Version2.2 2021-02-11T22:10:50Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 29-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cc(ccc1F)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)N[C@@H](C)C(=O)NC C39683910 RHF 6-31G(d) (6D,7F) Cc1cc(ccc1F)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)N[C@@H](C)C(=O)NC C01[X(C21H30F1N4O3)] 171 C1 495 CNC(=O)[C@@H](NC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1ccc(c(c1)C)F)C CNC(=O)[C@@H](NC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1ccc(c(c1)C)F)C CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(CC12CC[NH2+]CC2)C(=O)c3ccc(F)c(C)c3 InChIKey=VRDNSINOMLALEM-HNNXBMFYSA-N InChI=1S/C21H29FN4O3/c1-13-10-15(4-5-17(13)22)20(29)26-11-16(19(28)25-14(2)18(27)23-3)21(12-26)6-8-24-9-7-21/h4-5,10,14,16,24H,6-9,11-12H2,1-3H3,(H,23,27)(H,25,28)/p+1/t14-,16-/m0/s1 InChI=1/C21H29FN4O3/c1-13-10-15(4-5-17(13)22)20(29)26-11-16(19(28)25-14(2)18(27)23-3)21(12-26)6-8-24-9-7-21/h4-5,10,14,16,24H,6-9,11-12H2,1-3H3,(H,23,27)(H,25,28)/p+1/t14-,16-/m0/s1/fC21H30FN4O3/h23-25H/q+1 Cc1cc(ccc1F)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)N[C@@H](C)C(=O)NC C01[X(C21H30F1N4O3)] 171 C01 495 CNC(=O)[C@@H](NC(=O)[C@@H]1CN(CC21CC[NH2+]CC2)C(=O)c1ccc(c(c1)C)F)C CNC(=O)[C@@H]([NH][C](=O)[C@@H]1CN(CC21CC[NH2]CC2)C(=O)[C]1[CH][CH][C]([C]([CH]1)C)F)C CNC(=O)[C@H](C)NC(=O)[C@@H]1CN(CC12CC[NH2]CC2)C(=O)[C]3[CH][CH][C](F)[C](C)[CH]3 InChIKey=GWNYTMHGKORTMH-HOCLYGCPSA-N InChI=1S/C21H30FN4O3/c1-13-10-15(4-5-17(13)22)20(29)26-11-16(19(28)25-14(2)18(27)23-3)21(12-26)6-8-24-9-7-21/h4-5,10,14,16H,6-9,11-12,24H2,1-3H3,(H,23,27)(H,25,28)/t14-,16-/m0/s1 InChI=1/C21H30FN4O3/c1-13-10-15(4-5-17(13)22)20(29)26-11-16(19(28)25-14(2)18(27)23-3)21(12-26)6-8-24-9-7-21/h4-5,10,14,16H,6-9,11-12,24H2,1-3H3,(H,23,27)(H,25,28)/t14-,16-/m0/s1/f/h23,25H 2870.0530786034 -1354.3868775 1-A 16357.4956 108 387 495 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4674.67 4689.08 4696.65 4709.05 4719.53 4720.39 4732.34 4736.06 4745.20 4763.39 4763.82 4771.90 4774.48 4797.06 4799.12 4804.24 4827.47 4847.53 4883.66 4891.18 4907.30 5278.90 5370.55 5539.13 5598.76 0.545369 0.572492 0.573437 0.484211 -1353.841508 -1353.814385 -1353.813441 -1353.902666 2.992621D-04 MUNgauss RevisionA2.1 retrievium 11-Feb-2021 DUDE Cc1cc(ccc1F)C(=O)N2C[C@H](C3(C2)CC[NH2+]CC3)C(=O)N[C@@H](C)C(=O)NC C39683910 RHF 6-31G(d) (6D,10F) C1 405.230194 |X|Y|Z| 68.124634 104.307568 28.918305 59.010724 17 6 7 15 2 |36.858105| |12.628952|36.858105| |7.494671|13.775028|36.858105| |4.978841|7.851602|13.664598|36.858105| |4.415045|6.786846|7.924232|13.718115|36.858105| |5.007268|7.823093|6.885211|7.936228|13.771311|36.858105| |7.575541|13.725069|8.082974|6.957449|8.023657|13.837763|36.858105| |6.852270|8.186138|5.344268|4.688896|5.326506|8.209740|14.380071|97.533100| |3.800974|5.060546|7.703464|12.778260|7.547750|5.034042|4.506647|7.720535|36.858105| |3.663186|4.544122|6.734556|8.089734|5.347440|4.043047|3.866415|6.885971|15.782848|73.516695| |3.080043|3.929479|5.196954|7.764028|6.476