Version2.0 2020-02-04T19:59:02Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 11-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCN1C2=C([C@@H](NC1=O)c3ccccc3C(F)(F)F)C(=O)N(C2)[C@H](C(C)C)C(=O)NCc4ccco4 C35966514 RHF 6-31G(d) (6D,7F) CCN1C2=C([C@@H](NC1=O)c3ccccc3C(F)(F)F)C(=O)N(C2)[C@H](C(C)C)C(=O)NCc4ccco4 C01[X(C25H27F3N4O4)] 183 C1 594 CCN1C(=O)N[C@H](C2=C1CN(C2=O)[C@@H](C(=O)NCc1ccco1)C(C)C)c1ccccc1C(F)(F)F CCN1C(=O)N[C@H](C2=C1CN(C2=O)[C@@H](C(=O)NCc1ccco1)C(C)C)c1ccccc1C(F)(F)F CCN1C(=O)N[C@@H](c2ccccc2C(F)(F)F)C3=C1CN([C@H](C(C)C)C(=O)NCc4occc4)C3=O InChIKey=YQZFARVNPAMZFN-LEWJYISDSA-N InChI=1S/C25H27F3N4O4/c1-4-31-18-13-32(21(14(2)3)22(33)29-12-15-8-7-11-36-15)23(34)19(18)20(30-24(31)35)16-9-5-6-10-17(16)25(26,27)28/h5-11,14,20-21H,4,12-13H2,1-3H3,(H,29,33)(H,30,35)/t20-,21+/m0/s1 InChI=1/C25H27F3N4O4/c1-4-31-18-13-32(21(14(2)3)22(33)29-12-15-8-7-11-36-15)23(34)19(18)20(30-24(31)35)16-9-5-6-10-17(16)25(26,27)28/h5-11,14,20-21H,4,12-13H2,1-3H3,(H,29,33)(H,30,35)/t20-,21+/m0/s1/f/h29-30H CCN1C2=C([C@@H](NC1=O)c3ccccc3C(F)(F)F)C(=O)N(C2)[C@H](C(C)C)C(=O)NCc4ccco4 C01[X(C25H27F3N4O4)] 183 C01 594 CCN1C(=O)N[C@H](C2=C1CN(C2=O)[C@@H](C(=O)NCc1ccco1)C(C)C)c1ccccc1C(F)(F)F CCN1C(=O)N[C@H](C2=C1CN(C2=O)[C@@H](C(=O)NCc1ccco1)C(C)C)c1ccccc1C(F)(F)F CCN1C(=O)N[C@@H](c2ccccc2C(F)(F)F)C3=C1CN([C@H](C(C)C)C(=O)NCc4occc4)C3=O InChIKey=YQZFARVNPAMZFN-LEWJYISDSA-N InChI=1S/C25H27F3N4O4/c1-4-31-18-13-32(21(14(2)3)22(33)29-12-15-8-7-11-36-15)23(34)19(18)20(30-24(31)35)16-9-5-6-10-17(16)25(26,27)28/h5-11,14,20-21H,4,12-13H2,1-3H3,(H,29,33)(H,30,35)/t20-,21+/m0/s1 InChI=1/C25H27F3N4O4/c1-4-31-18-13-32(21(14(2)3)22(33)29-12-15-8-7-11-36-15)23(34)19(18)20(30-24(31)35)16-9-5-6-10-17(16)25(26,27)28/h5-11,14,20-21H,4,12-13H2,1-3H3,(H,29,33)(H,30,35)/t20-,21+/m0/s1/f/h29-30H 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0.18129 0.05346 0.04904 8.71 19.35 30.01 35.95 43.49 56.11 71.20 82.08 85.30 97.33 98.47 107.48 127.46 149.43 164.02 172.26 186.50 205.94 227.12 267.85 283.29 302.39 322.66 333.36 345.14 374.13 382.25 399.32 409.16 425.74 448.66 475.41 486.66 507.82 538.69 558.66 573.19 581.89 601.25 613.77 650.13 670.90 693.63 722.02 757.08 768.12 799.05 814.72 844.83 903.60 914.74 930.92 947.52 948.16 969.50 1001.34 1027.02 1034.13 1051.67 1102.24 1126.57 1170.44 1184.41 1203.16 1220.28 1230.31 1234.24 1246.48 1250.29 1257.29 1293.14 1308.71 1351.27 1354.97 1362.37 1397.52 1440.56 1446.82 1452.02 1467.63 1476.29 1480.93 1508.96 1534.94 1556.54 1565.48 1574.96 1591.17 1605.11 1614.79 1627.25 1641.47 1678.46 1682.94 1733.37 1741.87 1745.86 1751.00 1762.68 1786.59 1789.81 1828.44 1838.71 1863.24 1871.02 1897.75 1902.86 1912.62 1918.01 1929.47 