Version2.1 2021-01-08T21:02:55Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 26-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCCn1c2ccccc2nc(c1=O)CCC(=O)O[C@H](C)C(=O)Nc3ccc(cc3)F C11590054 RHF 6-31G(d) (6D,7F) CCCCn1c2ccccc2nc(c1=O)CCC(=O)O[C@H](C)C(=O)Nc3ccc(cc3)F C01[X(C24H26F1N3O4)] 168 C1 532 CCCCn1c(=O)c(CCC(=O)O[C@@H](C(=O)Nc2ccc(cc2)F)C)nc2c1cccc2 CCCCn1c(=O)c(CCC(=O)O[C@@H](C(=O)Nc2ccc(cc2)F)C)nc2c1cccc2 CCCCN1C(=O)C(=Nc2ccccc12)CCC(=O)O[C@H](C)C(=O)Nc3ccc(F)cc3 InChIKey=NETZMLOHTMYZBU-MRXNPFEDSA-N InChI=1S/C24H26FN3O4/c1-3-4-15-28-21-8-6-5-7-19(21)27-20(24(28)31)13-14-22(29)32-16(2)23(30)26-18-11-9-17(25)10-12-18/h5-12,16H,3-4,13-15H2,1-2H3,(H,26,30)/t16-/m1/s1 InChI=1/C24H26FN3O4/c1-3-4-15-28-21-8-6-5-7-19(21)27-20(24(28)31)13-14-22(29)32-16(2)23(30)26-18-11-9-17(25)10-12-18/h5-12,16H,3-4,13-15H2,1-2H3,(H,26,30)/t16-/m1/s1/f/h26H CCCCn1c2ccccc2nc(c1=O)CCC(=O)O[C@H](C)C(=O)Nc3ccc(cc3)F C01[X(C24H26F1N3O4)] 168 C01 532 CCCCn1c(=O)c(CCC(=O)O[C@@H](C(=O)Nc2ccc(cc2)F)C)nc2c1cccc2 CCCCN1C(=O)C(=N[C]2[C]1[CH][CH][CH][CH]2)CCC(=O)O[C@@H](C(=O)N[C]1[CH][CH][C]([CH][CH]1)F)C CCCCN1[C]2[CH][CH][CH][CH][C]2N=C(CCC(=O)O[C@H](C)C(=O)N[C]3[CH][CH][C](F)[CH][CH]3)C1=O InChIKey=NETZMLOHTMYZBU-MRXNPFEDSA-N InChI=1S/C24H26FN3O4/c1-3-4-15-28-21-8-6-5-7-19(21)27-20(24(28)31)13-14-22(29)32-16(2)23(30)26-18-11-9-17(25)10-12-18/h5-12,16H,3-4,13-15H2,1-2H3,(H,26,30)/t16-/m1/s1 InChI=1/C24H26FN3O4/c1-3-4-15-28-21-8-6-5-7-19(21)27-20(24(28)31)13-14-22(29)32-16(2)23(30)26-18-11-9-17(25)10-12-18/h5-12,16H,3-4,13-15H2,1-2H3,(H,26,30)/t16-/m1/s1/f/h26H 2945.0472930039 -1486.2927223 1-A 26905.1577 116 416 532 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -26.30504 -20.62579 -20.56499 -20.54390 -20.53770 -15.63187 -15.60926 -15.59597 -11.39328 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84.9573 108.5805 121.2358 126.1110 143.5755 153.5661 160.6196 189.8280 193.8706 227.8441 252.3481 258.1971 263.7656 272.8704 308.0704 325.6950 352.2054 360.1270 373.7340 417.2565 422.1643 440.2993 447.0965 454.3633 467.1700 469.0671 493.0515 501.8502 503.2794 534.1955 563.8330 583.1470 605.8277 625.2257 633.3473 634.9010 653.0071 672.1814 700.2381 701.0599 726.1030 774.0959 778.7347 793.3118 797.6671 809.5318 824.2770 837.7724 857.0399 862.0915 871.8290 897.9086 924.1282 935.5698 957.9585 960.1002 961.5591 972.5552 983.0114 988.5723 1031.7586 1044.2802 1059.0758 1062.1005 1081.4842 1083.8459 1104.0575 1108.2025 1113.1784 1115.3458 1135.2193 1144.6185 1144.8834 1148.9213 1172.7673 1191.6374 1212.0995 1221.3548 1230.6764 1234.4687 1245.3358 1273.2313 1275.3965 1286.4738 1300.7739 1303.6381 1327.9287 1345.3107 1352.9451 1366.7996 1383.5043 1390.1256 1412.5743 1420.6711 1420.9716 1431.8759 1441.0512 1450.4119 1457.6726 1466.3262 1483.6116 1500.3276 1513.7099 1527.1191 1539.2702 1560.2867 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MUNgauss RevisionA2.0 retrievium 08-Jan-2021 DUDE CCCCn1c2ccccc2nc(c1=O)CCC(=O)O[C@H](C)C(=O)Nc3ccc(cc3)F C11590054 RHF 6-31G(d) (6D,10F) C1 439.190735 |X|Y|Z| 62.520536 30.078892 148.632366
65.383170 23 6 7 8 19 3 1
