Version2.1 2021-01-15T09:25:05Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 11-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE COc1cccc(c1OC)[C@@H](CNC(=O)[C@@H]2CC(=O)N(C2)C3CC3)C4=c5ccccc5=[NH+]C4 C63403900 RHF 6-31G(d) (6D,7F) COc1cccc(c1OC)[C@@H](CNC(=O)[C@@H]2CC(=O)N(C2)C3CC3)C4=c5ccccc5=[NH+]C4 C01[X(C26H30N3O4)] 183 C1 555 COc1c(OC)cccc1[C@H](C1=c2ccccc2=[NH+]C1)CNC(=O)[C@@H]1CC(=O)N(C1)C1CC1 COc1c(OC)cccc1[C@H](C1=c2ccccc2=[NH+]C1)CNC(=O)[C@@H]1CC(=O)N(C1)C1CC1 COc1cccc([C@@H](CNC(=O)[C@H]2CN(C3CC3)C(=O)C2)C4=C5C=CC=CC5=[NH+]C4)c1OC InChIKey=OBULYQDXKCMWAJ-IIBYNOLFSA-O InChI=1S/C26H29N3O4/c1-32-23-9-5-7-19(25(23)33-2)21(20-13-27-22-8-4-3-6-18(20)22)14-28-26(31)16-12-24(30)29(15-16)17-10-11-17/h3-9,16-17,21H,10-15H2,1-2H3,(H,28,31)/p+1/t16-,21-/m1/s1 InChI=1/C26H29N3O4/c1-32-23-9-5-7-19(25(23)33-2)21(20-13-27-22-8-4-3-6-18(20)22)14-28-26(31)16-12-24(30)29(15-16)17-10-11-17/h3-9,16-17,21H,10-15H2,1-2H3,(H,28,31)/p+1/t16-,21-/m1/s1/fC26H30N3O4/h27-28H/q+1 COc1cccc(c1OC)[C@@H](CNC(=O)[C@@H]2CC(=O)N(C2)C3CC3)C4=c5ccccc5=[NH+]C4 C01[X(C26H30N3O4)] 183 C01 555 COc1c(OC)cccc1[C@H](C1=c2ccccc2=[NH+]C1)CNC(=O)[C@@H]1CC(=O)N(C1)C1CC1 CO[C]1[C]([CH][CH][CH][C]1[C@H](C1=[C]2[CH]=[CH][CH]=[CH][C]2[NH]C1)CNC(=O)[C@@H]1CC(=O)N(C1)C1CC1)OC CO[C]1[CH][CH][CH][C]([C]1OC)[C@@H](CNC(=O)[C@H]2CN(C3CC3)C(=O)C2)C4=C5C=CC=C[C]5NC4 InChIKey=MDOOHPHAQGNODD-IIBYNOLFSA-N InChI=1S/C26H30N3O4/c1-32-23-9-5-7-19(25(23)33-2)21(20-13-27-22-8-4-3-6-18(20)22)14-28-26(31)16-12-24(30)29(15-16)17-10-11-17/h3-9,16-17,21,27H,10-15H2,1-2H3,(H,28,31)/t16-,21-/m1/s1 InChI=1/C26H30N3O4/c1-32-23-9-5-7-19(25(23)33-2)21(20-13-27-22-8-4-3-6-18(20)22)14-28-26(31)16-12-24(30)29(15-16)17-10-11-17/h3-9,16-17,21,27H,10-15H2,1-2H3,(H,28,31)/t16-,21-/m1/s1/f/h28H 3552.3058377848 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2311.95 2314.41 2330.33 2332.54 2339.32 2351.47 2360.11 2369.69 2374.92 2377.58 2384.71 2392.94 2397.48 2402.77 2409.22 2449.79 2505.03 2543.82 2570.59 2587.21 2655.67 2777.60 2834.00 4615.35 4635.13 4647.80 4661.81 4684.34 4689.10 4709.62 4736.36 4756.43 4762.01 4768.36 4772.01 4772.20 4777.42 4788.87 4801.03 4801.78 4814.48 4838.47 4860.61 4885.78 4886.29 4893.72 4897.12 4909.25 4917.64 4924.49 4924.97 5576.54 5582.08 0.567721 0.596684 0.597629 0.505033 -1464.055499 -1464.026536 -1464.025592 -1464.118187 3.105652D-04 MUNgauss RevisionA2.0 retrievium 15-Jan-2021 DUDE COc1cccc(c1OC)[C@@H](CNC(=O)[C@@H]2CC(=O)N(C2)C3CC3)C4=c5ccccc5=[NH+]C4 C63403900 RHF 6-31G(d) (6D,10F) C1 448.223632 |X|Y|Z| 49.701025 37.174589 108.503436 58.526381 27 6 7 24 3 |36.858105| |13.543340|73.516695| |7.998977|25.235696|36.858105| |6.726123|14.040118|13.764447|36.858105| |4.517702|9.257300|7.930857|13.735098|36.858105| |3.792298|8.217338|6.847589|7.937225|13.828939|36.858105| 