1931.12 1936.77 1943.85 1962.00 1977.07 2015.11 2016.69 2036.40 2044.68 2067.43 2116.94 2143.34 2153.75 2175.38 2189.11 2204.79 2206.33 2228.06 2232.48 2239.48 2245.27 2259.03 2267.96 2281.12 2324.79 2337.34 2346.69 2348.27 2350.32 2363.47 2365.20 2371.57 2374.11 2375.46 2383.95 2389.62 2406.06 2447.17 2468.45 2566.47 2613.91 2622.07 2734.37 2802.25 2812.86 2851.98 4585.27 4590.83 4601.04 4613.48 4615.70 4616.90 4668.39 4680.28 4687.89 4693.39 4699.76 4722.12 4750.13 4761.36 4770.59 4778.81 4796.32 4809.32 4844.27 4870.04 4886.06 4919.69 4944.69 4962.47 5012.03 5576.10 5590.44 0.541113 0.572949 0.573894 0.471711 -1777.502313 -1777.470476 -1777.469532 -1777.571715 3.427235D-04 MUNgauss RevisionA2.0 retrievium 04-Feb-2020 DUDE CCN1C2=C([C@@H](NC1=O)c3ccccc3C(F)(F)F)C(=O)N(C2)[C@H](C(C)C)C(=O)NCc4ccco4 C35966514 RHF 6-31G(d) (6D,10F) C1 504.198440 |X|Y|Z| 126.354208 61.294972 45.168070 70.460983 24 6 7 8 19 4 1 |36.858105| |12.497481|36.858105| |7.650790|13.028456|53.358707| |5.637269|7.641062|18.930773|36.858105| |4.214832|5.110689|10.868062|14.386819|36.858105| |3.717499|4.344638|8.866460|7.680225|12.754104|36.858105| |3.163621|3.730565|7.081324|6.029284|9.074326|17.660179|0.500000| |4.302290|5.186936|11.090251|7.181544|8.043428|13.026029|0.255373|53.358707| |5.871464|7.778776|18.644924|8.034633|6.832183|7.466839|0.163353|19.146791|36.858105| |5.754172|7.024238|11.489701|5.483664|4.774906|5.251314|0.124850|11.576720|15.855783|73.516695| |3.295343|3.531377|6.467368|5.338694|7.493265|12.402712|0.246666|10.526549|5.359305|7.561043|36.858105| |3.534642|3.560670|6.248009|5.147470|6.475012|7.539231|0.156894|8.021841|4.828442|7.022696|13.732862|36.858105| |2.976071|2.900377|4.752618|3.773391|4.433894|4.992782|0.116481|5.807801|3.673394|5.707923|7.876383|13.763459|36.858105| |2.510631|2.491342|4.028917|3.150575|3.718621|4.393043|0.109796|5.169035|3.197820|5.096078|6.800666|7.953129|13.788879|36.858105| |2.418863|2.478823|4.082005|3.188675|3.879623|4.955928|0.130422|5.689337|3.337528|5.290614|7.875727|6.920234|7.980956|13.773593|36.858105| |2.691457|2.854401|4.916833|3.895537|5.032655|7.402318|0.196933|7.714397|4.132113|6.286281|13.621492|7.981399|6.884719|7.917370|13.733158|36.858105| |2.417666|2.632095|4.465415|3.474293|4.371985|6.334482|0.205034|7.103719|3.809378|5.945376|7.516728|5.030539|4.456622|5.053763|7.665898|12.629255|36.858105| |2.102027|2.245398|3.666380|2.805281|3.364972|4.417266|0.136061|5.342127|3.079842|5.004986|5.221522|4.024503|3.886905|4.707209|7.144915|8.100736|14.416419|97.533100| |2.309933|2.561700|4.334378|3.505323|4.517421|6.078293|0.224069|6.378802|3.534955|5.439144|6.264854|4.401368|3.840513|4.161357|5.640722|8.073508|14.405