|36.858105| |12.466921|36.858105| |7.484555|12.453056|36.858105| |4.881563|7.516373|12.471100|36.858105| |3.779148|4.950777|7.631921|12.991173|53.358707| |3.307222|4.078856|5.739530|7.616572|18.591550|36.858105| |3.384722|4.129074|5.423995|6.500181|10.570286|13.637961|36.858105| |2.818343|3.246738|3.963155|4.420691|7.006785|7.919469|13.813228|36.858105| |2.428805|2.737746|3.323595|3.699054|6.184425|6.806254|7.897411|13.698623|36.858105| |2.401426|2.724538|3.394725|3.873985|7.054122|7.880509|6.878099|7.994386|13.849470|36.858105| |2.723959|3.187224|4.190461|5.067609|10.826644|13.643999|7.923814|6.897857|7.915883|13.682039|36.858105| |2.525338|2.914425|3.762316|4.481193|9.307106|7.831235|5.161230|4.590249|5.211737|7.985848|13.713655|53.358707| |2.706510|3.168335|4.148498|5.048801|10.679111|6.923329|4.595956|3.867787|4.054616|5.379578|8.301662|20.539805|36.858105| |3.333654|4.133432|5.811393|7.897193|19.002596|7.922253|5.154260|3.961109|3.802852|4.583031|6.891077|10.692748|12.734038|36.858105| |3.432041|4.241777|5.618944|7.064235|11.493107|5.418923|4.048823|3.224180|3.075066|3.556055|4.804174|7.420308|8.097052|15.846486|73.516695| |2.383185|2.707461|3.347852|3.849590|6.880034|4.477031|3.371814|2.974342|3.141941|3.964840|5.144383|10.711388|12.651985|7.507170|12.177169|36.858105| |2.038833|2.262915|2.718557|3.041671|5.239656|3.740047|2.962929|2.753932|3.035341|3.876923|4.575601|9.335020|7.556569|4.906271|7.894954|12.516604|36.858105| |1.834733|2.003522|2.334237|2.552083|4.148590|2.912830|2.412055|2.261795|2.450674|2.973861|3.362467|6.062128|4.933381|3.769574|6.537204|7.570179|12.637309|36.858105| |1.842847|2.005598|2.308513|2.503477|3.959237|2.696970|2.253448|2.087567|2.212467|2.621277|2.989845|5.188984|4.417055|3.631960|6.646694|6.758505|7.924260|16.065366|73.516695| |1.648521|1.782103|2.049349|2.218948|3.556489|2.577160|2.191798|2.106790|2.317434|2.781920|3.001674|5.184680|3.916725|3.079391|5.262204|5.162226|8.128513|14.255324|15.260237|73.516695| |1.499906|1.604752|1.811280|1.936606|3.016284|2.170453|1.887369|1.820078|1.975767|2.303355|2.453956|4.046769|3.081401|2.565179|4.493958|3.894688|5.162723|8.014258|12.625588|23.750024|36.858105| |1.526954|1.624163|1.828016|1.934037|2.984413|2.116629|1.840858|1.760169|1.888633|2.185950|2.355395|3.863362|3.011609|2.557250|4.566080|3.858624|4.813703|7.574337|14.109878|16.535239|17.655129|0.500000| |1.419281|1.527041|1.703525|1.841464|2.831831|2.028906|1.779054|1.714855|1.847744|2.128216|2.262651|3.663434|2.799969|2.387431|4.219465|3.461224|4.307289|6.050603|10.404158|13.966109|12.513193|0.246197|36.858105| |1.387947|1.470103|1.649639|1.742696|2.694977|1.976010|1.749163|1.714672|1.876033|2.161025|2.238722|3.590149|2.646788|2.232305|3.866654|3.152735|4.059397|5.267723|8.279636|14.042116|12.476955|0.250965|7.594320|36.858105| |1.291920|1.359816|1.509350|1.583554|2.412433|1.761888|1.577775|1.547984|1.678365|1.902484|1.964213|3.086328|2.288160|1.979589|3.464917|2.679594|3.272687|4.112326|6.903387|9.630491|8.120613|0.202342|6.486649|15.874209|73.516695| |1.409439|1.492414|1.686171|1.779753|2.781108|2.080041|1.845483|1.832486|2.038594|2.365500|2.401763|3.843164|2.743114|2.276914|3.863757