5-6-20-19(11-16)15(12-27-20)7-9-26-23(31)13-28-24(32)30-10-8-18-17-3-1-2-4-21(17)29-22(18)14-30/h1-6,11,17-18,22,27H,7-10,12-14H2,(H,26,31)(H,28,32)/t17-,18+,22-/m1/s1 InChI=1/C24H27FN5O2/c25-16-5-6-20-19(11-16)15(12-27-20)7-9-26-23(31)13-28-24(32)30-10-8-18-17-3-1-2-4-21(17)29-22(18)14-30/h1-6,11,17-18,22,27H,7-10,12-14H2,(H,26,31)(H,28,32)/t17-,18+,22-/m1/s1/f/h26,28H 2942.1184609517 -1445.7461127 1-A 28482.3580 115 419 534 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -26.44505 -20.64822 -20.57209 -15.78181 -15.70688 -15.65032 -15.64410 -15.60369 -11.49164 -11.47472 -11.46495 -11.45201 -11.43314 -11.43239 -11.42891 -11.41039 -11.40487 -11.40402 -11.40056 -11.38264 -11.35974 -11.33009 -11.32518 -11.31261 -11.30673 -11.29525 -11.29302 -11.29119 -11.28566 -11.28523 -11.28459 -11.28257 -1.76645 -1.51542 -1.48658 -1.46286 -1.35986 -1.32852 -1.31473 -1.31192 -1.29137 -1.27227 -1.19101 -1.17875 -1.17443 -1.14991 -1.14368 -1.09191 -1.08383 -1.06997 -1.03742 -1.03538 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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 6 6 6 7 1 6 6 6 6 6 9 6 6 7 6 8 6 7 6 8 7 6 6 6 1 6 1 6 7 6 6 1 6 6 6 6 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 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 18.99840 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 14.00307 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 1.00783 12.00000 1.00783 12.00000 14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 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 6487.0540 47436.3832 52760.4226 1.00000 -0.00144 -0.00032 0.00144 1.00000 -0.00126 0.00032 0.00126 1.00000 1 0.01335 0.00183 0.00164 0.27821 0.03805 0.03421 11.79 14.47 24.20 29.00 47.30 80.51 97.81 122.63 137.83 146.84 163.58 180.52 212.23 225.28 248.23 260.74 293.44 326.66 332.65 355.96 379.09 421.35 458.68 480.16 505.94 530.96 538.78 542.61 584.26 617.72 651.74 657.95 665.61 681.75 701.92 709.07 754.13 771.53 775.60 809.60 815.89 819.61 883.19 890.40 909.41 944.12 965.59 974.35 1012.85 1018.38 1097.16 1122.26 1125.70 1148.41 1163.41 1164.08 1235.16 1238.05 1244.65 1262.28 1287.35 1314.18 1336.58 1338.33 1407.51 1408.33 1426.73 1443.71 1454.95 1464.40 1479.89 1519.06 1543.10 1554.56 1574.56 1579.21 1594.36 1601.75 1612.87 1615.97 1626.89 1655.21 1663.09 1677.40 1703.66 1735.63 1767.78 1787.53 1799.03 1815.94 1824.10 1834.81 1843.50 1864.94 1874.00 1876.01 1889.01 1897.79 1926.12 1944.59 1950.86 1977.80 1985.90 2003.48 2028.37 2036.36 2052.61 2066.58 2078.00 2082.01 2097.58 2113.72 2121.68 2133.09 2174.88 2193.93 2199.18 2208.50 2232.53 2238.47 2240.09 2246.20 2249.50 2267.18 2273.76 2282.77 2295.24 2343.04 2361.57 2364.87 2369.08 2377.28 2389.43 2392.59 2437.16 2478.28 2519.20 2560.90 2577.74 2651.10 2703.70 2732.74 2742.63 2762.70 4541.22 4569.54 4574.19 4580.40 4597.81 4603.84 4625.24 4680.34 4684.26 4684.74 4691.32 4736.26 4753.32 4764.48 4775.59 4781.25 4832.93 4846.93 4849.61 4870.97 4894.99 4895.66 4915.37 4924.84 5565.05 5584.33 5615.13 0.527565 0.553900 0.554844 0.465355 -1445.218548 -1445.192212 -1445.191268 -1445.280758 3.001509D-04 MUNgauss RevisionA2.0 retrievium 10-Jan-2021 DUDE