962|20.181295|97.533100| |2.562527|2.842253|4.852607|3.594763|4.342505|6.501586|0.212190|8.518262|4.399020|7.000077|6.473852|4.492221|3.865731|4.134070|5.543941|8.103303|14.288552|20.154900|20.136232|97.533100| |3.466082|4.008000|7.182150|8.344430|12.965291|7.179445|0.182042|6.832012|4.500347|6.235216|5.725507|5.338962|4.022415|3.440975|3.532429|4.323454|3.828257|6.899941|9.463243|8.088515|36.858105| |2.869451|3.218786|5.509079|5.554848|7.988376|6.156134|0.172256|5.819390|3.703050|5.340001|5.529321|5.010202|3.997314|3.567618|3.735808|4.517185|4.057963|7.374407|10.577577|8.129980|15.937504|73.516695| |3.742389|4.320265|7.131438|8.266687|8.337988|5.097202|0.128676|5.650836|4.104895|5.865137|4.254137|4.284019|3.409200|2.897912|2.883681|3.356221|3.016053|5.662454|7.266229|6.552578|13.744142|14.651326|53.358707| |5.008514|6.264054|10.166907|12.675964|8.209001|5.063440|0.122974|6.254527|5.022118|7.055984|4.036023|4.089671|3.226609|2.723975|2.703654|3.153079|2.853654|5.371209|6.654409|6.461297|8.162714|9.702504|17.894503|36.858105| |3.077535|3.459302|5.257745|5.206353|5.186788|3.749687|0.099870|4.336914|3.170160|4.759147|3.288226|3.311351|2.805904|2.461913|2.448112|2.761631|2.553050|4.941466|6.238404|5.521490|7.549085|11.334575|17.876298|7.679629|36.858105| |3.195058|3.497171|5.046035|4.766333|4.434624|3.303011|0.086466|3.976604|2.997770|4.583916|2.953426|3.057545|2.635757|2.296735|2.247954|2.492280|2.290866|4.490345|5.480920|5.001317|5.702348|8.589485|12.730875|7.352131|17.510497|0.500000| |2.564046|2.774151|4.215311|3.962723|4.252746|3.335273|0.090442|3.788435|2.684675|4.101810|3.115795|3.170973|2.793917|2.492117|2.461114|2.706096|2.491480|4.905736|6.151804|5.232867|6.199842|11.453076|10.301635|4.968044|12.297346|0.247606|36.858105| |2.606780|2.705020|4.092455|3.777306|4.061461|3.261150|0.085587|3.712299|2.630504|4.039871|3.228811|3.480087|3.148393|2.741509|2.610131|2.788528|2.474328|4.911033|5.938646|5.129060|5.571095|10.248197|8.744206|4.543324|7.525537|0.193167|12.440484|36.858105| |2.216265|2.374000|3.477734|3.097809|3.209589|2.648901|0.072845|3.126606|2.246707|3.521848|2.493787|2.529458|2.295919|2.091996|2.068526|2.233719|2.100582|4.231360|5.165512|4.455952|4.190977|7.714056|6.726174|3.805459|7.481433|0.192605|12.416540|7.592073|36.858105| |2.813188|3.283202|4.908136|4.605555|4.527307|3.453520|0.096229|4.112324|3.017361|4.598206|2.928356|2.826748|2.414985|2.180544|2.222178|2.529780|2.437317|4.742970|6.063216|5.374413|5.902712|9.332900|10.655414|6.216289|12.380863|0.247068|7.415852|4.867662|6.286085|36.858105| |2.730801|3.266153|5.048187|4.709095|4.849584|3.787345|0.110042|4.456059|3.191153|4.827197|3.102314|2.879082|2.436290|2.232769|2.327900