|3.170323|4.188531|4.930859|7.303397|13.007382|7.793404|0.169288|5.449803|14.111450|14.927049|53.358707| |1.318176|1.384902|1.553826|1.625054|2.514597|1.903132|1.719154|1.730521|1.931067|2.201026|2.183853|3.387728|2.380280|2.015833|3.409198|2.643729|3.321054|3.655765|5.631835|8.506617|4.994308|0.119721|4.000211|7.656713|11.552148|18.382401|36.858105| |1.213954|1.267245|1.406151|1.460964|2.226912|1.674133|1.528883|1.537551|1.694621|1.897251|1.885473|2.875694|2.045551|1.773736|3.034413|2.258929|2.727073|3.028317|4.873171|6.713805|4.196180|0.105460|3.566621|6.286875|11.676384|10.489653|13.696586|36.858105| |1.146715|1.190924|1.314498|1.358108|2.056023|1.556533|1.439216|1.459953|1.608853|1.776577|1.743046|2.608349|1.840867|1.615822|2.757480|1.988625|2.344327|2.520739|4.096183|5.355743|3.222732|0.082878|2.845647|4.318941|7.980056|6.968360|7.930421|13.746115|36.858105| |1.162957|1.207223|1.336068|1.378827|2.094320|1.605109|1.493120|1.531018|1.703065|1.874073|1.809172|2.679608|1.861354|1.630105|2.754498|1.973825|2.321978|2.416856|3.881269|5.058086|2.902644|0.074424|2.566706|3.692489|6.441496|6.218348|6.899004|7.972874|13.851266|36.858105| |1.251774|1.305526|1.458169|1.511267|2.323071|1.799640|1.665753|1.718373|1.940097|2.160146|2.062580|3.069941|2.096734|1.807518|3.018417|2.207997|2.646076|2.690532|4.217706|5.676491|3.116395|0.078627|2.704059|3.897008|6.390972|7.060881|7.890906|6.846582|7.937385|13.836649|36.858105| |1.340684|1.408004|1.586366|1.656952|2.578592|1.988852|1.809458|1.849081|2.096527|2.388882|2.311362|3.534891|2.415783|2.037293|3.393055|2.597576|3.239545|3.337811|5.082325|7.385391|3.971605|0.097133|3.300183|5.169018|7.886828|10.857077|13.693338|7.939251|6.907291|8.025224|13.784303|36.858105| |1.095256|1.131684|1.244377|1.278051|1.925022|1.478691|1.390923|1.433671|1.587289|1.720936|1.650929|2.407150|1.671712|1.483675|2.510568|1.749927|2.015039|2.072849|3.371883|4.224490|2.413874|0.062817|2.182821|2.942388|5.208991|4.713022|4.653963|5.288613|8.148441|14.301591|8.154211|5.308331|97.533100| |17.554851|8.780481|5.460886|4.054431|4.355745|2.846649|2.940191|2.508436|2.177900|2.140403|2.390007|3.035585|2.378231|2.870595|5.295269|2.130196|1.844537|1.679820|3.011473|2.701071|1.394158|0.039427|1.328361|1.293690|2.152332|1.782184|1.228546|1.137716|1.077568|1.091153|1.168900|1.246762|2.319902|0.500000| |17.537915|8.773261|6.781136|4.502354|4.975329|3.349538|3.542544|2.996346|2.555195|2.482733|2.767086|3.428559|2.638444|3.167874|5.606003|2.301740|1.998488|1.789015|3.163816|2.881080|1.471562|0.041473|1.386164|1.372531|2.269464|1.910768|1.320895|1.215432|1.153010|1.175367|1.268159|1.352614|2.497304|0.301673|0.500000| |17.544827|8.780740|6.786058|4.515172|4.980431|3.154654|3.113049|2.617929|2.312601|2.330610|2.660958|3.441219|2.751389|3.375295|6.341093|2.467847|2.099611|1.904014|3.427758|3.025024|1.552288|0.044222|1.460675|1.433079|2.373594|1.973044|1.352048|1.246341|1.174274|1.186855|1.275117|1.368888|2.509863|0.301704|0.301620|0.500000| |8.862391|17.501356|8.843361|6.889985|6.280451|4.012076|4.314788|3.408812|2.800256|2.714581|3.109468|3.779912|2.943830|3.734725|6.596459|2.501736|2.127