c1cc2=[NH+]CC(=c2cc1F)CCNC(=O)CNC(=O)N3CC[C@@H]4[C@@H](C3)N=C5[C@@H]4C=CC=C5 C63271448 RHF 6-31G(d) (6D,10F) C1 436.214879 |X|Y|Z| 157.036523 57.744720 22.071473 58.494463 29 6 7 24 5 |36.858105| |14.124572|36.858105| |8.063595|13.370795|36.858105| |5.264169|7.717680|14.550012|53.358707| |4.650180|6.819110|9.287819|26.004200|0.500000| |4.149756|5.189188|8.376452|17.891807|0.243804|36.858105| |4.639165|5.278381|8.424057|11.257676|0.161768|12.714127|36.858105| |6.862273|7.633480|13.207563|11.499124|0.164446|8.209888|14.034711|36.858105| |7.805763|6.585016|7.631125|7.201936|0.117560|5.077849|7.427336|13.192577|36.858105| |13.184926|7.778339|6.885149|6.387535|0.110458|4.127153|5.167110|8.041029|14.295615|36.858105| |8.151017|5.303837|4.669462|4.823046|0.086908|3.230985|3.923090|5.287343|8.235261|14.458504|97.533100| |3.583514|3.794518|5.104272|6.918258|0.113193|7.248522|12.725344|7.400041|5.821250|4.161015|7.741043|36.858105| |3.079204|3.243006|4.136104|5.755313|0.098960|5.710073|7.490548|5.346191|4.536789|3.491091|6.745099|12.223068|36.858105| |2.526967|2.673180|3.294403|4.756834|0.085446|4.643523|5.235291|3.940620|3.427818|2.784774|5.534307|7.612483|13.197535|53.358707| |2.384358|2.586316|3.195612|4.854716|0.089335|4.850526|4.819548|3.614005|3.047995|2.542736|5.026958|6.095205|7.858694|19.234204|36.858105| |2.585031|2.889987|3.676013|5.913343|0.108823|6.351915|5.570847|4.020345|3.221831|2.695340|5.220148|6.257904|7.020716|11.643932|15.749596|73.516695| |2.006921|2.152250|2.560891|3.841872|0.072921|3.572961|3.509127|2.817944|2.470368|2.122854|4.294388|4.225583|5.035040|10.670338|12.591822|14.142998|36.858105| |1.892227|2.056182|2.422354|3.716743|0.072479|3.375938|3.126609|2.565641|2.231449|1.957362|3.956547|3.494468|3.966499|7.173730|7.919879|12.537111|13.272397|53.358707| |1.665989|1.793311|2.065823|3.121317|0.061608|2.727798|2.560277|2.169427|1.928845|1.718237|3.520754|2.828074|3.135471|5.412336|5.165221|8.330535|7.944785|18.832333|36.858105| |1.578164|1.677632|1.916498|2.842128|0.055733|2.460490|2.379124|2.036916|1.843178|1.642813|3.399083|2.679073|2.980408|5.189262|4.620316|7.101057|7.232276|11.612447|15.787453|73.516695| |1.572632|1.702185|1.939094|2.949916|0.059285|2.516312|2.311178|1.992924|1.771834|1.600292|3.283815|2.467237|2.672931|4.363665|4.023093|6.993771|5.241629|11.102476|13.990013|14.962063|53.358707| |1.408359|1.511117|1.695759|2.543547|0.051295|2.124083|1.980711|1.740109|1.571552|1.432933|2.970353|2.109850|2.252357|3.600722|3.149017|5.429675|3.966593|7.074691|7.878079|12.410338|17.633229|36.858105| |1.314228|1.409436|1.563496|2.338069|0.047601|1.913994|1.778939|1.586747|1.440661|1.327454|2.762695|1.863124|1.991518|3.100196|2.644063|4.632013|3.154930|5.396460|5.203975|8.420571|10.319331|12.398191|36.858105| |1.354988|1.466628|1.625510|2.458701|0.050666|1.996130|1.817933|1.625597|1.463249|1.354505|2.804488|1.866724|1.976278|3.020552|2.597917|4.709741|2.974569|5.165612|4.556574|6.925712|9.143707|7.748744|12.536210|36.858105| |1.362406|1.477898|1.638877|2.487009|0.051381|2.018100|1.828841|1.634412|1.467863|1.359319|2.810899|1.872070|1.949869|2.969041|2.562414|4.697061|2.911829|5.021090|4.361472|6.629469|8.571328|7.344467