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|2.006637|4.113855|2.673363|2.602018|2.976370|3.770455|4.022259|3.221161|5.558065|2.740270|5.455044|0.130259|6.879020|11.605249|15.811643|73.516695| |1.769971|3.588135|2.248732|2.148720|2.360329|2.843988|3.101813|2.663180|4.826526|2.400921|4.066486|0.111649|5.003128|10.650342|12.492199|14.075545|36.858105| |1.727509|3.477286|2.173320|2.090220|2.296374|2.739735|2.945533|2.542904|4.577123|2.259012|3.750352|0.104429|4.764337|9.917584|8.922980|10.737451|17.575718|0.500000| |1.763725|3.594188|2.209082|2.062119|2.204665|2.614902|2.948039|2.631757|4.969261|2.520804|3.859637|0.112120|4.251179|8.295207|7.553721|10.153534|12.362744|0.241674|36.858105| |1.660707|3.359596|2.050825|1.923971|2.049472|2.398191|2.669029|2.410477|4.537754|2.380362|3.381057|0.095248|3.555348|6.238418|5.923931|9.557590|7.890212|0.159300|12.526878|36.858105| |1.636476|3.307148|1.991381|1.850885|1.941807|2.240952|2.514138|2.328560|4.462339|2.402621|3.115579|0.088988|3.117677|5.167384|4.535428|7.648326|5.346340|0.118884|7.878698|15.898602|73.516695| |1.581001|3.167941|1.948863|1.863786|2.014502|2.353399|2.541566|2.259352|4.137009|2.165042|3.153303|0.085660|3.444052|5.929791|6.047514|10.568203|8.118481|0.162534|8.209858|14.079491|14.806825|53.358707| |1.592985|3.183444|1.978562|1.915443|2.101763|2.475669|2.626076|2.288085|4.111003|2.103796|3.264815|0.087690|3.827164|6.900750|7.519620|12.109530|12.416421|0.242865|7.957535|8.119951|9.664542|17.858763|36.858105| |1.456395|2.886133|1.761612|1.697946|1.826977|2.094541|2.225027|2.005252|3.650365|1.949086|2.656779|0.071588|2.832202|4.565604|4.336639|8.139615|5.120506|0.115654|5.145980|7.752476|11.701000|18.140149|7.591465|36.858105| |1.454370|2.867822|1.761552|1.720184|1.868472|2.134787|2.222674|1.987156|3.551876|1.903086|2.601534|0.068329|2.770480|4.274904|4.026140|8.202864|4.272060|0.099239|3.989277|5.234214|8.318129|10.312413|5.941716|12.704060|36.858105| |1.475146|2.922488|1.776878|1.708561|1.826806|2.079686|2.214059|2.015707|3.677901|2.002262|2.605168|0.069694|2.669770|4.119948|3.767532|7.409350|4.021943|0.092567|4.170152|6.036428|10.773859|10.287283|5.093065|12.783148|12.736744|36.858105| |2.811977|6.206958|4.209779|3.761327|4.138820|5.591525|7.625171|5.856204|10.317038|4.827087|12.653261|0.252528|7.550259|8.533791|5.735331|11.008333|4.133212|0.100020|4.050851|3.813875|6.375998|4.823914|3.476581|3.015318|2.994678|3.068691|36.858105| |2.565035|5.586595|3.554392|3.117432|3.268371|4.053745|5.238187|4.699561|9.310853|4.813095|7.412720|0.199011|5.364386|7.194513|5.204352|9.641095|4.128419|0.097500|4.442975|4.379359|7.709040|5.220416|3.527824|3.259577|3.141831|3.399612|14.051768|36.858105| |2.458455|5.332392|3.245475|2.787984|2.831394|3.381765|4.342414|4.204598|9.121902|4.851590|5.846530|0.186872|4.