184|4.421077|3.768294|6.746359|13.855176|15.057860|53.358707| |2.911910|3.671286|4.522330|6.272442|6.053290|4.378291|3.666440|6.700189|7.592892|9.632818|17.734176|36.858105| |2.476498|2.950248|3.536914|4.363910|4.067891|3.243204|2.877441|5.481766|5.408152|8.058248|10.752999|12.168333|36.858105| |2.507372|2.937046|3.471907|4.077973|3.755037|3.104663|2.831116|5.445955|4.773688|7.327903|8.253762|8.708502|17.581168|0.500000| |2.410841|2.824957|3.473906|4.188122|3.674285|2.932669|2.670244|5.091899|5.778012|9.558706|11.015943|7.697693|12.195290|0.242406|36.858105| |2.570937|3.096671|3.905294|5.033976|4.379252|3.325379|2.948692|5.516907|7.847830|12.526837|17.937065|8.129292|7.957147|0.161534|12.366927|36.858105| |2.596629|2.974779|3.719500|4.185657|3.463163|2.838227|2.697628|5.147158|5.666079|10.323688|8.630024|5.853968|7.572674|0.210720|12.329170|7.459324|36.858105| |2.426115|2.700060|3.336206|3.597078|2.975863|2.497113|2.419189|4.681178|4.792665|9.907012|6.673433|4.203409|4.882190|0.131830|7.439841|6.069909|12.529281|36.858105| |2.039299|2.244153|2.670967|2.895254|2.517432|2.150370|2.064200|4.071622|3.678612|7.220247|5.402229|3.570770|4.338349|0.115447|6.457018|5.152363|7.707286|12.616490|53.358707| |1.943600|2.111282|2.488050|2.651530|2.313958|2.001235|1.937218|3.850383|3.303674|6.631272|4.696415|3.069672|3.557298|0.094912|4.925886|4.338576|5.686141|9.157535|25.688828|0.500000| |1.947340|2.122727|2.488522|2.665882|2.346490|2.031695|1.959768|3.898521|3.274911|6.251034|4.813415|3.344287|4.177677|0.116190|5.736199|4.359111|7.021310|9.199504|25.682690|0.328506|0.500000| |1.937052|2.165682|2.559892|2.873415|2.574012|2.175216|2.039473|4.022199|3.675268|6.894069|5.795594|3.846872|4.806932|0.119122|7.500538|6.085286|6.530693|7.551759|17.200368|0.254708|0.255808|36.858105| |2.024645|2.304412|2.726848|3.153081|2.873488|2.392799|2.201740|4.313087|4.032166|7.038497|6.938090|4.987157|7.268035|0.167803|12.386020|7.436782|7.646182|6.459189|10.407227|0.157220|0.193830|12.491655|36.858105| |2.118061|2.479106|2.845491|3.432270|3.414928|2.834759|2.490715|4.878704|3.989263|6.140163|7.436310|7.542772|12.490952|0.246868|7.386447|5.843624|4.983372|3.754719|4.988217|0.086022|0.099986|4.323658|6.564118|36.858105| |1.999238|2.339056|2.669714|3.243373|3.291375|2.731097|2.373630|4.671918|3.788057|5.896328|7.089045|6.344657|7.999199|0.163303|6.364295|5.895519|4.268270|3.459368|4.726094|0.083297|0.092469|4.309819|6.236596|15.768847|73.516695| |1.972547|2.264850|2.531957|2.941989|2.954833|2.556147|2.285404|4.567074|3.257462|5.120126|5.581501|5.477485|7.854241|0.213988|5.275870|4.209997|4.157486|3.225441|4.347978|0.076168|0.090496|3.603521|5.056370|14.254099|15.106051|53.358707| |1.744148|1.976642|2.161234|2.472088|2.536517|2.254993|2.020516|4.116675|2.671945|4.268330|4.420220|4.050300|5.007861|0.134998|3.889110|3.346603|3.191304|2.637542|3.645559|0.065634|0.075994|3.037091|3.971448|7.773653|12.075834|17.889867|36.858105| |1.744429|1.991570|2.166455|2.507132|2.632756|2.340688|2.064828|4.211135|2.684401|4.245