Version2.0 2020-07-17T03:34:39Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 31-May-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COCCN(CCN2CCN(c1ccc(F)cc1F)CC2)c5cc4nc(c3ccco3)nn4c(N)n5 475369 CHEMBL514939 RHF 6-31G(d) (6D,7F) COCCN(CCN2CCN(c1ccc(F)cc1F)CC2)c5cc4nc(c3ccco3)nn4c(N)n5 C01[X(C24H28F2N8O2)] 186 C1 596 COCCN(c1nc(N)n2c(c1)nc(n2)c1ccco1)CCN1CCN(CC1)c1ccc(cc1F)F COCCN(c1nc(N)n2c(c1)nc(n2)c1ccco1)CCN1CCN(CC1)c1ccc(cc1F)F COCCN(CCN1CCN(CC1)c2ccc(F)cc2F)c3cc4nc(nn4c(N)n3)c5occc5 InChIKey=IBTJXZMYRPSUKB-UHFFFAOYSA-N InChI=1S/C24H28F2N8O2/c1-35-14-12-33(11-8-31-6-9-32(10-7-31)19-5-4-17(25)15-18(19)26)21-16-22-28-23(20-3-2-13-36-20)30-34(22)24(27)29-21/h2-5,13,15-16H,6-12,14H2,1H3,(H2,27,29) InChI=1/C24H28F2N8O2/c1-35-14-12-33(11-8-31-6-9-32(10-7-31)19-5-4-17(25)15-18(19)26)21-16-22-28-23(20-3-2-13-36-20)30-34(22)24(27)29-21/h2-5,13,15-16H,6-12,14H2,1H3,(H2,27,29)/f/h27H2 COCCN(CCN2CCN(c1ccc(F)cc1F)CC2)c5cc4nc(c3ccco3)nn4c(N)n5 C01[X(C24H28F2N8O2)] 186 C01 596 COCCN(c1nc(N)n2c(c1)nc(n2)c1ccco1)CCN1CCN(CC1)c1ccc(cc1F)F COCCN([C]1[N][C]([NH2])[N@]2[C]([CH]1)[N][C]([N]2)C1=[CH][CH]=CO1)CCN1CC[N@](CC1)[C]1[CH][CH][C]([CH][C]1F)F COCCN(CCN1CCN(CC1)[C]2[CH][CH][C](F)[CH][C]2F)[C]3[CH][C]4[N][C]([N]N4[C](N)[N]3)c5occc5 InChIKey=IBTJXZMYRPSUKB-UHFFFAOYSA-N InChI=1S/C24H28F2N8O2/c1-35-14-12-33(11-8-31-6-9-32(10-7-31)19-5-4-17(25)15-18(19)26)21-16-22-28-23(20-3-2-13-36-20)30-34(22)24(27)29-21/h2-5,13,15-16H,6-12,14H2,1H3,(H2,27,29) InChI=1/C24H28F2N8O2/c1-35-14-12-33(11-8-31-6-9-32(10-7-31)19-5-4-17(25)15-18(19)26)21-16-22-28-23(20-3-2-13-36-20)30-34(22)24(27)29-21/h2-5,13,15-16H,6-12,14H2,1H3,(H2,27,29)/f/h27H2 3636.2972713361 -1709.2645702 1-A 35272.0686 131 465 596 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -26.31779 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3266.6523 3295.8780 3302.0398 3306.3336 3313.7353 3345.0302 3394.8999 3410.5420 3417.0623 3441.3529 3466.0492 3481.2444 3481.7516 3837.6650 3971.0505 6.1361 6.6938 5.4956 5.7257 4.7110 4.4757 4.6416 6.7508 3.3676 5.9368 4.6245 2.7287 3.7204 4.3843 4.5701 5.3122 4.8112 5.7920 5.5833 4.1873 2.1047 2.4018 3.2815 6.5022 4.9684 2.4949 2.7094 2.3762 1.5707 4.6945 3.0681 3.8127 5.0054 3.3061 3.9373 3.9406 3.1697 5.8750 2.9587 3.2519 3.1094 3.4409 4.4498 3.7660 3.1531 1.1990 4.1475 4.4222 3.5299 5.0555 5.3655 2.8959 3.4823 3.7213 3.8914 6.0619 3.3966 4.8445 4.4133 9.1782 4.3431 4.0510 2.0707 1.8209 2.5892 1.2520 5.5050 3.5486 3.3483 1.4788 2.3044 1.5352 1.9336 2.2519 1.3687 6.3971 5.5365 1.4086 3.4826 2.1876 2.5179 2.0515 1.8080 4.4131 1.5710 2.6073 2.3009 2.9541 2.3303 2.3416 1.9421 1.7440 2.1831 1.9950 2.6567 3.2237 2.3847 2.4630 2.4324 2.3158 2.6433 2.7138 2.2944 1.4248 2.9549 2.2628 2.4677 2.7817 1.2142 1.9086 1.7539 2.1074 1.8305 2.0821 1.7554 1.6318 1.5078 3.5632 1.9461 1.9621 1.4453 1.3827 3.3106 1.5768 1.6046 1.4841 1.5307 1.3982 1.4268 2.6816 1.4646 1.5756 1.4643 1.7193 4.3036 3.2128 1.9516 1.1870 1.1211 1.1824 1.0508 1.1205 4.3517 1.1282 1.0656 1.1144 1.1101 1.5467 1.1657 3.5986 3.4296 5.0705 3.3575 7.8917 2.1720 6.7658 7.9326 5.1999 1.0743 1.0740 1.0746 1.0710 1.0711 1.0574 1.0422 1.1002 1.1051 1.0725 1.0789 1.0925 1.0918 