|9.026164|17.490134|0.500000| |1.498049|1.635917|1.832305|2.809007|0.057989|2.304258|2.063543|1.825810|1.622402|1.493842|3.066762|2.105772|2.258955|3.463312|3.053006|5.641140|3.455079|6.330897|5.280097|7.426728|10.815377|6.667420|7.696750|12.514418|0.250851|36.858105| |1.489570|1.618709|1.810917|2.754719|0.056517|2.261441|2.049642|1.816127|1.621906|1.491806|3.070452|2.106224|2.306966|3.555495|3.101164|5.606927|3.537985|6.395586|5.342147|7.681178|10.063952|6.143722|7.258947|8.864700|0.175966|17.501044|0.500000| |1.639370|1.798944|2.051708|3.182518|0.065050|2.690892|2.386856|2.063775|1.810049|1.644780|3.349680|2.465647|2.635946|4.148560|3.847807|7.196321|4.495886|9.248779|7.638005|9.385175|17.706859|7.567918|6.368061|7.619607|0.203549|12.559372|0.253018|36.858105| |1.498462|1.647946|1.829544|2.821653|0.059243|2.262825|1.996157|1.789483|1.586419|1.475550|3.024612|1.988436|2.108239|3.135591|2.713849|5.154163|2.910949|5.046948|3.883747|5.702450|6.890911|4.473305|5.130441|7.978720|0.191595|13.053618|0.258375|7.461892|53.358707| |1.366609|1.491811|1.636166|2.491151|0.052318|1.971209|1.763896|1.600840|1.435953|1.345256|2.778796|1.759771|1.855289|2.741119|2.320261|4.338979|2.495684|4.173340|3.290288|5.043099|5.714766|4.083578|5.086633|8.165572|0.192270|8.714937|0.197491|5.397096|20.572992|36.858105| |1.275405|1.379455|1.510700|2.274918|0.047292|1.810791|1.648609|1.495740|1.353847|1.265870|2.630895|1.670142|1.761391|2.633936|2.215586|4.048932|2.450551|4.071034|3.383374|5.328998|6.022675|4.818193|6.987934|12.387842|0.252301|7.993699|0.187242|5.105445|10.917330|12.535822|36.858105| |1.225919|1.324449|1.443508|2.168545|0.045200|1.714782|1.562953|1.425271|1.293845|1.214238|2.529076|1.578478|1.645031|2.443927|2.042206|3.744000|2.241532|3.658009|3.014722|4.822304|5.225749|4.281960|5.793926|8.827909|0.238877|5.914550|0.137946|4.346209|8.399022|8.937786|17.471079|0.500000| |1.193351|1.281774|1.393261|2.075667|0.043024|1.640436|1.512375|1.383523|1.264051|1.186764|2.481583|1.535909|1.632836|2.429344|2.004555|3.614066|2.208913|3.562462|2.943193|4.801040|4.945033|3.979249|5.722442|7.071919|0.152545|5.566374|0.155019|3.910523|7.578860|7.719926|12.614717|0.253352|36.858105| |1.165641|1.252439|1.351752|2.009725|0.041885|1.569830|1.445035|1.333037|1.220609|1.153136|2.414795|1.453801|1.543088|2.264518|1.849881|3.358534|1.995981|3.164583|2.532138|4.141989|4.104406|3.162393|4.131650|4.989501|0.116717|4.484461|0.126693|3.308249|6.767991|6.922106|7.810733|0.185770|14.349177|36.858105| |1.208683|1.307078|1.407242|2.105429|0.044295|1.629898|1.483025|1.372774|1.250652|1.186163|2.475266|1.473034|1.552821|2.253412|1.845135|3.405983|1.952296|3.096400|2.409953|3.882051|3.879731|2.874918|3.540776|4.488838|0.110738|4.365307|0.118504|3.273595|7.482543|8.026249|6.744410|0.170747|7.767735|12.872393|36.858105| |1.303019|1.420518|1.538867|2.328657|0.049271|1.807817|1.621909|1.492664|1.347035|1.274084|2.641737|1.601078|1.680439|2.439120|2.024313|3.793033|2.129726|3.437344|2.644190|4.160901|4.332923|3.116249|3.744844|5.106654|0.128943|5.289771|0.134964|3.868876|10.656877|12.954433|7.498101|0.186459|6.587168|7.747925|14.306187|36.858105| |17.729738|9.028399|5.674816