145|4.472457|4.082491|4.683674|0.120479|3.671826|3.340033|2.970484|2.487954|3.411067|0.062033|0.069816|2.868317|3.677893|7.249946|12.993491|12.543352|17.586921|0.500000| |1.575250|1.761274|1.928340|2.174921|2.193334|1.958629|1.779973|3.647718|2.387058|3.922218|3.882019|3.328869|4.153290|0.111266|3.596246|3.079421|2.985783|2.566195|3.705707|0.067234|0.078180|3.152471|4.025807|5.911323|10.222927|10.482590|12.425366|0.246274|36.858105| |1.690725|1.892043|2.029651|2.269081|2.338461|2.137174|1.941555|4.015057|2.378712|3.818636|3.782744|3.441162|4.030518|0.116680|3.183856|2.769756|2.790672|2.330639|3.176044|0.057885|0.067003|2.538800|3.164123|5.232667|8.025346|10.873656|12.448086|0.245634|7.552294|36.858105| |1.764189|1.962852|2.102758|2.320540|2.360555|2.169093|1.996815|4.130663|2.416310|3.887958|3.781218|3.462612|4.094707|0.126255|3.207919|2.731281|2.919375|2.407286|3.235843|0.058760|0.069061|2.516849|3.117599|4.876130|7.123447|9.968063|7.999487|0.167989|5.723271|15.803437|73.516695| |1.548126|1.718845|1.818504|2.015940|2.102282|1.954944|1.779509|3.730219|2.085487|3.371702|3.259537|2.872690|3.203102|0.090758|2.643172|2.381685|2.343923|2.013163|2.756658|0.051030|0.057834|2.200862|2.651233|4.007749|6.614906|7.202320|7.823625|0.200427|6.128762|14.237586|15.117313|53.358707| |1.471569|1.613703|1.684074|1.834937|1.912387|1.813002|1.672240|3.552373|1.868759|3.043054|2.851122|2.471739|2.691044|0.077700|2.267568|2.060276|2.074461|1.804097|2.455079|0.045867|0.051703|1.920317|2.254390|3.161305|5.210889|5.392444|5.001052|0.130523|4.296847|7.810829|12.198730|17.850321|36.858105| |17.572521|8.859736|5.855206|4.277158|3.969793|4.609003|6.749531|15.483354|3.360522|5.827714|3.772024|2.600581|2.226398|0.061960|2.183206|2.353158|2.315938|2.198678|2.556174|0.050139|0.049709|1.797474|1.863237|1.939645|3.296903|2.460018|1.617746|0.045199|1.470451|1.566845|2.884833|1.970116|1.378857|0.500000| |17.567035|8.853359|5.856824|4.281499|3.964199|4.591244|6.719211|15.378738|3.354750|5.669372|3.845828|2.765855|2.384383|0.068074|2.280197|2.378335|2.455824|2.269352|2.623983|0.050887|0.051706|1.831716|1.929575|2.057568|3.426044|2.649150|1.728224|0.047861|1.554616|1.697707|3.172776|2.120583|1.493690|0.302807|0.500000| |17.595244|8.883170|7.195426|4.716613|3.949095|4.161496|5.591270|11.150159|3.832150|6.872169|4.167090|2.845353|2.474837|0.069976|2.463876|2.604982|2.725519|2.593915|2.929686|0.057278|0.057030|2.008806|2.072501|2.095550|3.506121|2.652311|1.715103|0.047304|1.562652|1.657239|3.083650|2.057354|1.434948|0.301429|0.301205|0.500000| |6.919016|8.953073|17.742892|8.945442|5.654335|4.960866|5.706331|9.641184|7.226231|13.304569|6.597106|4.122242|3.423748|0.094538|3.514591|3.869544|3.972361|3.687875|3.903920|0.074740|0.073930|2.667307|2.775430|2.728586|4.534890|3.315933|2.075279|0.057163|1.878691|1.947721|3.604589|2.369998|1.615335|0.151079|0.150838|0.219328|0.500000| |3.535818|4.909745|5.632316|8.883127|17.745577|8.957185|5.691947|9.647631|6.915142|8.742677|9.654083|6.861731|4.398003|0.108154|3.878695|4