1.0837 1.0880 1.0909 1.0963 1.0988 1.0966 1.0901 1.0958 1.0948 1.0928 1.0995 1.1064 1.0931 1.0465 1.1064 0.0004 0.0007 0.0010 0.0033 0.0039 0.0044 0.0089 0.0141 0.0082 0.0186 0.0193 0.0138 0.0194 0.0307 0.0420 0.0592 0.0880 0.1222 0.1246 0.1213 0.0654 0.0808 0.1276 0.2711 0.2260 0.1191 0.1341 0.1225 0.0895 0.2840 0.1962 0.2776 0.3934 0.2770 0.3559 0.4235 0.3447 0.6718 0.3597 0.4259 0.4282 0.5553 0.7316 0.6610 0.5618 0.2193 0.7789 0.9287 0.7678 1.1950 1.3214 0.7399 0.9545 1.0360 1.1387 1.8265 1.1457 1.6515 1.5910 3.3485 1.6600 1.5908 0.8506 0.7521 1.0868 0.5531 2.4874 1.6433 1.6158 0.7542 1.1861 0.8161 1.0693 1.2464 0.7600 3.5736 3.2919 0.8579 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4.1743 9.1513 2.0786 10.7782 2.6890 1.6084 1.0064 4.6225 0.7138 2.3842 1.2835 3.6195 9.6907 3.0223 3.4849 4.7376 6.2817 4.6843 11.3056 9.5099 2.1931 0.6679 17.1135 7.8885 6.7075 10.5077 4.6216 5.0355 7.5234 7.7370 4.1636 3.0233 51.5896 50.6175 87.7661 2.0319 25.2701 4.2008 0.1539 35.7401 27.9523 6.6504 10.4452 24.5044 1.5891 59.5405 3.6674 7.8362 20.5481 18.4195 19.3773 43.9232 40.6712 45.1733 8.6885 37.8022 11.8485 21.4890 4.4766 78.9771 15.2286 19.8490 7.7848 11.0213 62.7757 15.3527 129.8100 98.0896 92.5027 108.9278 52.3208 31.2885 8.1727 15.5989 10.0717 34.4753 551.8455 11.1597 12.1068 48.1647 34.8167 52.0406 56.3207 28.4631 3.7201 37.2179 37.0074 20.7065 134.6112 63.9428 84.0325 11.3234 13.1065 23.7042 49.0084 64.4077 4.9733 45.9975 88.2365 23.3891 14.7951 10.4908 355.7029 60.1781 1.8029 24.8449 35.9833 3.8839 1.0583 40.6163 25.3766 14.7686 13.0401 4.1029 118.6630 4.3640 180.1807 341.5960 7.3058 366.8610 40.1906 1016.5502 38.4024 170.6430 1135.2420 12.5427 33.5322 38.0389 47.9790 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1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 7522.4577 60142.2959 66071.8969 1.00000 0.00233 -0.00068 -0.00233 0.99998 0.00524 0.00069 -0.00524 0.99999 1 0.01151 0.00144 0.00131 0.23991 0.03001 0.02731 15.56 19.39 25.30 44.97 53.59 58.52 82.15 85.78 92.53 104.92 121.20 133.30 135.36 156.75 179.59 197.82 253.56 272.27 280.05 319.07 330.40 343.72 369.67 382.75 399.75 409.55 416.94 425.67 447.46 461.02 473.98 505.82 525.48 542.59 563.54 614.49 618.15 633.85 653.58 678.34 695.58 752.98 760.06 785.27 791.18 801.70 812.27 858.98 874.18 911.33 930.20 947.43 981.36 989.01 1013.95 1028.90 1088.64 1094.43 1125.44 1132.18 1158.82 1174.60 1201.38 1204.64 1214.38 1245.92 1259.98 1275.54 1302.10 1338.64 1344.79 1366.68 1393.94 1394.48 1396.73 1400.98 1445.35 1462.84 1464.77 1485.94 1520.26 1534.35 1542.79 1571.49 1589.14 1596.99 1606.76 1644.35 1652.61 1662.66 1693.09 1714.60 1736.65 1740.49 1740.66 1772.76 1791.22 1797.96 1810.94 1834.93 1842.91 1856.14 1864.54 1870.39 1880.79 1893.39 1902.60 1913.80 1931.18 1939.15 1940.69 1978.41 1986.41 1991.56 2011.55 2035.76 2045.67 2060.27 2066.30 2074.88 2090.80 2117.42 2138.50 2144.76 2154.52 2170.81 2177.67 2219.27 2223.02 2234.40 2252.72 2275.28 2279.69 2296.62 2302.02 2318.21 2342.34 2353.13 2358.93 2361.72 2367.80 2370.70 2374.05 2377.10 2380.74 2387.62 2399.27 2402.54 2411.17 2423.81 2444.18 2478.52 2502.73 2582.17 2600.08 2637.11 2645.69 2657.61 4502.38 