528851|6.542370|4.592578|7.773347|4.022440|0.096751|4.783906|4.565621|8.452557|5.055431|3.363536|3.121408|2.870152|3.189006|7.430510|13.199241|36.858105| |2.167808|4.568017|2.703259|2.366270|2.384885|2.755383|3.349957|3.308340|6.983898|3.984506|4.163841|0.127068|3.501399|5.170120|3.848330|6.631716|3.630108|0.087263|4.521602|4.722433|9.706013|5.070638|3.204174|3.232819|2.914621|3.399456|5.139695|7.955834|14.210024|36.858105| |2.002234|4.141203|2.457021|2.202732|2.239759|2.559931|2.999457|2.921402|5.868850|3.422625|3.599871|0.103033|3.117328|4.537842|3.556808|6.487311|3.363985|0.079927|4.018868|4.648461|9.991541|5.224377|3.165830|3.519779|3.247521|3.979833|4.651880|6.883182|7.868173|13.170212|36.858105| |2.047547|4.228906|2.557991|2.329980|2.406312|2.770953|3.196078|3.034783|5.859050|3.388394|3.803447|0.103106|3.284280|4.642323|3.726369|7.232380|3.363047|0.079174|3.752792|4.377319|8.721542|5.305149|3.243301|3.662409|3.588873|4.335114|5.292093|7.658256|6.614932|7.712160|14.057808|36.858105| |2.303353|4.856070|3.039278|2.762677|2.909489|3.475390|4.108996|3.741237|7.056036|3.914957|5.097713|0.131001|4.177437|5.666463|4.480055|9.038909|3.711828|0.086888|3.932080|4.281863|7.800344|5.333512|3.442743|3.523159|3.535117|3.943373|8.417791|13.208367|7.648231|6.818271|8.076784|13.458827|36.858105| |2.336122|4.873784|3.127553|2.943961|3.195013|3.845079|4.313610|3.767323|6.628564|3.612369|5.064892|0.120842|4.278047|5.481648|4.365171|9.492166|3.483507|0.082754|3.442944|3.688022|6.440071|4.918764|3.311431|3.333470|3.548607|3.728605|8.270497|8.451094|5.295245|4.657613|5.259892|7.722974|14.501685|53.358707| |2.154319|4.396398|2.784255|2.677710|2.905546|3.385992|3.629053|3.225711|5.618439|3.117377|4.066302|0.098794|3.620794|4.699706|3.814090|8.362065|3.157152|0.075663|3.091549|3.397079|5.976242|4.678116|3.128249|3.314120|3.681190|3.840414|5.830613|5.927351|4.238290|3.954045|4.647298|6.823896|9.287094|26.032415|0.500000| |2.626462|5.582677|3.780060|3.610744|4.117065|5.366644|6.037722|4.733420|7.758455|3.930284|7.188253|0.151266|5.787054|6.624013|4.952603|10.848915|3.656628|0.088614|3.443219|3.439792|5.766371|4.620789|3.318374|3.026950|3.183910|3.183841|12.693418|8.208468|5.077661|4.102451|4.152426|5.196080|8.359432|17.896743|0.244218|36.858105| |17.664243|16.984041|5.886146|4.907986|3.622290|3.187186|3.406839|4.411334|7.529502|4.485434|2.798651|0.079554|2.377444|2.838814|1.874630|3.312527|1.674456|0.045420|1.687485|1.593895|2.813275|2.054308|1.511609|1.394670|1.385745|1.414717|2.572701|2.409624|2.360382|2.112687|1.947033|1.967015|2.174383|2.957567|0.055874|2.388821|0.500000| |17.577132|16.413508|6.983040|6.703235|4.553536|3.712073|3.748711|4.714132|7.263560|4.200934|2.940134|0.080067|2.499802|2.917336|1.941081|3.493497|1.706536|0.046060|1.691964|1.610578|2.824537|2.102759