|5.699238|0.108158|3.390685|3.677032|4.950529|5.651709|8.838802|17.089377|2.988414|2.637618|3.018209|2.103555|4.018610|1.803841|2.331096|1.525022|2.577646|1.971841|1.307758|1.228030|1.266610|0.035369|1.392025|0.038460|1.509544|1.903078|1.283790|1.199821|0.032124|1.127338|1.105289|1.147127|1.231922|0.500000| |8.979125|17.755850|8.724422|9.235179|0.192828|4.537604|4.285894|5.485392|4.803668|5.550283|9.614056|3.222864|2.835234|3.277425|2.374807|4.739799|2.009702|2.657747|1.716953|2.844626|2.244571|1.469584|1.380981|1.447861|0.040586|1.613447|0.044198|1.759254|2.236989|1.492331|1.372210|0.036696|1.274762|1.251836|1.314953|1.431620|0.214716|0.500000| |3.592706|4.371858|6.300120|12.295781|0.205257|17.601224|8.839990|6.198970|4.279360|3.571476|6.498955|6.461856|6.086750|6.944591|5.584802|13.985532|3.980452|5.213438|3.011307|4.743840|3.773681|2.292598|2.069352|2.168405|0.060306|2.558714|0.070329|3.004992|3.418639|2.155344|1.959978|0.051029|1.773109|1.695975|1.762999|1.964812|0.083857|0.110163|0.500000| |3.602330|4.382468|6.324008|12.331333|0.204789|17.564677|8.884154|6.229941|4.297368|3.583303|6.517568|6.479499|4.985877|6.032059|4.886028|11.671668|3.700321|4.831113|2.869920|4.568306|3.617023|2.240578|1.995608|2.087703|0.059388|2.396766|0.064314|2.852286|3.187156|2.035588|1.876959|0.049650|1.681107|1.598351|1.659367|1.851102|0.084042|0.110329|0.303189|0.500000| |5.575093|4.804505|5.474233|5.812695|0.097789|4.400412|6.501488|8.630554|17.764319|9.083394|16.592391|6.096079|4.785742|4.895439|3.088958|5.613092|2.519959|3.038605|1.937404|3.329749|2.398348|1.568887|1.432079|1.440992|0.040086|1.589597|0.044304|1.775606|2.096138|1.397703|1.328155|0.035237|1.243954|1.197182|1.218718|1.306924|0.124541|0.105041|0.106668|0.107107|0.500000| |3.156804|3.386181|4.445802|6.366083|0.107756|6.807471|9.060735|5.773137|4.640166|3.540497|6.738738|17.616866|8.797645|10.393295|6.843143|12.602522|4.751089|5.273543|3.103130|5.205037|3.646292|2.279581|1.979571|1.978799|0.055617|2.224126|0.061130|2.658128|2.829491|1.834015|1.749823|0.046062|1.593950|1.497480|1.514237|1.652822|0.074570|0.082123|0.168426|0.196215|0.132951|0.500000| |3.640320|3.659790|4.660000|5.893223|0.098439|5.454642|8.988050|6.988942|6.506195|4.479065|8.545347|17.605466|8.726838|8.245491|4.771196|8.315248|3.617807|4.091715|2.517379|4.328932|3.007229|1.927713|1.712075|1.704081|0.047498|1.894271|0.052712|2.185434|2.438313|1.604335|1.534425|0.040475|1.421376|1.348307|1.361759|1.469345|0.084795|0.085511|0.134129|0.139391|0.214390|0.303761|0.500000| |3.003340|3.050446|3.726364|4.948323|0.086367|4.512790|5.965756|4.850910|4.529978|3.505689|6.974001|8.779096|17.637160|12.657355|5.801276|9.027126|4.264614|4.625723|2.799589|4.849924|3.270792|2.067032|1.845736|1.816800|0.049601|2.050080|0.058563|2.344069|2.609375|1.707801|1.632837|0.042446|1.530699|1.451685|1.454313|1.559164|0.072239|0.073906|0.129858|0.110619|0.140334|0.181359|0.230302|0.500000| |3.214419|3.469538|4.478213|6.395842|0.110096|6.312806|7.488825|5.498153|4.472076|3.533971|6.726347|8.711786|17.597195|12.528702|7.134879|12.743072|4.665645|5.341861|3.084378|5.100408|3.653321|2.241893|2.010480|2.021439|0.055065|2.346985|0.066956|2.712928