4506.68 4521.26 4528.53 4542.39 4542.82 4575.02 4595.28 4641.64 4644.70 4670.87 4679.23 4696.01 4699.98 4742.03 4750.90 4757.08 4767.73 4812.75 4884.50 4907.01 4916.39 4951.34 4986.87 5008.73 5009.46 5521.54 5713.46 0.559430 0.589663 0.590607 0.492828 -1708.705140 -1708.674907 -1708.673963 -1708.771742 3.279524D-04 MUNgauss RevisionA2.0 retrievium 17-Jul-2020 DUDE COCCN(CCN2CCN(c1ccc(F)cc1F)CC2)c5cc4nc(c3ccco3)nn4c(N)n5 475369 CHEMBL514939 RHF 6-31G(d) (6D,10F) C1 498.230329 |X|Y|Z| 175.358753 62.449395 24.928855 64.871310 29 6 7 8 21 7 1 |36.858105| |13.674647|73.516695| |8.134419|24.356470|36.858105| |5.196212|14.221754|12.522823|36.858105| |4.460598|11.267419|7.604284|13.131215|53.358707| |3.702664|8.324111|5.764784|7.714150|17.789875|36.858105| |2.925936|6.339179|4.281818|5.779584|10.404768|12.448751|36.858105| |2.550250|5.260896|3.494193|4.218679|6.886079|7.720792|13.106706|53.358707| |2.159844|4.386613|2.810621|3.345730|5.315391|5.125273|7.862038|17.862112|36.858105| |1.935339|3.824180|2.419456|2.741143|4.218929|3.939301|5.069112|10.616826|12.521600|36.858105| |1.920054|3.753815|2.412632|2.678419|3.953169|3.646199|4.502748|9.119830|7.838461|13.135398|53.358707| |1.709912|3.284506|2.077776|2.250335|3.269157|2.900628|3.380369|6.133105|5.104635|7.806628|18.364361|36.858105| |1.592641|3.034354|1.885505|2.022403|2.969993|2.601957|2.947126|5.157297|4.321301|6.548973|10.460881|13.718838|36.858105| |1.441925|2.718405|1.674322|1.773369|2.569161|2.195380|2.431144|4.053228|3.301349|4.455616|6.920864|7.840566|13.714112|36.858105| |1.394059|2.618168|1.618708|1.705526|2.428241|2.049993|2.263115|3.703480|2.954787|3.772644|6.181679|6.842429|8.019384|13.879176|36.858105| |1.278349|2.383531|1.461407|1.527480|2.161655|1.796434|1.954723|3.113641|2.454680|3.000685|4.695001|4.632088|5.303807|8.159111|14.339067|97.533100| |1.466053|2.764035|1.729042|1.827919|2.571716|2.175414|2.427970|3.991829|3.148568|3.938938|7.004460|7.823550|6.887439|7.921592|13.802496|18.399876|36.858105| |1.621844|3.091522|1.959338|2.099002|2.968258|2.563688|2.935583|5.022020|3.993852|5.182102|10.723680|13.672771|8.057573|6.938760|8.074839|12.009751|13.865266|36.858105| |1.695916|3.245974|2.085364|2.242193|3.104574|2.660841|3.070810|5.144031|3.949031|4.650384|9.526319|8.128496|5.319306|4.676738|5.345562|9.230987|8.231301|14.344281|97.533100| |2.178821|4.258792|2.806208|3.069154|4.483495|4.301961|5.063060|10.599510|6.719075|7.925392|17.787322|7.861857|5.504864|4.095937|3.814894|6.820733|4.356727|6.146710|14.024133|36.858105| |2.513472|5.077849|3.470638|3.997452|5.877699|6.016937|7.852141|17.856774|8.001885|6.721964|10.640033|5.116830|3.979902|3.147993|2.973635|5.558559|3.345286|4.379171|10.727144|12.531838|36.858105| |4.086650|9.965773|5.574883|7.726516|19.014835|7.750769|5.823455|5.659591|3.487920|2.808320|3.492434|2.164352|2.008227|1.752784|1.647742|3.327185|1.722989|1.961400|4.551577|2.796976|3.470184|36.858105| |4.306604|10.589983|5.228128|6.552159|10.728435|5.083611|4.197664|4.389936|2.819980|2.345606|2.965095|1.879806|1.755616|1.557121|1.476426|3.012848|1.541749|1.731608|4.030706|2.347776|2.825807|13.774379|36.858105| |3.483750|7.710038|3.805542|4.431