|2.704193|2.675883|5.152584|6.822163|5.942131|6.159563|10.015452|9.329111|5.664405|7.951468|0.165011|5.846273|4.132775|4.917867|15.882321|73.516695| |2.593480|2.970910|4.209315|3.701567|3.509894|2.811696|0.078003|3.482006|2.611536|4.098211|2.442451|2.391436|2.091540|1.902009|1.924108|2.149551|2.082318|4.130922|5.104844|4.630984|4.209767|6.830837|7.310094|4.880044|7.774564|0.210847|5.685509|4.085114|5.888730|14.080230|15.115973|53.358707| |2.288899|2.629794|3.683211|3.099537|2.967241|2.489629|0.070469|3.144928|2.354152|3.766817|2.165249|2.088884|1.847790|1.709395|1.747623|1.947173|1.927942|3.867518|4.745209|4.329473|3.392877|5.670094|5.397643|3.772253|4.987491|0.133652|4.140053|3.170253|4.438228|7.782574|12.209189|17.860584|36.858105| |2.189632|2.473497|3.338699|2.712727|2.538284|2.166653|0.060564|2.805498|2.138821|3.490573|1.910475|1.866916|1.670282|1.545190|1.567209|1.726116|1.702968|3.451376|4.120833|3.851033|2.799202|4.647685|4.449621|3.267709|3.934618|0.113101|3.342677|2.728819|3.643306|5.192600|8.165072|10.707247|12.775813|36.858105| |2.132855|2.413465|3.188917|2.511716|2.323014|2.019721|0.056436|2.672494|2.061475|3.418796|1.778730|1.734087|1.556230|1.445208|1.468595|1.615241|1.603291|3.264842|3.847256|3.666936|2.476684|4.093646|3.854414|2.935820|3.221621|0.092687|2.754359|2.332641|2.912717|4.037600|6.707533|7.248000|7.322788|14.222368|36.858105| |1.977584|2.177372|2.838873|2.212254|2.047443|1.796288|0.049786|2.386885|1.845934|3.091800|1.610299|1.589030|1.442675|1.340251|1.351075|1.469033|1.448888|2.974628|3.446376|3.302060|2.174949|3.617775|3.379612|2.572168|2.815650|0.083041|2.477060|2.157428|2.669521|3.310767|5.402992|5.776793|5.140326|8.567466|13.211421|36.858105| |1.952184|2.120464|2.790496|2.209721|2.061408|1.794512|0.049546|2.353770|1.807486|3.005117|1.624975|1.617052|1.474286|1.365754|1.368619|1.480503|1.448875|2.976504|3.451428|3.269440|2.233690|3.740149|3.514714|2.613133|3.023515|0.090858|2.707802|2.350546|3.027307|3.490638|5.495205|6.304177|5.343025|8.758100|8.596857|14.248435|36.858105| |2.065348|2.268693|3.043726|2.470533|2.322958|1.990371|0.055136|2.568921|1.955569|3.204915|1.791499|1.776892|1.608536|1.485840|1.492151|1.623505|1.586374|3.237493|3.814044|3.557732|2.581965|4.330175|4.129273|2.988315|3.720376|0.111278|3.299285|2.751388|3.789951|4.494234|6.810076|8.982046|7.887885|14.106942|8.637175|8.628620|14.130808|73.516695| |17.594818|8.844851|9.394880|5.003375|4.000878|3.763194|0.088212|6.188686|6.263005|11.854938|3.429558|3.697838|3.143991|2.655928|2.550495|2.820667|2.515468|4.940166|5.289105|6.063044|3.228162|4.853305|4.534187|4.198749|2.745829|0.077758|2.353542|2.415634|2.037248|2.519792|4.417632|3.146338|2.066316|1.