645|1.881884|3.324806|3.005671|1.524354|0.042570|1.459840|1.403347|2.310513|1.945546|1.332583|1.220751|1.151517|1.170838|1.266481|1.360311|2.477327|0.213029|0.210662|0.173022|0.500000| |8.863729|17.519015|8.859277|6.935426|6.292376|3.692185|3.603295|2.883218|2.491958|2.521070|2.962929|3.797929|3.103001|4.086908|7.887750|2.718417|2.250583|2.016568|3.633584|3.169657|1.614262|0.045546|1.547217|1.468074|2.420308|2.011361|1.364658|1.252109|1.172783|1.182362|1.273647|1.377066|2.490007|0.212912|0.172972|0.210979|0.303780|0.500000| |6.860056|8.842674|17.548400|8.922990|9.512400|5.142139|4.543632|3.492468|3.072828|3.240226|4.034973|5.214068|4.395415|6.213944|11.459312|3.645089|2.898063|2.502848|4.448710|3.856874|1.917167|0.054278|1.786256|1.736253|2.821368|2.403874|1.618354|1.463670|1.362036|1.378408|1.502433|1.642252|2.878086|0.140282|0.168780|0.203535|0.173478|0.211765|0.500000| |6.860142|8.838864|17.524859|8.836251|9.486764|6.145291|6.322361|4.583834|3.721399|3.690329|4.437031|5.172929|3.978012|5.153049|8.300319|3.168249|2.649977|2.258980|3.915753|3.573045|1.771910|0.049448|1.655720|1.632362|2.652193|2.294635|1.566196|1.414722|1.329482|1.360758|1.491347|1.614753|2.859608|0.140270|0.203425|0.168868|0.211272|0.173589|0.303231|0.500000| |4.522516|6.860432|8.778572|17.622812|12.489992|7.212029|7.259346|4.834429|3.848444|3.843986|4.778167|5.495835|4.285632|5.900356|9.309970|3.333569|2.744286|2.321416|4.020907|3.653424|1.804435|0.049690|1.732090|1.637574|2.654945|2.284308|1.544048|1.392455|1.301525|1.326057|1.452333|1.581998|2.778301|0.108504|0.118849|0.111167|0.206273|0.172566|0.173738|0.208412|0.500000| |4.537617|6.838471|8.868688|17.677733|12.627452|5.757527|4.875662|3.613327|3.157503|3.361337|4.315552|5.583623|4.856243|7.735751|14.717351|3.924603|3.037537|2.598675|4.620111|3.972959|1.964584|0.054782|1.886490|1.748431|2.833367|2.401264|1.600185|1.444219|1.336773|1.347433|1.468514|1.614588|2.805407|0.108532|0.111222|0.120225|0.169244|0.206881|0.215478|0.173836|0.304053|0.500000| |3.905617|4.943211|6.294899|7.288054|9.542771|8.850392|17.787444|8.998407|5.648309|4.960607|5.629798|5.665483|3.946695|4.676551|6.913301|3.022013|2.632301|2.198325|3.712715|3.548746|1.743806|0.047582|1.654269|1.616348|2.613616|2.300241|1.578570|1.417303|1.337755|1.382113|1.527826|1.649677|2.910499|0.093855|0.114229|0.096095|0.151536|0.115500|0.135405|0.208454|0.255306|0.146242|0.500000| |2.738218|3.093745|3.595238|3.860808|5.676139|5.647259|8.987968|17.720183|8.899639|5.671236|4.965171|4.962413|3.185878|3.304567|4.970059|2.551275|2.383843|2.005937|3.320945|3.352202|1.652495|0.044500|1.565770|1.568682|2.538633|2.275502|1.593334|1.428857|1.366708|1.435208|1.599879|1.702262|3.048175|0.068693|0.081965|0.069742|0.092424|0.075950|0.087384|0.115889|0.120012|0.089355|0.218776|0.500000| |2.177685|2.404659|2.827915|3.072263|4.923133|4.918569|5.629715|8.879293|17.734263|8.932055|5.632389|5.740263|3.376682|3.145440|4.672310|2.746112|2.728018|2.254017|3.616941|3.865068|1.874029|0.049571|1.757362|1.805859|2.886208|2.690079|1.900407|1.674266|1.605336|1.715135|1.957759|2.087216|3.623670|0.054930|0.063876|0.057722|0.068595|0.061