551|7.102371|3.952925|3.474777|3.809158|2.548009|2.155922|2.694097|1.731754|1.640522|1.465486|1.384652|2.842665|1.432583|1.593588|3.672093|2.087814|2.440252|8.045846|13.596765|36.858105| |3.153544|6.620100|3.218295|3.565678|5.310413|3.117017|2.816146|3.198210|2.179208|1.883005|2.374630|1.548940|1.475658|1.332492|1.265053|2.616836|1.305593|1.438423|3.313015|1.826712|2.095143|5.212640|7.629028|14.481953|53.358707| |2.655276|5.398449|2.706236|2.983305|4.551820|2.822087|2.610156|3.031287|2.109466|1.839968|2.295006|1.506717|1.450255|1.312818|1.240016|2.571323|1.270188|1.392971|3.179952|1.742316|1.968159|4.367679|5.465427|9.107801|19.187792|36.858105| |2.309195|4.540489|2.288251|2.462049|3.638224|2.321759|2.180363|2.595105|1.828289|1.622895|2.039120|1.355411|1.311866|1.198830|1.136439|2.372683|1.160532|1.261881|2.876061|1.538629|1.712053|3.281835|3.930286|5.463947|10.632192|13.080527|36.858105| |2.238385|4.326962|2.166733|2.290441|3.279665|2.092986|1.966906|2.357116|1.657418|1.482061|1.883545|1.259179|1.216476|1.118070|1.066294|2.235017|1.091292|1.181798|2.704144|1.424931|1.579958|2.863767|3.451881|4.446077|8.571684|7.480584|14.175755|36.858105| |1.929871|3.670370|1.866900|1.960862|2.806848|1.835839|1.745406|2.126948|1.511985|1.367653|1.738677|1.171949|1.139316|1.053249|1.004603|2.115228|1.023718|1.102000|2.511193|1.306300|1.431527|2.396795|2.768279|3.407919|5.910523|5.207788|8.593413|13.274941|36.858105| |1.853080|3.539345|1.819110|1.926347|2.810017|1.861859|1.780804|2.180738|1.562472|1.415485|1.784202|1.203090|1.175673|1.085578|1.030403|2.168164|1.045519|1.125294|2.550427|1.332579|1.454542|2.416183|2.723788|3.391970|5.641100|5.390973|8.820030|8.614111|14.198681|36.858105| |2.027517|3.935494|2.019766|2.167655|3.228413|2.123031|2.021861|2.449291|1.750244|1.569826|1.961903|1.312795|1.281070|1.174835|1.110198|2.324548|1.126972|1.219774|2.761943|1.466751|1.612578|2.854057|3.233102|4.239892|7.115950|7.900275|14.150557|8.617591|8.622361|14.231960|73.516695| |2.555107|5.221715|2.686225|3.012713|4.819545|3.068785|2.860446|3.323572|2.331486|2.021407|2.478651|1.619025|1.565918|1.408485|1.319407|2.725050|1.345573|1.480715|3.356190|1.869420|2.109653|4.740370|5.369981|8.491646|11.481700|14.654108|7.873318|5.151085|4.150316|4.624759|12.073492|53.358707| |2.968162|6.327273|3.268035|3.802563|6.454432|3.918864|3.545235|3.953026|2.702609|2.285346|2.791993|1.793944|1.717201|1.527827|1.429312|2.929284|1.466670|1.631225|3.715175|2.132135|2.462667|7.165025|8.042379|13.989005|11.942848|9.266821|5.479883|4.146732|3.346222|3.532054|8.229609|18.981521|53.358707| |2.913933|6.232637|3.369028|4.014838|7.433160|4.798443|4.340827|4.773084|3.244281|2.687402|3.204883|2.028568|1.942756|1.704933|1.578514|3.207481|1.616319|1.814352|4.103957|2.444731|2.847418|8.299807|6.945558|8.032679|7.512229|5.647534|4.008774|3.218222|2.735882|2.911648|6.485768|10.694142|19.287148|36.858105| |2.461881|5.064182|2.777617|3.208708|5.645143|4.005072|3.835981|4.504501|3.207524|2.720956|3.174958|2.031748|1.981071|1.740680|1.594945|3.246428|1.613834|1.800590|4.013624|2.365635|2.671414|5.376224|4.666019|5.345689|5.829972|4.763274|3.672408|2.942575|2.605139|2.862182|6.365824|9.339