.771644|3.447897|2.940927|3.465605|0.064692|0.065759|2.681306|3.050134|3.821368|6.732589|4.389175|2.779322|0.081788|2.379379|2.510549|4.422127|3.073625|2.024058|0.090536|0.090272|0.089981|0.124195|0.500000| |4.109179|5.615814|4.961693|5.627387|8.851088|17.748548|8.979227|16.841298|4.078314|5.986617|5.186993|3.898096|2.966301|0.078721|2.654375|2.980749|2.525536|2.234846|2.676524|0.050996|0.051889|2.011486|2.217909|2.693657|4.672987|3.349752|2.217440|0.064741|1.919960|2.116563|3.784609|2.671606|1.828052|0.109324|0.108718|0.096158|0.107716|0.213676|0.500000| |3.288489|4.234823|5.189313|7.063543|6.785900|4.997799|4.225402|7.580205|7.250548|9.193386|12.315506|17.662567|8.647238|0.226923|5.936809|5.907700|5.333315|3.876300|4.396700|0.078157|0.085608|3.321115|4.112107|5.849843|8.625953|6.619844|3.687761|0.101883|3.013421|3.322304|6.142936|3.794037|2.456960|0.079738|0.087895|0.088263|0.127570|0.193363|0.120239|0.500000| |2.692157|3.375741|3.955944|5.397663|5.932334|4.399957|3.533581|6.581645|5.940946|7.900899|12.358843|17.625342|8.713674|0.181962|5.929327|6.608111|4.496639|3.482102|4.224286|0.075583|0.081200|3.437804|4.396349|7.669632|12.698452|7.587314|4.336556|0.128422|3.463404|3.617091|6.241771|4.172810|2.600192|0.068025|0.071449|0.071895|0.098327|0.209664|0.114030|0.302123|0.500000| |2.324680|2.778581|3.367961|4.296709|4.035100|3.128580|2.725480|5.185494|5.917004|9.389282|12.531313|7.076106|6.986364|0.140606|8.857485|17.588105|5.484198|4.728730|6.046275|0.106934|0.106922|5.670585|7.064911|6.204757|12.786611|5.889795|3.553132|0.101353|3.298674|2.853272|4.865831|3.372655|2.114113|0.059960|0.060151|0.064642|0.090863|0.128079|0.080113|0.142109|0.186776|0.500000| |2.575116|3.054008|3.884265|4.795247|4.025723|3.127103|2.845071|5.346517|7.602241|14.733784|12.489933|5.805684|5.638233|0.127540|8.543251|17.706377|6.853055|6.742680|7.565138|0.135230|0.123889|6.282106|6.341257|4.434435|8.040855|4.675970|2.838172|0.078533|2.682100|2.406915|4.240890|2.866206|1.849622|0.065987|0.065311|0.073573|0.110608|0.117488|0.077465|0.131113|0.137160|0.301095|0.500000| |3.038215|3.542034|4.621966|5.151820|4.011568|3.242548|3.122062|5.832377|7.078454|12.706651|9.633556|6.365382|6.961170|0.201287|8.712290|6.891141|17.630298|9.046782|7.648920|0.127390|0.143985|4.881401|5.518924|4.509380|6.885335|5.209769|2.970719|0.077946|2.709114|2.662402|4.997044|3.068426|2.019182|0.073729|0.079220|0.089252|0.139987|0.106973|0.078217|0.174245|0.130324|0.139467|0.178523|0.500000| |2.423695|2.719713|3.280535|3.581891|3.067401|2.593137|2.487988|4.832584|4.448752|7.906749|6.703363|5.055409|6.975708|0.226398|8.809405|5.471498|17.503200|8.903606|9.451259|0.144457|0.206133|5.756290|6.927910|4.893395|7.169052|5.965101|3.332020|0.083667|3.136731|2.971431|5.665409|3.349915|2.188173|0.060031|0.064880|0.070549|0.096630|0.084724|0.064929|0.133884|0.111993|0.123379|0.138379|0.304229|0.500000| |2.528816|2.837874|3.568472|3.878368|3.151279|2.613877|2.527277|4.851798|5.399150|12.274795|7.169985|4.160688|4.473813|0.115842|6.665242|6.647