|1.552553|1.434253|1.444954|1.462432|2.731594|2.485362|2.339871|2.081541|1.957047|2.028312|2.281697|3.201718|0.060899|2.633395|0.300002|0.500000| |17.583462|16.431518|7.075075|6.751761|4.612919|3.775975|3.817502|4.785811|7.365887|3.921398|2.994607|0.083380|2.603429|3.029969|1.973564|3.482601|1.743194|0.047700|1.721936|1.608710|2.798368|2.094153|1.565542|1.414517|1.411491|1.421314|2.645086|2.390822|2.296482|2.024211|1.866496|1.905269|2.141938|2.967273|0.056011|2.470912|0.299976|0.298473|0.500000| |7.497993|12.578872|8.914308|17.772057|8.949013|5.661951|4.944181|5.630115|7.457675|3.779859|3.540804|0.091822|3.089481|3.428170|2.241543|4.056604|1.920197|0.052145|1.848048|1.736547|2.983700|2.299006|1.733146|1.554012|1.578070|1.566523|3.119121|2.671496|2.429185|2.108821|1.982103|2.088499|2.422751|3.505681|0.066291|3.054609|0.146410|0.226587|0.223602|0.500000| |3.918270|7.466547|5.651890|8.939301|17.732402|8.945090|5.640347|4.953845|6.511970|3.147581|4.062442|0.097662|3.848119|4.054900|2.656128|4.914893|2.202972|0.059926|2.036406|1.906055|3.202813|2.583281|1.993081|1.738283|1.793457|1.735606|3.510364|2.842166|2.479755|2.131949|2.030139|2.187498|2.602412|3.928590|0.074635|3.627592|0.089150|0.112726|0.113803|0.216828|0.500000| |3.137497|6.519396|4.941094|5.659679|8.990473|17.741788|8.851059|5.628489|7.525313|3.411513|6.834286|0.142399|7.139037|6.369387|4.009219|7.547831|3.056039|0.081968|2.713501|2.487216|4.065109|3.391782|2.675069|2.213222|2.280244|2.177280|5.383784|3.894205|3.214772|2.652136|2.498722|2.731003|3.424145|5.277450|0.096177|5.496491|0.075163|0.086163|0.087591|0.124834|0.217006|0.500000| |4.588242|11.390468|6.306315|4.586581|3.977207|4.195104|5.408738|7.445247|16.376518|17.575429|4.736026|0.134247|3.424041|4.066130|2.717351|4.913059|2.334357|0.060502|2.421151|2.334925|4.195912|2.930558|2.080776|1.961545|1.944554|2.043876|4.991087|4.899312|4.564777|3.834328|3.471530|3.584174|4.211649|5.460317|0.096470|4.329270|0.120249|0.122464|0.105679|0.109407|0.091558|0.097635|0.500000| |5.416111|13.977623|6.172636|4.293869|3.552810|3.614640|4.543277|6.566143|16.416970|17.688802|4.004714|0.121781|3.060453|3.708251|2.427855|4.251713|2.144670|0.056778|2.244731|2.118114|3.804265|2.638935|1.894602|1.759986|1.718828|1.801289|3.823381|3.790091|3.889455|3.348995|2.924166|2.871216|3.212511|4.102589|0.074192|3.250406|0.154112|0.130400|0.122547|0.106321|0.082907|0.084639|0.299809|0.500000| |3.713353|8.764834|4.724804|3.572293|3.227820|3.526741|4.637696|5.921997|16.862531|17.627576|4.650715|0.147829|3.413229|4.278844|2.829734|4.932054|2.496995|0.064731|2.698792|2.562224|4.678450|3.108282|2.183637|2.048830|1.974309|2.111506|4.793117|5.250179|5.823492|4.834608|3.965699|3.756075|4.201281|4.990682|0.087480|3.809430|0.102241|0.094716|0.090100|0.086783|0.076029|0.085265|0.299629|