|3.021311|1.939452|1.815900|0.046878|1.685117|1.602969|1.624601|1.764710|0.076233|0.084755|0.206881|0.142755|0.124152|0.185352|0.179550|0.304184|0.500000| |2.301102|2.391688|2.861398|4.048477|0.073839|3.751823|4.234133|3.390258|3.083066|2.549811|5.184114|5.883044|9.014251|26.060339|9.369235|10.888059|7.442197|6.654809|3.899937|6.970839|4.224342|2.612838|2.250332|2.152537|0.058422|2.431934|0.070066|2.866847|2.969921|1.928997|1.877846|0.048383|1.749940|1.627246|1.603634|1.719002|0.056818|0.060209|0.112331|0.100347|0.091603|0.163033|0.145173|0.234220|0.189425|0.500000| |1.947233|2.071431|2.449322|3.631044|0.068784|3.344742|3.354529|2.716177|2.412588|2.072840|4.220932|4.118823|4.575604|9.226792|8.999746|11.442253|17.501186|12.292499|7.014288|12.679059|6.518875|3.854461|3.009517|2.801657|0.077702|3.127964|0.087097|4.025417|3.607506|2.314639|2.309168|0.059565|2.079101|1.873861|1.827662|1.984869|0.048738|0.053638|0.099262|0.098589|0.069014|0.134080|0.100757|0.110331|0.113039|0.186948|0.500000| |1.904186|2.017674|2.364665|3.479259|0.066174|3.144151|3.165985|2.610854|2.341081|2.025117|4.143717|3.809822|4.756780|9.950987|8.878052|10.609327|17.618200|12.524738|7.101945|13.085131|6.521492|3.787316|3.087734|2.842680|0.075759|3.261470|0.095849|4.014960|3.736536|2.388790|2.369705|0.059874|2.183799|1.976565|1.911438|2.055448|0.047837|0.052355|0.097086|0.088010|0.066985|0.113475|0.093441|0.118305|0.123155|0.223789|0.304184|0.500000| |1.992766|2.197403|2.615114|4.115251|0.080918|3.788890|3.353946|2.724165|2.322146|2.038835|4.080338|3.626547|3.970546|6.795428|7.681063|14.707790|9.240531|26.105548|9.234917|10.960307|10.095395|4.795228|3.781974|3.837776|0.106139|4.852588|0.129929|7.546400|5.448254|3.224662|3.052019|0.076668|2.615165|2.343313|2.339885|2.649157|0.049908|0.058223|0.121100|0.113213|0.063655|0.112866|0.085137|0.092483|0.111452|0.122566|0.199850|0.182792|0.500000| |1.392807|1.495773|1.675698|2.516104|0.050876|2.093873|1.946582|1.714040|1.547777|1.414102|2.931734|2.064227|2.157142|3.411823|2.972897|5.205618|3.653113|6.306146|6.396963|10.279589|12.396486|17.497313|8.875759|6.922789|0.217310|5.683439|0.136753|6.658925|5.638573|3.847540|4.522237|0.118633|3.640264|2.940869|2.726132|2.980867|0.035962|0.040485|0.061987|0.062150|0.042856|0.062533|0.052571|0.054897|0.059270|0.068292|0.102113|0.094431|0.124075|0.500000| |1.375631|1.464661|1.640972|2.435623|0.048741|2.037373|1.934283|1.701574|1.550212|1.410264|2.937834|2.091149|2.249830|3.638907|3.122967|5.220478|4.046339|6.792392|7.790807|15.087945|12.558892|17.712996|8.785018|5.589338|0.146054|5.034743|0.138983|5.615956|4.963385|3.388733|3.943826|0.099001|3.488949|2.834803|2.553869|2.703510|0.035505|0.039380|0.060770|0.059349|0.043318|0.062671|0.053507|0.057938|0.061521|0.074838|0.111509|0.111105|0.121629|0.302642|0.500000| |1.231438|1.314561|1.448448|2.151030|0.043809|1.746806|1.635526|1.470172|1.344632|1.244275|2.602637|1.712506|1.813457|2.799053|2.346396|4.101044|2.766297|4.536503|4.243266|7.249903|7.582673|8.897095|17.539718|8.744243|0.212195|5.531100|0.144678|4.808649|5.710533|4.382883|6.225493|0.158869|5.443475|3.946545|3.323188|3.413207|0.032086|0.035825|0.051895|0.050659|0.037