752|8.773575|17.659517|12.335996|0.223823|0.180640|6.828827|5.652250|3.505508|5.946734|4.031354|2.464011|0.065858|2.387375|2.171478|3.939355|2.585309|1.704124|0.064148|0.064585|0.075272|0.110572|0.086344|0.064581|0.105411|0.096944|0.141032|0.238517|0.214801|0.173352|0.500000| |2.441792|2.647781|3.225959|3.321289|2.743342|2.358661|2.337216|4.567230|4.178999|8.697851|5.526650|3.603491|4.066636|0.115235|5.435558|4.608542|8.774931|17.626761|12.364512|0.221714|0.226183|5.566326|4.881151|3.213449|5.232449|3.906177|2.385838|0.062301|2.323850|2.161714|4.018690|2.559901|1.709709|0.061269|0.063750|0.073749|0.101571|0.073928|0.058613|0.096298|0.084126|0.104296|0.139646|0.213740|0.215763|0.301480|0.500000| |1.977490|2.223167|2.644441|2.995311|2.675609|2.243325|2.094092|4.112998|3.906030|7.504625|6.097047|3.808876|4.419721|0.106794|6.732968|6.693769|5.732515|6.884059|12.431876|0.225361|0.181327|17.634029|8.749229|3.975004|7.342753|4.434644|2.792699|0.075159|2.856092|2.342868|4.095187|2.804076|1.804335|0.051312|0.051421|0.056918|0.076462|0.077789|0.057523|0.090533|0.095749|0.177134|0.214158|0.127838|0.132980|0.203655|0.142025|0.500000| |1.746314|1.929034|2.235363|2.474389|2.259108|1.944988|1.830529|3.656870|3.045868|5.664340|4.719440|3.236928|3.984873|0.101386|5.461642|4.619609|4.910784|5.563117|12.369500|0.222615|0.225494|17.624849|8.763555|3.826076|6.896763|4.529809|2.914265|0.076151|3.148454|2.448280|4.283842|2.922946|1.878365|0.045322|0.046156|0.050192|0.064429|0.065444|0.050504|0.079051|0.082702|0.126343|0.130958|0.107821|0.129531|0.141345|0.126512|0.301471|0.500000| |1.925896|2.164313|2.518862|2.848577|2.620819|2.228916|2.070979|4.100957|3.488273|6.057562|5.776828|4.439432|6.699868|0.173481|8.772066|5.448924|6.870979|5.676084|9.350619|0.143563|0.203697|8.883470|17.502694|6.422032|10.032677|7.513958|4.296286|0.105336|4.495933|3.452952|6.145391|3.864372|2.410361|0.049130|0.051574|0.054788|0.071312|0.076485|0.057740|0.106443|0.109749|0.144129|0.132180|0.140243|0.204737|0.131190|0.128387|0.173010|0.215294|0.500000| |1.912969|2.184756|2.548517|2.981204|2.806186|2.343707|2.125970|4.188786|3.724796|6.358666|6.547737|4.787425|6.559311|0.145351|8.775787|6.906904|5.526449|4.851251|7.606401|0.126977|0.143106|8.994150|17.626833|7.111548|13.969194|7.161447|4.322686|0.114231|4.500144|3.291666|5.561210|3.794864|2.328257|0.049331|0.050687|0.053836|0.070815|0.084741|0.061184|0.107461|0.125176|0.216182|0.160368|0.122860|0.140993|0.126684|0.107406|0.213717|0.212524|0.303818|0.500000| |2.035291|2.321342|2.583296|2.947456|2.926246|2.563055|2.325520|4.659167|3.208693|5.060625|5.314963|5.247665|7.402506|0.242191|4.964591|3.884543|4.236774|3.230231|4.267788|0.074738|0.090383|3.381567|4.585841|9.329054|10.811587|25.998047|9.178810|0.187100|6.149660|8.005067|16.079292|7.000255|4.063985|0.051402|0.056288|0.055971|0.069343|0.086564|0.068122|0.138754|0.140886|0.106237|0.089757|0.110383|0.129532|0.081123|0.081466|0.084325|0.086556|0.143029|0.124757|0.500000| |1.463428|1.625892|1.760097|1.969558|2.005041|1.815