191|0.073331|0.087327|0.088980|0.074599|0.124381|0.214069|0.500000| |2.143948|2.390591|2.910626|3.259924|5.748049|5.646467|4.956858|5.651765|8.891111|17.737115|8.999027|10.127443|4.986862|4.014232|5.724764|3.937199|4.132920|3.156389|4.829960|5.390778|2.479705|0.064453|2.272201|2.354250|3.648177|3.581443|2.456797|2.085482|1.950243|2.076477|2.435964|2.717055|4.259539|0.053577|0.061322|0.058424|0.065756|0.062259|0.078880|0.086471|0.088940|0.081166|0.107687|0.124014|0.213076|0.500000| |2.319825|2.664382|3.210455|3.784011|6.442339|4.058517|3.136282|2.753026|2.854969|3.487564|4.421872|8.291799|8.986021|6.923557|12.535760|17.570769|8.826938|6.899784|12.187431|8.488481|3.774885|0.104108|3.542460|2.996217|4.598998|3.991050|2.449620|2.126707|1.873824|1.844936|2.037756|2.376113|3.697968|0.058225|0.061436|0.066477|0.068697|0.075931|0.095993|0.082508|0.091906|0.111973|0.079697|0.066460|0.069873|0.095339|0.500000| |2.485611|2.774779|3.427197|3.753055|6.404140|4.056852|3.139530|2.758977|2.863290|3.499140|4.430162|8.311210|8.986992|6.899514|12.527324|17.573219|8.827561|6.912453|12.291202|8.469152|3.772775|0.108683|3.276880|3.079012|4.715725|4.157575|2.565608|2.218950|1.956169|1.931119|2.140079|2.499231|3.862695|0.061417|0.066363|0.072943|0.069873|0.077646|0.107779|0.089470|0.088547|0.106951|0.079771|0.066607|0.070093|0.095726|0.307975|0.500000| |2.036659|2.230019|2.695094|2.937590|5.070577|3.758857|3.009419|2.849117|3.205648|4.152883|4.744025|9.535098|6.857973|4.545859|7.148829|8.800327|17.565928|9.024017|11.008507|13.138936|4.841485|0.126142|3.861476|4.109046|5.847216|6.113283|3.616866|2.904042|2.506054|2.518597|2.929580|3.632124|4.887890|0.050970|0.056121|0.058351|0.058236|0.060740|0.079962|0.074541|0.073805|0.079564|0.073555|0.068334|0.080484|0.126583|0.172793|0.208957|0.500000| |1.940868|2.169781|2.583174|2.949602|5.082875|3.754369|3.002706|2.838973|3.189434|4.125944|4.724017|9.477555|6.842380|4.546780|7.144674|8.791180|17.572518|9.022290|10.954410|13.247682|4.855238|0.119303|4.328981|3.922654|5.634463|5.621803|3.312897|2.706825|2.339924|2.335772|2.681840|3.282062|4.565913|0.049067|0.053000|0.054835|0.057508|0.059869|0.074699|0.070287|0.075654|0.081512|0.073417|0.068102|0.080051|0.125451|0.208944|0.172723|0.306264|0.500000| |1.387666|1.498470|1.671966|1.820358|2.810666|2.041700|1.798191|1.749077|1.901042|2.191572|2.298352|3.698387|2.763041|2.340228|4.073179|3.317707|4.182944|5.376870|8.646188|12.692970|8.837671|0.173633|17.560334|6.833370|10.225580|7.484839|4.123106|3.617770|2.910976|2.657136|2.827562|3.462780|5.074484|0.036106|0.037769|0.039418|0.040056|0.042030|0.048257|0.045342|0.047969|0.051533|0.046237|0.044367|0.050501|0.065656|0.094067|0.085025|0.104829|0.123725|0.500000| |1.481410|1.604269|1.788589|1.949088|2.989620|2.108005|1.835166|1.748648|1.866142|2.150646|2.326480|3.789263|2.971066|2.555138|4.583478|3.762772|4.505350|6.446024|12.148763|12.528781|8.875635|0.214692|17.602655|5.527822|8.659064|5.910365|3.330397|2.989253|2.463063|2.261649|2.390429|2.862538|4.401373|0.038520|0.039935|0.042392|0.042496|0.045477|0.052209|0.047839|0.050724|0.056089|0.047576|0.044260|0.048899|0.062964