0.299720|0.500000| |2.710051|5.728284|3.968332|3.864115|4.601975|6.464277|7.035779|4.990546|7.868962|3.371475|8.908100|0.215099|17.615382|12.579174|5.838960|9.079537|4.294498|0.120787|3.709290|3.079082|4.859684|4.058903|3.342956|2.494561|2.431001|2.340238|5.549742|4.270900|3.843774|3.058017|2.709673|2.800772|3.422706|4.741142|0.084215|4.495319|0.067884|0.070778|0.076284|0.089588|0.112017|0.195835|0.089078|0.083343|0.089108|0.500000| |2.498785|5.214956|3.621498|3.644918|4.542561|6.654382|6.571623|4.475272|6.973541|3.175002|8.690863|0.174175|17.662010|12.604280|7.399296|13.677215|4.717875|0.123530|3.848770|3.376910|5.248228|4.655663|3.851763|2.874257|2.906892|2.725751|6.847245|4.833602|3.921452|3.159190|2.936663|3.193556|4.082257|6.073630|0.107273|6.295232|0.062538|0.067387|0.068948|0.085108|0.113960|0.239174|0.088198|0.077144|0.084452|0.303232|0.500000| |2.182288|4.536494|2.917277|2.740819|3.033067|3.815655|4.362241|3.600225|6.464542|2.969403|6.179670|0.180857|9.042841|26.059048|9.381877|10.891987|7.501638|0.222140|6.212182|4.367965|6.483895|5.501329|4.735119|3.123371|2.857453|2.780898|5.001907|4.497811|4.439005|3.594175|3.088472|3.058338|3.578896|4.616055|0.082227|3.938556|0.056642|0.057174|0.060414|0.066336|0.076304|0.111958|0.077508|0.073321|0.083844|0.231491|0.184493|0.500000| |1.923214|3.976207|2.441876|2.235378|2.365809|2.828356|3.301355|2.973415|5.770201|2.894296|4.471533|0.136355|4.681947|9.084852|7.176970|9.676792|8.545585|0.189411|17.630509|8.827546|12.626198|8.171874|5.705965|4.222857|3.469596|3.707091|4.654399|5.299181|6.189529|5.553307|4.516608|4.071265|4.344852|4.987535|0.088949|3.704649|0.051169|0.050869|0.051905|0.055192|0.059815|0.079958|0.075998|0.070721|0.087426|0.112606|0.112239|0.192144|0.500000| |1.649387|3.327898|2.020401|1.890214|2.003292|2.332811|2.600552|2.366483|4.480807|2.292280|3.276622|0.096519|3.595854|6.666599|5.566253|7.830438|8.751646|0.221133|17.551109|8.984827|11.917780|8.966795|6.636434|4.578827|3.524776|3.676823|3.337728|3.619693|3.992560|3.897997|3.468331|3.183308|3.250215|3.926468|0.073205|2.885796|0.044113|0.043835|0.044942|0.047493|0.051742|0.066910|0.060747|0.057610|0.068177|0.091007|0.090834|0.147497|0.302645|0.500000| |1.479774|2.930779|1.805179|1.753210|1.910880|2.214135|2.328663|2.059365|3.705601|1.906741|2.819061|0.076816|3.281087|5.741659|5.563318|8.872248|8.787615|0.223501|6.598516|6.499788|8.400910|12.318610|17.523831|6.601099|5.114136|4.420624|2.928188|2.972251|2.907654|2.813809|2.766928|2.784188|2.894979|3.792934|0.073927|2.795363|0.039173|0.040014|0.040577|0.044436|0.050688|0.066122|0.052149|0.048247|0.054935|0.082516|0.091145|0.115097|0.134571|0.178226|0.500000| |1.594687|3.173763|1.988729|1.952368|2.171621|2.562672|2.656073|2.283210|4.023092|2.057571|3.248786|0.084701|3.872279|6.625830|7.267266|13