290|1.653364|3.421525|2.130515|3.516316|3.403279|2.868679|3.400844|0.091454|3.004867|2.665731|2.554266|2.244695|3.235421|0.059723|0.067992|2.720236|3.317907|4.559258|8.216021|7.601458|8.762670|0.212486|17.575282|6.811376|8.974057|8.972420|4.596509|0.038174|0.040217|0.040211|0.047536|0.060356|0.049892|0.073176|0.083906|0.079578|0.065623|0.065327|0.073950|0.058655|0.057081|0.069671|0.076301|0.100413|0.102596|0.132142|0.500000| |1.587813|1.782518|1.969807|2.240839|2.247319|1.982988|1.795091|3.656796|2.507107|4.141878|4.136900|3.458841|4.354807|0.111403|3.942934|3.402287|3.154308|2.743017|4.041221|0.073133|0.084123|3.587295|4.655281|6.333877|12.133591|9.528873|8.853797|0.213705|17.604334|5.510496|8.001424|6.361862|3.493045|0.041267|0.043187|0.043871|0.053453|0.068227|0.053783|0.084586|0.100068|0.104064|0.082062|0.078210|0.090139|0.071367|0.067879|0.090346|0.100460|0.141096|0.154289|0.150237|0.301593|0.500000| |1.553450|1.721909|1.886789|2.100231|2.086307|1.870985|1.722443|3.536013|2.309910|3.840978|3.696853|3.138538|4.002709|0.111842|3.547779|2.943898|3.052039|2.631426|3.845756|0.069552|0.083128|3.202178|4.043318|5.263843|8.565064|9.455005|8.802489|0.173533|17.564848|6.927363|10.520741|7.463693|4.140832|0.040165|0.042709|0.043071|0.051550|0.061909|0.050598|0.080274|0.087838|0.085250|0.072105|0.076160|0.091712|0.066841|0.066878|0.078783|0.089903|0.132395|0.119919|0.171675|0.300974|0.299624|0.500000| |1.500244|1.669447|1.766423|1.968969|2.067500|1.919577|1.736117|3.641490|2.042599|3.305083|3.206374|2.788838|3.066463|0.084510|2.570195|2.360149|2.247390|1.950710|2.687708|0.049984|0.055934|2.174243|2.604549|3.904601|6.762904|6.656288|7.468854|0.219066|6.249587|9.431656|10.879309|26.089967|8.999473|0.039168|0.041738|0.040630|0.046885|0.062294|0.053846|0.074040|0.084087|0.069329|0.058069|0.059888|0.064643|0.051572|0.050358|0.057029|0.059201|0.076343|0.077573|0.125207|0.203885|0.136221|0.144630|0.500000| |1.443342|1.571269|1.642941|1.774660|1.825597|1.729879|1.612359|3.425663|1.815736|2.980884|2.751118|2.366999|2.620396|0.076966|2.234521|2.001610|2.076759|1.811542|2.476113|0.046269|0.052662|1.917778|2.239166|3.018461|4.905702|5.174295|4.604681|0.114486|4.159384|7.069209|12.598730|12.427590|17.635168|0.037487|0.040774|0.039313|0.044111|0.053163|0.048068|0.065658|0.067840|0.056508|0.050187|0.055925|0.061663|0.047163|0.048010|0.049647|0.052353|0.067466|0.063469|0.111528|0.121393|0.093609|0.117870|0.183331|0.500000| |1.536827|1.686719|1.745427|1.896856|1.994523|1.910329|1.761206|3.759655|1.903550|3.079258|2.883871|2.520434|2.678833|0.077861|2.232117|2.045897|2.057804|1.781089|2.390233|0.044681|0.050118|1.854127|2.171343|3.074683|5.026869|5.154176|4.499962|0.120660|3.709106|6.728796|11.526199|12.326619|17.592734|0.039945|0.043585|0.041392|0.046215|0.058432|0.053805|0.070793|0.073891|0.057939|0.051000|0.056383|0.060059|0.046895|0.047038|0.048669|0.049930|0.063865|0.061822|0.110049|0.106291|0.086571|0.099040|0.191882|0.301080|0.500000| 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