860|11.321735|14.200969|53.358707| |3.295417|7.333954|4.136180|5.219555|11.321201|7.106785|5.916826|5.996463|3.834140|3.064007|3.661663|2.263861|2.132403|1.846877|1.710971|3.444649|1.768286|2.012822|4.587607|2.861439|3.465211|13.977867|7.915178|6.948154|6.438852|4.410921|3.306529|2.795401|2.388854|2.480135|5.303678|7.230523|11.290983|14.728695|11.254991|53.358707| |17.628352|16.906443|5.868134|4.346303|5.363462|3.273271|2.643910|3.151528|1.998385|1.798496|2.407203|1.586169|1.490689|1.356028|1.308244|2.711655|1.367170|1.502781|3.512421|1.976570|2.250817|3.856037|4.264973|3.603982|4.581489|2.816767|2.470559|2.418696|2.072084|1.972321|3.822727|3.619803|4.131872|2.898099|3.340530|4.316218|0.500000| |17.502699|16.461943|7.210857|4.705654|5.258746|3.290484|2.698874|3.242152|2.034311|1.835117|2.509188|1.652282|1.532533|1.395550|1.360089|2.815275|1.437513|1.584823|3.757383|2.091043|2.398591|3.493301|3.681311|3.037016|3.822452|2.384245|2.111008|2.074228|1.804122|1.722741|3.312772|3.105932|3.548748|2.555548|2.984266|3.898693|0.299676|0.500000| |17.508851|16.471763|7.213154|4.742396|5.862462|3.794837|2.946260|3.574754|2.203095|1.997398|2.707523|1.775687|1.659011|1.500616|1.446810|2.981751|1.517489|1.678260|3.927434|2.283926|2.605293|3.868038|3.854186|3.184006|3.887519|2.474421|2.159096|2.073359|1.811315|1.759248|3.424593|3.310177|3.834427|2.840523|3.321050|4.404439|0.299733|0.299438|0.500000| |7.355688|16.569665|17.487295|8.837714|9.533939|6.235544|4.405327|5.095243|2.932283|2.562738|3.510003|2.217079|2.010764|1.777984|1.713572|3.467652|1.829012|2.079454|4.956464|3.081279|3.789560|5.049869|4.453753|3.402835|3.927273|2.499451|2.128990|2.004422|1.749441|1.720696|3.393143|3.441519|4.152819|3.240932|3.720967|5.457011|0.148306|0.178211|0.219011|0.500000| |7.204062|16.568226|17.461152|8.911144|7.603211|4.599499|3.737039|4.288370|2.588572|2.258614|3.122224|1.996730|1.802573|1.614187|1.577493|3.218019|1.696907|1.914099|4.638592|2.660722|3.246247|4.371185|4.269345|3.270532|3.905515|2.431514|2.100891|2.020731|1.754780|1.698288|3.310300|3.247669|3.844343|2.871320|3.299122|4.639347|0.146857|0.213682|0.173037|0.301093|0.500000| |4.282447|10.290336|8.977607|17.552249|12.582526|7.528613|6.427784|6.408535|3.658335|2.965521|4.033745|2.454930|2.162233|1.885849|1.826509|3.656879|1.984212|2.306816|5.649366|3.449724|4.698409|5.864511|4.944384|3.657926|4.132310|2.617078|2.204484|2.061323|1.791930|1.767083|3.505109|3.627608|4.455237|3.514855|3.979426|6.099293|0.100261|0.113414|0.112358|0.210570|0.223874|0.500000| |4.852000|13.088061|8.911312|17.629994|12.436237|5.720393|4.837080|4.915870|3.019429|2.486038|3.287624|2.056448|1.860331|1.645990|1.588815|3.223114|1.698973|1.933328|4.647010|2.689130|3.403262|7.337628|7.417560|4.885166|5.417203|3.219004|2.647764|2.484608|2.098443|2.038725|4.074238|4.304039|5.404064|3.978836|4.284619|6.676576|0.118083|0.125211|0.117073|0.173983|0.211835|0.304773|0.500000| |3.501093|7.553518|4.810432|5.725946|12.422842|17.686831|8.907411|9.521717|4.952766|3.963787|4.826533|2.866037|2.641273|2.224335|2.045683|4.040937|2.133746|2.490113|5.670618|4.100926|5.240447|7.252876|4.804828|3.945245|4.230439|2.884813|2.367076|2.108965