201|0.050528|0.044103|0.047041|0.050552|0.056754|0.074927|0.075527|0.088655|0.220955|0.209612|0.500000| |1.301597|1.391364|1.540549|2.292253|0.046546|1.873442|1.753525|1.568133|1.429451|1.317610|2.748380|1.841687|1.998059|3.113339|2.625503|4.542533|3.133833|5.270624|5.008826|8.345071|9.080201|8.790987|17.542283|8.808177|0.174691|6.973214|0.218062|5.588402|6.565907|4.784716|6.249611|0.138645|5.924149|4.306108|3.565533|3.651201|0.033812|0.037815|0.056592|0.053624|0.039557|0.053826|0.047090|0.051788|0.056289|0.063335|0.081604|0.087708|0.100277|0.173837|0.215452|0.301707|0.500000| |1.783795|1.973501|2.278455|3.583249|0.073138|3.076905|2.679281|2.287218|1.978682|1.787132|3.609064|2.747770|2.983537|4.695733|4.493802|8.708349|5.033241|10.764186|7.248262|8.867916|12.369565|5.574770|4.852816|5.556206|0.146423|8.952883|0.221956|17.664554|9.215473|4.780033|4.248769|0.101505|3.446505|3.040767|3.076120|3.635419|0.045338|0.053472|0.098286|0.089744|0.053645|0.081750|0.066520|0.072524|0.086966|0.088236|0.118711|0.122609|0.269900|0.137852|0.127666|0.106936|0.127507|0.500000| |1.644915|1.812641|2.065590|3.224155|0.066365|2.712540|2.379283|2.061780|1.802343|1.642291|3.339026|2.432700|2.525129|3.912396|3.603774|6.919242|4.077121|7.840633|6.180841|8.134342|12.245044|6.590427|5.509667|6.845512|0.217406|8.819591|0.175437|17.492538|9.119664|5.098559|4.811950|0.121220|3.595944|3.083738|3.119417|3.741127|0.042098|0.049434|0.082643|0.081669|0.048915|0.073738|0.060024|0.062211|0.071634|0.074492|0.105874|0.098884|0.188049|0.188015|0.137785|0.124341|0.128425|0.300718|0.500000| |1.152352|1.231058|1.337441|1.979929|0.040798|1.569679|1.461914|1.337504|1.228651|1.151972|2.417508|1.497481|1.597141|2.390049|1.958966|3.484127|2.185434|3.485479|2.935783|4.911971|4.860100|4.084860|6.079526|6.327676|0.138237|4.861451|0.140214|3.624265|6.112981|5.548162|8.467723|0.193459|17.709172|9.075910|5.536151|4.803497|0.030254|0.033885|0.046966|0.044642|0.033748|0.043186|0.038667|0.041814|0.045497|0.048248|0.057497|0.060681|0.069817|0.102358|0.102628|0.170996|0.185120|0.088613|0.092011|0.500000| |1.108128|1.184952|1.272622|1.878927|0.039076|1.461562|1.355993|1.257519|1.158638|1.097708|2.308490|1.366289|1.452900|2.124145|1.715901|3.094467|1.846039|2.877599|2.293648|3.815561|3.624662|2.801530|3.570880|4.017247|0.096112|3.671104|0.106289|2.843885|5.358642|5.001673|5.545917|0.139378|9.104564|17.716528|8.675771|5.623026|0.029273|0.032891|0.043723|0.041144|0.031631|0.038925|0.035377|0.038224|0.041877|0.042632|0.048276|0.051237|0.058710|0.072370|0.071560|0.096851|0.105745|0.073712|0.073678|0.217148|0.500000| |1.165410|1.257873|1.344498|2.002043|0.042231|1.535171|1.400934|1.306811|1.195645|1.140168|2.386057|1.384931|1.456110|2.094014|1.697485|3.134761|1.777157|2.773479|2.132959|3.469980|3.354179|2.474268|2.958011|3.581672|0.090818|3.534093|0.097121|2.789928|5.896554|5.647391|4.903456|0.130413|5.625587|8.671118|17.711674|9.106137|0.030847|0.035276|0.045942|0.043227|0.032324|0.039356|0.035708|0.038056|0.042380|0.041431|0.046344|0.048476|0.058199|0.065648|0.062093|0.078255|0.083191|0.074172|0.074497|0.123532|0.213092|0.500000| 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