|0.111379|0.098537|0.107221|0.124759|0.299890|0.500000| |1.328433|1.418953|1.567598|1.678840|2.546301|1.823549|1.618159|1.564281|1.675548|1.903338|2.008964|3.187878|2.432121|2.121702|3.778439|2.934261|3.499847|4.651077|8.373084|10.103673|8.889029|0.212380|17.617904|7.042589|12.733744|6.656993|3.801796|3.586280|2.865405|2.525926|2.588568|3.084236|4.864320|0.034700|0.036047|0.038022|0.037717|0.039986|0.045641|0.042357|0.044011|0.047808|0.042085|0.039977|0.044524|0.056163|0.083370|0.078807|0.089623|0.096696|0.300284|0.300374|0.500000| |1.503002|1.601867|1.829218|1.945090|3.088633|2.326562|2.039454|2.024839|2.277835|2.696334|2.741936|4.486794|3.155146|2.545193|4.257813|3.664319|5.137345|5.828253|8.036843|16.218692|7.628835|0.163454|5.306477|9.567808|10.908922|26.088233|9.293652|5.728160|4.279064|4.092748|4.911065|7.622991|7.189058|0.038595|0.041623|0.042865|0.042596|0.043931|0.053195|0.050895|0.050813|0.053322|0.051386|0.050833|0.060979|0.084502|0.092127|0.096084|0.157963|0.142116|0.151851|0.122415|0.125067|0.500000| |1.190242|1.241961|1.372175|1.425616|2.160477|1.607650|1.465851|1.463234|1.598113|1.785120|1.794085|2.743247|1.980110|1.730198|2.989909|2.213652|2.646105|3.023207|4.978272|6.677558|4.448219|0.113806|3.841322|6.874670|15.148966|9.517622|8.913198|17.830232|8.934523|5.673711|4.947013|5.651237|9.596896|0.031056|0.032969|0.034023|0.033174|0.034247|0.039778|0.038135|0.037679|0.039393|0.037934|0.037816|0.043640|0.053952|0.058541|0.060782|0.076774|0.072434|0.105597|0.088192|0.111766|0.143058|0.500000| |1.083509|1.121509|1.229859|1.266683|1.901930|1.433534|1.332338|1.349231|1.475241|1.615084|1.589204|2.361466|1.678327|1.490463|2.559232|1.809362|2.096767|2.261335|3.739319|4.712740|2.875557|0.075283|2.601430|3.736000|7.201245|5.628327|5.635911|8.893165|17.739868|8.978223|5.660505|4.971712|16.681549|0.028381|0.030236|0.030833|0.030144|0.030736|0.035381|0.034497|0.033776|0.034721|0.034592|0.035257|0.040914|0.048808|0.047732|0.049681|0.061596|0.058005|0.073363|0.063144|0.074166|0.097748|0.214425|0.500000| |1.254639|1.306888|1.459945|1.510078|2.320663|1.817959|1.698144|1.772061|2.016019|2.225166|2.087667|3.057741|2.061817|1.784918|2.960132|2.128129|2.515160|2.489605|3.908597|5.116358|2.746465|0.069882|2.418097|3.276519|5.363272|5.719600|5.615105|4.940340|5.656423|8.955061|17.742565|8.877946|16.657720|0.032535|0.035474|0.035376|0.035341|0.035252|0.041579|0.041744|0.040492|0.040510|0.043166|0.045990|0.057168|0.070126|0.054409|0.057134|0.077734|0.071235|0.070404|0.060435|0.063965|0.115941|0.107459|0.124741|0.500000| |1.431105|1.511512|1.719685|1.806705|2.851408|2.225678|2.009444|2.063221|2.377626|2.759014|2.642258|4.079162|2.725786|2.252780|3.698501|2.899777|3.701256|3.653051|5.404365|8.023462|4.012064|0.097333|3.314078|4.843282|7.093862|10.026486|8.898344|5.642364|4.968410|5.691022|8.963766|17.699733|9.617044|0.036796|0.040183|0.040496|0.040580|0.040910|0.049360|0.048807|0.047874|0.048613|0.050360|0.052288|0.065652|0.089144|0.072525|0.076406|0.118724|0.105516|0.097328|0.081222|0.083666|0.234150|0.124103|0.107819|0.214777|0.500000|
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