|1.859928|1.906459|3.890645|4.377924|5.589465|5.296387|6.181976|10.776274|0.088119|0.085081|0.102053|0.147839|0.107846|0.148626|0.127572|0.500000| |3.946809|8.616513|6.454757|7.555500|12.612837|17.589820|8.810394|9.625881|4.630542|3.786584|5.049902|2.973603|2.634422|2.232268|2.105173|4.146739|2.255255|2.664806|6.297228|4.662590|6.596621|5.812723|4.299430|3.390356|3.773221|2.503507|2.104263|1.927646|1.702049|1.714227|3.428617|3.628729|4.476440|3.835721|4.494733|7.041861|0.093815|0.098703|0.115725|0.217886|0.144188|0.221242|0.148864|0.304553|0.500000| |2.910200|6.355806|4.417358|6.270755|9.629084|8.787951|17.422302|12.256176|6.551843|4.458970|5.732910|3.216349|2.755213|2.309678|2.194614|4.286059|2.393717|2.893168|7.036612|4.698343|7.378729|5.318510|4.091587|3.344800|3.752185|2.517603|2.121889|1.938191|1.716669|1.735134|3.473578|3.668403|4.484995|3.828617|4.561767|6.762324|0.072574|0.076114|0.079830|0.121331|0.111066|0.216727|0.149716|0.173793|0.206114|0.500000| |2.722699|5.880728|3.764207|5.031531|9.402304|8.974132|17.624132|12.509834|7.681463|4.854996|5.513010|3.130448|2.808351|2.332607|2.152446|4.212929|2.274255|2.705593|6.250832|4.225103|5.739991|6.196928|4.418985|3.793177|4.126761|2.859645|2.359694|2.095907|1.858187|1.914458|3.909344|4.375713|5.493111|5.173073|6.282032|9.625765|0.069905|0.069393|0.075379|0.104690|0.091479|0.145094|0.125162|0.219335|0.174770|0.303048|0.500000| |2.071430|4.215851|2.710660|3.265214|4.982830|4.509583|6.931890|12.244359|17.426434|8.887232|9.559041|4.813848|3.964772|3.128549|2.886992|5.430311|3.146910|3.998708|9.279631|5.843133|7.100069|3.281029|2.720609|2.460250|2.892970|2.048532|1.786679|1.630347|1.488370|1.531368|3.033914|3.046145|3.502450|3.009544|4.005107|4.759970|0.053274|0.054791|0.057995|0.077022|0.070609|0.101256|0.083651|0.115841|0.114689|0.187230|0.190211|0.500000| |2.128653|4.337732|2.713034|3.245367|5.339439|4.990668|7.276908|12.510878|17.571828|8.927640|7.718188|4.189078|3.817837|3.004895|2.661089|5.075359|2.758782|3.350580|7.331561|5.004639|5.743389|3.683974|2.956615|2.728018|3.154572|2.276544|1.959964|1.755613|1.602466|1.671091|3.357529|3.493476|4.055116|3.678390|5.109026|5.826977|0.055342|0.055200|0.060078|0.077794|0.068633|0.095232|0.082624|0.140968|0.119016|0.161823|0.237462|0.300739|0.500000| |1.760213|3.460541|2.159393|2.439478|3.712695|3.315114|4.183616|7.686398|8.894806|17.580098|12.510382|7.281580|6.713805|4.682744|3.905619|7.012447|3.975683|5.032546|9.884655|5.712008|5.011690|2.534397|2.159253|2.017740|2.425842|1.757660|1.564041|1.429893|1.328455|1.379486|2.710013|2.628755|2.927059|2.501364|3.504235|3.777888|0.045822|0.046553|0.050138|0.062705|0.056439|0.072737|0.062661|0.092709|0.087746|0.106003|0.116525|0.218104|0.213659|0.500000| |1.954792|3.833392|2.396918|2.669299|4.182885|3.946750|4.737705|9.561760|8.926075|17.446734|12.236734|6.692052|6.535601|4.461240|3.632199|6.593030|3.630062|4.528141|8.929731|7.021134|5.842565|2.816042|2.341577|2.166745|2.572329|1.858377|1.638005|1.489979|1.377411|1.431447|2.828635|2.799298|3.159548|2.758991|3.861760|4.263150|0.050644|0.051086|0.056595|0.071368|0.061519|0.078533|0.066849|0.115924|0.105426|0.111441|0.127497|0.174455