969152|1.921772|1.786609|1.763033|3.308025|0.500000| |17.547276|8.845412|7.585240|4.427748|3.455529|3.086490|0.075225|4.775086|4.557627|8.314310|2.774570|2.950695|2.563969|2.206398|2.128331|2.334560|2.131341|4.235234|4.613198|5.075446|2.970236|4.468008|4.424305|4.225160|2.793416|0.081903|2.346973|2.374698|2.077301|2.599666|4.452805|3.353039|2.203147|2.153774|2.127833|1.998280|1.961642|3.633758|0.301097|0.500000| |17.541674|8.773859|9.362970|5.872309|4.424819|3.753624|0.087730|5.561228|5.168959|8.434362|3.423639|3.832971|3.225712|2.652291|2.503031|2.756673|2.423474|4.738239|5.233414|5.642626|3.748562|5.468225|5.663270|5.552013|3.381234|0.099260|2.816962|2.937963|2.405000|2.965159|5.005340|3.697567|2.344471|2.231503|2.139078|1.993999|1.999012|3.790310|0.300485|0.301059|0.500000| |8.823197|17.604164|12.538054|7.318520|4.861402|3.924688|0.096533|5.925594|5.793222|9.175005|3.199430|3.222003|2.659652|2.301075|2.290013|2.620372|2.441034|4.714464|5.468185|5.838241|4.084549|5.786373|6.401559|7.310475|3.864983|0.111113|2.984765|2.847134|2.574302|3.729974|6.445976|4.668853|2.997829|2.840063|2.770046|2.477610|2.404976|4.591734|0.173345|0.212775|0.209573|0.500000| |8.863574|17.675938|12.589805|5.822221|4.325513|3.943608|0.097247|6.707042|7.464995|14.128641|3.214910|3.154848|2.624676|2.311715|2.332973|2.682112|2.538686|4.919743|5.537275|6.311135|3.443526|5.082745|4.898754|4.831289|2.991294|0.083222|2.453652|2.371256|2.140277|2.940287|5.310646|3.679950|2.468802|2.345690|2.334044|2.104913|2.020080|3.797078|0.213236|0.212695|0.173054|0.303679|0.500000| |3.743156|4.317314|8.095715|5.224382|5.782050|9.015289|0.215182|26.036988|9.691358|14.220077|6.933362|5.240181|4.064798|3.800023|4.323451|5.830427|5.703729|9.749977|10.776307|17.308821|4.079939|6.516249|4.671173|3.706041|2.748329|0.070521|2.461552|2.424151|2.071302|2.639419|5.090036|3.097385|2.090877|1.881505|1.806288|1.623094|1.596170|3.073813|0.113018|0.087369|0.097774|0.101765|0.119322|0.500000| |4.224074|4.163268|7.368294|6.250605|7.308915|7.059619|0.143601|7.962231|5.259777|7.472419|8.949755|17.742259|8.960265|5.664979|4.978499|5.665610|4.090069|7.514419|8.442960|8.644854|5.876102|9.017565|6.781548|4.924790|3.697534|0.096457|3.425100|3.811940|2.696818|3.063853|5.426585|3.522816|2.222080|1.993193|1.846872|1.693751|1.727659|3.379593|0.120511|0.095272|0.132804|0.104196|0.098464|0.136690|0.500000| |2.960675|2.791723|4.412896|3.471643|3.879975|4.088775|0.096737|4.959330|3.310955|5.249917|5.626675|8.933350|17.718513|8.919300|5.660986|4.958238|3.560976|7.207392|7.131398|7.175433|3.623065|6.322182|4.391918|3.081747|2.707097|0.072130|2.712260|3.142202|2.255220|2.304176|4.059227|2.754229|1.781611|1.626390|1.516062|1