.567157|8.708421|0.192240|5.747553|5.982861|7.913731|12.402411|17.662271|6.922536|6.550223|5.000232|3.480023|3.411864|3.123253|2.940738|2.962721|3.143315|3.408952|4.664928|0.091500|3.477834|0.041804|0.043449|0.043597|0.049107|0.057729|0.078379|0.057158|0.051500|0.058603|0.093384|0.113683|0.121433|0.127946|0.135527|0.300929|0.500000| |1.354999|2.666343|1.614965|1.558979|1.667692|1.890269|1.998460|1.820477|3.320931|1.779987|2.349480|0.064014|2.507036|4.016002|3.667423|6.647967|4.450285|0.106187|4.554842|6.343368|10.103635|12.261636|6.377842|17.680143|8.616566|8.651463|2.602331|2.797163|2.744736|2.867857|3.074596|3.114352|2.968242|3.824224|0.077730|2.589480|0.036193|0.037023|0.036669|0.039891|0.044275|0.055270|0.049514|0.045078|0.051975|0.062586|0.070226|0.078240|0.104053|0.120687|0.178010|0.158380|0.500000| |1.353308|2.644516|1.616500|1.589658|1.723321|1.943110|1.998446|1.799990|3.202114|1.723367|2.290109|0.060303|2.441892|3.704438|3.371168|6.727443|3.586876|0.086896|3.340485|4.159183|6.785905|7.631994|4.851751|8.595411|17.719294|8.564149|2.583592|2.676681|2.470777|2.513322|2.779144|3.036944|2.980495|4.123342|0.088294|2.759391|0.035881|0.037448|0.036587|0.040820|0.046347|0.057667|0.048949|0.043629|0.049423|0.060580|0.071436|0.069762|0.081604|0.084833|0.124991|0.149742|0.212063|0.500000| |1.548306|3.065332|1.905197|1.872244|2.060545|2.382831|2.460690|2.160292|3.811506|2.021939|2.898984|0.074515|3.130669|4.782646|4.634264|10.183319|4.592921|0.105298|4.050507|5.021717|7.742479|9.661573|6.213956|8.628367|17.714617|8.621984|3.376020|3.441269|3.026370|2.980589|3.287956|3.750178|3.890920|5.542303|0.117853|3.703472|0.040704|0.042820|0.041760|0.047436|0.054972|0.071673|0.057711|0.050424|0.057761|0.075056|0.093526|0.086439|0.099320|0.096685|0.139854|0.211350|0.171664|0.292121|0.500000| |1.590022|3.177666|1.936519|1.846079|1.968714|2.257885|2.438955|2.220985|4.081944|2.233978|2.904270|0.077490|2.899035|4.436219|4.038094|8.086456|4.109613|0.093008|4.381534|6.382002|12.007649|9.622185|4.821755|8.671634|8.603663|17.755577|3.555604|4.084017|3.757342|4.061874|5.018618|5.730266|4.999746|6.210001|0.129839|3.696811|0.042314|0.043794|0.042292|0.046732|0.051496|0.065177|0.063705|0.055198|0.065899|0.069540|0.081700|0.081970|0.112388|0.103766|0.112419|0.130646|0.172431|0.170642|0.211712|0.500000| |1.381813|2.717816|1.636496|1.573965|1.668473|1.873516|1.987656|1.836083|3.361672|1.852014|2.294217|0.061911|2.327037|3.536584|3.118981|5.999935|3.341726|0.079559|3.525087|4.857586|9.205958|7.622375|4.091526|8.651982|8.564937|17.724751|2.664554|2.954609|2.831697|3.079597|3.632430|3.861192|3.409925|4.384379|0.093144|2.758435|0.036999|0.038117|0.036961|0.040378|0.044195|0.054097|0.052530|0.046680|0.054346|0.057559|0.065699|0.067361|0.088590|0.089639|0.104097|0.110981|0.213677|0.208719