|0.219722|0.300306|0.500000| |1.624306|3.102809|1.914193|2.060560|3.082116|2.721010|3.071361|5.404217|4.612006|7.253140|9.512415|8.936715|17.754758|8.975361|5.701552|9.626681|4.962606|5.694570|9.600167|5.196509|3.928499|2.104850|1.827295|1.717231|2.094403|1.521507|1.372232|1.264981|1.185194|1.229097|2.390964|2.255593|2.474079|2.078717|2.923319|3.095763|0.042389|0.043088|0.047086|0.056764|0.050317|0.060531|0.052584|0.078349|0.075404|0.077874|0.082627|0.112458|0.117293|0.207791|0.229627|0.500000| |1.370336|2.572101|1.568769|1.654044|2.405458|2.036968|2.226235|3.639697|2.951807|3.861034|5.604005|5.596327|8.850426|17.748500|8.972179|16.643739|5.649886|4.988612|8.328466|3.448136|2.756575|1.659324|1.481768|1.405863|1.747337|1.272103|1.166588|1.087647|1.028916|1.063479|2.042572|1.860599|2.004245|1.639779|2.298632|2.393593|0.035994|0.036771|0.039641|0.046197|0.041920|0.048391|0.042821|0.057918|0.057187|0.058457|0.060037|0.077259|0.076764|0.113853|0.111160|0.215085|0.500000| |1.409069|2.644794|1.652961|1.737146|2.412938|2.012286|2.226356|3.569476|2.770285|3.304478|5.699535|5.600447|4.962937|5.636916|8.883490|16.563209|17.760620|8.937538|16.779402|3.739867|3.006751|1.617572|1.460498|1.357211|1.692473|1.206921|1.107208|1.046090|0.982467|1.000194|1.909211|1.729835|1.879498|1.508660|2.040446|2.239274|0.036512|0.038621|0.040403|0.048364|0.045455|0.052457|0.045091|0.054450|0.058175|0.061798|0.057907|0.078100|0.068013|0.092398|0.084739|0.107745|0.124227|0.500000| |2.106020|4.062145|2.685255|2.870448|4.038262|3.704281|4.185243|7.690840|5.020735|5.716174|12.465214|7.348881|5.065713|4.026485|3.981731|7.138919|4.815198|6.900486|17.504190|17.629200|8.919832|2.522553|2.164084|1.925302|2.318195|1.618327|1.440632|1.345202|1.236070|1.254752|2.438597|2.337774|2.644340|2.186349|2.864984|3.441531|0.052914|0.056911|0.061318|0.081837|0.072297|0.090386|0.070408|0.096765|0.114197|0.113570|0.098209|0.131407|0.109887|0.127914|0.142831|0.125475|0.093078|0.117453|0.500000| |2.219731|4.290403|2.791057|2.979759|4.437457|4.312129|4.704341|9.477884|5.818208|7.036441|12.282481|6.788514|5.486453|4.104777|3.693320|6.692732|3.996070|5.213343|11.077947|17.449693|8.874774|2.792455|2.335780|2.087015|2.483443|1.747606|1.542953|1.425470|1.308567|1.338362|2.621995|2.563283|2.920333|2.475578|3.285027|3.937143|0.056051|0.058657|0.065609|0.086815|0.072557|0.090447|0.072032|0.119974|0.131335|0.115965|0.111077|0.133560|0.130343|0.143204|0.206684|0.151968|0.098357|0.095136|0.300826|0.500000| |2.842438|5.737249|4.064813|4.528095|6.448943|6.703260|7.230903|12.452197|5.733546|5.005959|7.706813|4.205747|3.427668|2.812190|2.687810|5.128124|3.000040|3.764972|9.262533|8.944215|17.579258|3.638808|2.962555|2.507677|2.924061|1.993581|1.730456|1.603972|1.446357|1.461181|2.876356|2.881746|3.384306|2.845067|3.562641|4.769708|0.069358|0.075354|0.082898|0.128457|0.105197|0.150188|0.102953|0.156382|0.238085|0.191479|0.144102|0.143867|0.127953|0.109752|0.130794|0.094232|0.069451|0.076379|0.214506|0.218318|0.500000| |2.400338|4.864784|3.335910|3.912719|5.475473|5.130781|6.946506|12.280672|7.119424|5.842460|9.530972|4.820241|3.680034|2.988113|2.903323|5.462244|3.352473|4.406220|11.601591|