.417484|1.455220|2.810999|0.086709|0.071530|0.090943|0.071580|0.069783|0.095957|0.216734|0.500000| |2.259434|2.215092|3.485289|2.697012|3.090172|3.520648|0.090063|4.281877|2.736654|4.461363|4.915216|5.647031|8.904266|17.728383|8.929362|5.639948|4.125020|9.206583|7.882888|7.799661|2.928367|5.420409|3.456600|2.394087|2.212547|0.057942|2.266324|2.509769|1.939372|1.969883|3.562017|2.370774|1.575021|1.434645|1.345110|1.256046|1.282466|2.468493|0.066355|0.055991|0.066278|0.057244|0.057491|0.088126|0.124380|0.214130|0.500000| |2.144098|2.199966|3.547347|2.739897|3.256599|4.049833|0.111498|4.826380|2.895973|4.699431|5.624398|4.980732|5.672688|8.949325|17.771363|8.933259|7.159409|18.730729|12.056193|11.676743|3.029101|5.757013|3.433263|2.369762|2.194544|0.056162|2.224866|2.336536|1.906101|2.024711|3.784261|2.411761|1.628737|1.466093|1.378870|1.271855|1.286565|2.484514|0.062691|0.053143|0.061125|0.056861|0.058259|0.103988|0.108028|0.124462|0.215929|0.500000| |5.679018|6.345092|8.957286|8.804801|6.160719|4.260075|0.102522|5.468482|4.519970|6.638458|3.645033|3.898856|3.166482|2.634838|2.548600|2.886139|2.574135|4.936432|5.885922|5.807778|6.096621|7.991041|12.332487|17.546081|6.553306|0.201881|4.569671|4.494425|3.629735|5.100018|7.940705|5.956056|3.409169|3.085891|2.798725|2.523382|2.589607|5.177568|0.126404|0.133860|0.191381|0.209052|0.131551|0.092470|0.134228|0.086626|0.065109|0.062179|0.500000| |4.607374|6.108420|8.948033|8.900632|6.298431|4.345113|0.111230|5.606026|4.583575|6.696846|3.439977|3.382062|2.752793|2.392969|2.409237|2.797592|2.621274|4.992462|6.181447|6.030720|6.302873|8.245193|12.287051|17.529952|7.114085|0.193610|4.540195|3.930711|3.701510|7.019736|11.399548|7.787352|4.435478|3.828016|3.451792|2.937235|2.932157|5.997859|0.106573|0.113332|0.133523|0.220293|0.137731|0.094673|0.108230|0.073066|0.059121|0.059687|0.300710|0.500000| |2.428957|2.658019|4.135675|3.885850|4.416366|3.554717|0.099274|3.923705|2.702770|4.110990|3.322458|3.273228|2.877220|2.616229|2.636881|2.930047|2.733162|5.354801|6.938467|5.650558|6.693403|14.361760|9.335600|4.540669|8.888705|0.175330|17.648264|8.919057|8.908193|6.831112|10.982842|6.855574|3.932171|3.114941|2.601864|2.315653|2.488822|5.337204|0.062841|0.061434|0.072992|0.078125|0.066144|0.071182|0.095242|0.075987|0.065696|0.066433|0.111810|0.116103|0.500000| |2.694596|2.737557|4.014106|3.621519|3.691852|2.971902|0.077026|3.498524|2.544027|3.951857|2.930823|3.218513|2.939750|2.536935|2.385749|2.526636|2.243039|4.484714|5.291310|4.723594|4.713953|8.108394|7.901522|4.494194|6.851421|0.208112|8.756084|17.506222|6.821464|4.514824|6.638173|5.472287|3.100536|2.754765|2.363437|2.221324|2.445139|5.045126|0.068565|0.068935|