|0.170774|0.292951|0.500000| |2.590918|5.689327|3.441503|2.898988|2.910437|3.473904|4.577935|4.544035|10.419431|5.198202|6.201795|0.227550|4.758560|6.861197|4.457630|7.180647|3.947437|0.098430|4.673494|4.128067|7.415929|4.605859|3.189240|2.822506|2.581611|2.801402|6.571625|8.715876|17.753566|9.028212|5.588310|4.819587|5.501359|5.841728|0.098215|4.428292|0.069288|0.067215|0.067693|0.069865|0.070213|0.090436|0.126850|0.116798|0.174647|0.116172|0.109366|0.135767|0.174030|0.111804|0.077990|0.081778|0.070248|0.062601|0.075430|0.088729|0.069767|0.500000| |2.057237|4.287146|2.487927|2.177843|2.172556|2.468682|2.962769|2.982497|6.346373|3.653404|3.579383|0.111603|3.099339|4.621605|3.394088|5.713659|3.343182|0.082381|4.268562|4.364630|9.180659|4.640928|2.958657|2.984958|2.646281|3.080542|4.105480|5.625914|9.043332|17.762389|8.778327|5.590486|4.929676|5.022582|0.090017|3.355369|0.056349|0.054514|0.053590|0.054475|0.054281|0.065923|0.095254|0.088176|0.124271|0.077368|0.077413|0.092408|0.144987|0.107455|0.074015|0.074549|0.075526|0.064367|0.073882|0.098855|0.079279|0.215350|0.500000| |1.828573|3.721988|2.177865|1.968955|1.991535|2.237512|2.569089|2.527938|5.039337|2.971840|2.999259|0.086051|2.670420|3.903657|3.070153|5.563468|3.011984|0.072644|3.614951|4.282313|9.652524|4.858206|2.913727|3.402242|3.107048|3.911827|3.686496|4.960206|5.660292|8.803759|17.735900|9.089416|5.703484|5.716548|0.108598|3.399111|0.049803|0.049751|0.047486|0.049818|0.050661|0.060872|0.083440|0.072501|0.094982|0.065753|0.070455|0.075154|0.109356|0.089802|0.072308|0.075460|0.084564|0.075076|0.084908|0.133562|0.103451|0.124089|0.215975|0.500000| |1.896293|3.848540|2.314577|2.145124|2.219381|2.511721|2.808473|2.671661|5.044330|2.940382|3.227272|0.086414|2.873053|4.034993|3.278002|6.474461|3.014143|0.071724|3.283238|3.913371|7.796660|4.971405|3.025175|3.635161|3.699748|4.564663|4.293934|5.497055|4.819441|5.522757|8.950281|17.753209|8.758614|9.241105|0.192924|4.542482|0.050702|0.052683|0.049114|0.054057|0.056841|0.069373|0.087418|0.070824|0.088678|0.069042|0.079364|0.074317|0.095456|0.079020|0.073034|0.082799|0.086320|0.088057|0.105942|0.168947|0.116237|0.105296|0.123237|0.216700|0.500000| |2.404784|4.998355|3.381210|3.355757|3.975252|5.233711|5.377398|4.094192|6.600393|3.294120|6.451992|0.135559|6.234747|7.164922|5.641394|13.708916|3.982282|0.096270|3.535168|3.514240|5.698102|4.930453|3.670519|3.218121|3.469263|3.311891|8.895064|6.239061|4.302504|3.581998|3.633433|4.426798|6.361717|12.407078|0.208855|17.611735|0.060718|0.066980|0.064004|0.079832|0.100665|0.163763|0.098071|0.078060|0.088790|0.131815|0.212927|0.114950|0.102129|0.082013|0.084779|0.110986|0.075907|0.083348|0.116285|0.104390|0.078615|0.107475|0.083543|0.084954|0.111525|0.500000| 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