8.898849|17.422058|3.269649|2.729107|2.359837|2.783054|1.913132|1.673210|1.553492|1.408178|1.424911|2.795922|2.764991|3.205783|2.671911|3.396489|4.355563|0.059827|0.064560|0.067938|0.097849|0.089121|0.132428|0.095077|0.120938|0.151671|0.215172|0.147774|0.210523|0.144314|0.131046|0.133897|0.098283|0.072395|0.085366|0.218990|0.174023|0.301138|0.500000| |5.065586|13.260084|6.036227|7.120428|9.474626|4.556490|3.774347|4.033159|2.580355|2.177088|2.807734|1.792895|1.666934|1.488321|1.423008|2.914232|1.493266|1.671377|3.922391|2.242212|2.691326|8.801188|17.867888|8.906921|9.144427|4.698510|3.612522|3.335162|2.671816|2.563956|5.253773|5.919335|7.777204|5.005279|5.039104|7.660206|0.139488|0.120712|0.118596|0.133032|0.138678|0.144026|0.249086|0.116108|0.113548|0.105867|0.105958|0.069944|0.073576|0.055722|0.060032|0.047780|0.039278|0.039539|0.058262|0.061716|0.079555|0.073047|0.500000| |2.396621|4.628751|2.289078|2.400098|3.364890|2.117578|1.977011|2.356994|1.644076|1.467396|1.878612|1.254385|1.205860|1.108569|1.061302|2.224178|1.090575|1.182158|2.718575|1.429721|1.592654|2.910973|3.601826|4.502833|8.894193|6.498502|8.851399|17.819665|8.430367|5.856253|10.457144|6.160270|5.352867|3.078771|3.742944|3.747499|0.072549|0.062014|0.060759|0.058133|0.059684|0.059669|0.073298|0.058624|0.054541|0.054599|0.057940|0.045074|0.047980|0.039189|0.040837|0.034691|0.029873|0.029108|0.037644|0.039635|0.045176|0.043652|0.100132|0.500000| |1.807054|3.398124|1.733889|1.805172|2.552271|1.679721|1.601556|1.965315|1.398844|1.273097|1.627818|1.102485|1.072304|0.995575|0.952654|2.012211|0.970886|1.041412|2.375372|1.222716|1.333833|2.141139|2.451098|2.917320|4.911833|4.076347|5.850027|8.451846|17.803428|8.819542|10.449791|4.588272|3.857088|2.378752|3.093669|2.884004|0.053920|0.047358|0.047125|0.045200|0.045681|0.046123|0.053607|0.047092|0.043625|0.043960|0.047025|0.038362|0.040950|0.034413|0.035564|0.030894|0.027036|0.025954|0.032286|0.033995|0.037469|0.036548|0.066744|0.192278|0.500000| |1.693463|3.213225|1.667416|1.761672|2.572814|1.730513|1.667222|2.063969|1.489982|1.360359|1.712945|1.161130|1.140293|1.056587|1.001950|2.113966|1.012987|1.086214|2.452976|1.272855|1.378630|2.184275|2.406839|2.921357|4.647274|4.300281|6.053380|5.822241|8.612814|17.833743|16.546548|5.387065|4.217314|2.645983|3.633211|3.087345|0.049797|0.043897|0.045016|0.044151|0.043376|0.045270|0.051368|0.049411|0.044403|0.045022|0.049779|0.040547|0.044320|0.037001|0.038285|0.033152|0.028847|0.026919|0.033312|0.035555|0.038333|0.037497|0.062914|0.123101|0.195197|0.500000| |2.289097|4.622765|2.496894|2.818924|4.748496|3.331997|3.199661|3.845927|2.772492|2.412374|2.848657|1.852426|1.820502|1.618486|1.487404|3.050808|1.498401|1.655317|3.683046|2.110998|2.345057|4.418303|4.126136|4.985503|5.832434|5.130949|4.052378|3.158330|2.836169|3.209232|7.328138|10.730392|10.530106|9.434062|26.056902|8.148410|0.064279|0.056933|0.062822|0.068017|0.061304|0.071546|0.077916|0.102950|0.078782|0.079646|0.103815|0.071619|0.088709|0.064235|0.069801|0.054675|0.043891|0.038820|0.052758|0.059845|0.063995|0.061378|0.093548|0.079989|0.067975|0.083667|0.500000| 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