0.085710|0.080899|0.066229|0.063575|0.100149|0.083401|0.065144|0.059507|0.131606|0.108685|0.173562|0.500000| |2.287058|2.353525|3.535667|3.158138|3.433523|2.900058|0.077355|3.324316|2.333189|3.634492|2.946810|3.159279|2.966724|2.650001|2.518034|2.631154|2.351830|4.751005|5.659249|4.822100|4.493704|8.764295|6.519508|3.623958|5.481400|0.142294|8.830273|17.554301|7.043062|4.039794|6.326252|4.791136|2.853660|2.483402|2.137026|1.996794|2.182062|4.499403|0.059697|0.058421|0.070727|0.068112|0.058258|0.061357|0.093108|0.082685|0.068534|0.063472|0.099527|0.089674|0.212778|0.301666|0.500000| |2.830005|2.922208|4.553752|4.295784|4.812752|3.815537|0.097668|4.216111|2.939527|4.444961|3.882453|4.316703|3.831741|3.234312|3.035669|3.258146|2.798113|5.473989|6.647955|5.729223|6.740312|12.382324|9.697579|4.933714|6.793186|0.168526|8.751641|17.629338|5.501179|4.497901|7.129286|5.002065|2.914386|2.517280|2.193592|2.018739|2.160219|4.427502|0.073537|0.070222|0.089455|0.083696|0.070476|0.075734|0.133092|0.105614|0.080765|0.073912|0.134427|0.112836|0.214441|0.300582|0.302584|0.500000| |2.116511|2.303494|3.365266|2.965630|3.063996|2.558630|0.071627|3.044608|2.187469|3.444278|2.366989|2.350171|2.125353|1.960625|1.967249|2.140891|2.054059|4.145496|5.104618|4.392367|3.923254|7.229576|6.150153|3.597007|6.677644|0.166437|8.686769|5.488357|17.574495|6.936401|9.784723|9.385958|5.393810|4.189002|3.240937|2.911166|3.309513|7.631199|0.054092|0.055388|0.062790|0.069728|0.058392|0.056272|0.068940|0.057465|0.050476|0.050725|0.093149|0.101003|0.213663|0.138682|0.143466|0.122392|0.500000| |2.017328|2.132084|3.126916|2.738359|2.883644|2.453636|0.067756|2.893825|2.059532|3.253066|2.368555|2.412886|2.237039|2.062294|2.031589|2.159826|2.030413|4.139784|4.990521|4.261573|3.687162|7.049749|5.567395|3.226511|5.470192|0.142366|8.839725|7.078770|17.567678|4.720179|7.117934|6.057285|3.638824|3.088016|2.540545|2.368125|2.672089|5.757879|0.052139|0.052627|0.060711|0.063245|0.053806|0.053838|0.070418|0.061306|0.053625|0.052387|0.086412|0.086175|0.212363|0.172428|0.217583|0.143882|0.303314|0.500000| |2.251146|2.380528|3.403662|2.984132|2.989353|2.465785|0.066901|2.973435|2.176510|3.440981|2.324762|2.393657|2.183711|1.974991|1.932914|2.073458|1.940115|3.924320|4.695194|4.157034|3.748630|6.604170|6.252789|3.745125|6.807873|0.207036|8.714165|6.782357|17.498322|5.660390|7.683811|7.990933|4.364974|3.795591|3.025214|2.841945|3.310408|7.374450|0.056984|0.059246|0.068318|0.072465|0.059415|0.054756|0.071821|0.060354|0.051127|0.049469|0.103187|0.102091|0.173132|0.199386|0.170548|0.138549|0.300581|0.302528|0.500000| |2.538678|2.826280|3.932890|3.419456|3.222329|2.599529|0.071125|3.234696|2.439950|3.860049|2.311001|2.308198|2.043073|1.849517|1.847952|2.036924|1.950811|3.899413|4.730284|4.315919|3.847800|6.285931|6.787358|4.547424|7.418984|0.233966|5.779626|4.291743|6.533499|9.370560|10.882375|26.069828|9.072258|7.331297|5.012770|4.316926|5.036669|13.153415|0.062681|0.067583|0.074903|0.090501|0.070995|0.058981|0.069834|0.055567|0.047352|0.047285|0.120015|0.141763|0.133630|0.122476|0.102701|0.103865|0.202214|0.133833|0.202366|0.500000| |2.359449|2.777205|3.923630|3.275672|3.132130|2.646742|0.075896|3.369530|2.521548|4.029054|2.253748|2.138033|1.874848|1.741227|1.799056|2.027524|2.033597|4.056576|5.031875|4.619101|3.494618|5.789378|5.393207|3.868751|4.648079|0.120417|3.789474|2.953432|3.820738|7.342534|13.675917|12.568611|17.665398|9.014135|6.861179|4.626931|4.442573|10.227373|0.059345|0.062801|0.066133|0.087812|0.073344|0.062197|0.062857|0.049782|0.044352|0.046598|0.094436|0.129660|0.103410|0.079238|0.073794|0.077495|0.124659|0.089192|0.102068|0.180738|0.500000| |2.057664|2.329115|3.300962|2.773045|2.732823|2.339101|0.066915|2.924462|2.153286|3.457024|2.066621|1.988253|1.777676|1.660704|1.702817|1.884954|1.877796|3.797580|4.661481|4.177364|3.164655|5.486225|4.857938|3.276880|4.497110|0.117689|4.072125|3.097028|4.603214|6.556322|10.857214|12.369336|17.528399|8.971740|5.862570|4.506523|4.834722|12.363429|0.052259|0.054917|0.058694|0.072170|0.061029|0.054511|0.058075|0.047575|0.042697|0.044368|0.082794|0.102475|0.110401|0.082860|0.079392|0.078263|0.165684|0.107239|0.121750|0.203093|0.302793|0.500000| |2.156907|2.479074|3.271675|2.540301|2.343466|2.058083|0.057869|2.753503|2.131069|3.553883|1.794277|1.732331|1.548798|1.443464|1.476568|1.633039|1.635313|3.326424|3.924541|3.775652|2.451944|4.039910|3.747169|2.899420|3.031767|0.085496|2.578758|2.197158|2.653838|3.813346|6.639648|6.396291|6.328178|8.839892|17.797244|8.434188|5.853543|10.456856|0.054182|0.059772|0.059255|0.078802|0.067657|0.051858|0.051047|0.041696|0.037240|0.038568|0.075783|0.095616|0.068782|0.061273|0.055927|0.058239|0.081466|0.064854|0.075177|0.118274|0.190329|0.143311|0.500000| |1.878716|2.051981|2.649416|2.031870|1.878258|1.668002|0.046178|2.238761|1.738235|2.942822|1.502301|1.483953|1.353931|1.261583|1.271128|1.376910|1.360587|2.806925|3.217689|3.113348|1.967146|3.277055|3.018462|2.319646|2.458141|0.072305|2.183838|1.937948|2.326837|2.821001|4.684022|4.701265|4.032371|5.840832|8.431875|17.802247|8.838843|10.449860|0.047370|0.053228|0.052255|0.064350|0.055683|0.042554|0.043832|0.037019|0.032945|0.033336|0.063672|0.072871|0.057074|0.055498|0.050111|0.050801|0.069529|0.058185|0.068551|0.097277|0.105162|0.100835|0.192802|0.500000| 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