Version2.0 2020-01-23T07:50:57Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 27-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOC[C@@H](C[NH+](Cc1c(nn(c1Oc2ccc(cc2)OC)c3ccccc3)C)C[C@@H]4CCCO4)O C36304597 RHF 6-31G(d) (6D,7F) CCOC[C@@H](C[NH+](Cc1c(nn(c1Oc2ccc(cc2)OC)c3ccccc3)C)C[C@@H]4CCCO4)O C01[X(C28H38N3O5)] 216 C1 616 CCOC[C@@H](C[NH+](Cc1c(C)nn(c1Oc1ccc(cc1)OC)c1ccccc1)C[C@@H]1CCCO1)O CCOC[C@@H](C[NH+](Cc1c(C)nn(c1Oc1ccc(cc1)OC)c1ccccc1)C[C@@H]1CCCO1)O CCOC[C@H](O)C[NH+](C[C@@H]1CCCO1)Cc2c(C)nn(c3ccccc3)c2Oc4ccc(OC)cc4 InChIKey=JSGMJEWBLMJXOM-BVAGGSTKSA-O InChI=1S/C28H37N3O5/c1-4-34-20-23(32)17-30(18-26-11-8-16-35-26)19-27-21(2)29-31(22-9-6-5-7-10-22)28(27)36-25-14-12-24(33-3)13-15-25/h5-7,9-10,12-15,23,26,32H,4,8,11,16-20H2,1-3H3/p+1/t23-,26+/m1/s1 InChI=1/C28H37N3O5/c1-4-34-20-23(32)17-30(18-26-11-8-16-35-26)19-27-21(2)29-31(22-9-6-5-7-10-22)28(27)36-25-14-12-24(33-3)13-15-25/h5-7,9-10,12-15,23,26,32H,4,8,11,16-20H2,1-3H3/p+1/t23-,26+/m1/s1/fC28H38N3O5/h30H/q+1 CCOC[C@@H](C[NH+](Cc1c(nn(c1Oc2ccc(cc2)OC)c3ccccc3)C)C[C@@H]4CCCO4)O C01[X(C28H38N3O5)] 216 C01 616 CCOC[C@@H](C[NH+](Cc1c(C)nn(c1Oc1ccc(cc1)OC)c1ccccc1)C[C@@H]1CCCO1)O CCOC[C@@H](C[NH](Cc1c(C)nn(c1Oc1ccc(cc1)OC)c1ccccc1)C[C@@H]1CCCO1)O CCOC[C@H](O)C[NH](C[C@@H]1CCCO1)Cc2c(C)nn(c3ccccc3)c2Oc4ccc(OC)cc4 InChIKey=SBAKRSLZUZNPFG-BVAGGSTKSA-N InChI=1S/C28H38N3O5/c1-4-34-20-23(32)17-30(18-26-11-8-16-35-26)19-27-21(2)29-31(22-9-6-5-7-10-22)28(27)36-25-14-12-24(33-3)13-15-25/h5-7,9-10,12-15,23,26,30,32H,4,8,11,16-20H2,1-3H3/t23-,26+/m1/s1 InChI=1/C28H38N3O5/c1-4-34-20-23(32)17-30(18-26-11-8-16-35-26)19-27-21(2)29-31(22-9-6-5-7-10-22)28(27)36-25-14-12-24(33-3)13-15-25/h5-7,9-10,12-15,23,26,30,32H,4,8,11,16-20H2,1-3H3/t23-,26+/m1/s1 4035.4681595791 -1619.8475664 1-A 21920.7714 133 483 616 |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|A|A| -20.72117 -20.68652 -20.67777 -20.66938 -20.66901 -15.80957 -15.74518 -15.67421 -11.44681 -11.41744 -11.41739 -11.41424 -11.40815 -11.40617 -11.39697 -11.39009 -11.38736 -11.37533 -11.36566 -11.36250 -11.36151 -11.35509 -11.33799 -11.33640 -11.33296 -11.33195 -11.32705 -11.32595 -11.32305 -11.31452 -11.31369 -11.31114 -11.30833 -11.30746 -11.30511 -11.29370 -1.56380 -1.51528 -1.50857 -1.49976 -1.48468 -1.48334 -1.44626 -1.26760 -1.25260 -1.21205 -1.19884 -1.19434 -1.17404 -1.15328 -1.12717 -1.12378 -1.11167 -1.10448 -1.09810 -1.08016 -1.05814 -1.04510 -1.02962 -1.02206 -0.96345 -0.95805 -0.93731 -0.93119 -0.92736 -0.92193 -0.91932 -0.91371 -0.88483 -0.87136 -0.86180 -0.83862 -0.83173 -0.82071 -0.81750 -0.81035 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2157.41 2199.29 2209.54 2221.66 2227.91 2233.03 2253.16 2261.85 2265.21 2281.77 2288.36 2305.54 2326.48 2333.85 2337.74 2341.98 2343.54 2344.73 2345.72 2354.83 2358.44 2364.09 2364.76 2365.65 2375.17 2377.12 2378.91 2384.45 2393.89 2412.37 2421.33 2424.15 2429.50 2467.14 2553.69 2574.58 2587.73 2601.04 2621.53 4573.51 4600.38 4623.62 4624.14 4624.39 4633.36 4648.16 4653.69 4654.81 4656.19 4660.79 4675.76 4704.31 4710.44 4719.16 4720.27 4726.44 4734.45 4734.58 4742.23 4749.66 4775.60 4777.14 4804.64 4813.43 4828.30 4851.44 4852.48 4867.00 4869.80 4873.57 4885.69 4901.12 4908.07 4910.76 4913.39 5228.04 5850.77 0.684492 0.718401 0.719345 0.611165 -1619.163074 -1619.129165 -1619.128221 -1619.236401 3.628375D-04 MUNgauss RevisionA2.0 retrievium 23-Jan-2020 DUDE CCOC[C@@H](C[NH+](Cc1c(nn(c1Oc2ccc(cc2)OC)c3ccccc3)C)C[C@@H]4CCCO4)O C36304597 RHF 6-31G(d) (6D,10F) C1 496.281147 |X|Y|Z| 113.425925 80.757249 50.334411 77.253758 26 6 7 8 21 3 2 |36.858105| |12.581361|36.858105| |8.019919|13.493720|73.516695| |5.199046|8.048505|24.389730|36.858105| |4.080887|5.227975|14.610211|12.519520|36.858105| |4.026273|4.893107|13.283807|8.995769|17.551825|0.500000| |3.141381|3.907263|9.176079|7.553859|12.483112|0.244551|36.858105| |2.674040|3.127496|7.062617|4.974078|7.611787|0.182208|12.744956|53.358707| |2.755856|3.177586|7.218858|4.874662|7.382800|0.170152|9.381981|25.577197|0.500000| |2.521770|2.850302|6.376589|4.187065|6.172041|0.180574|7.609051|17.076686|0.256358|36.858105| |2.214243|2.421531|5.238951|3.264501|4.406115|0.126638|4.981335|10.321756|0.200947|12.802039|36.858105| |2.202324|2.345107|5.038407|3.003557|3.937364|0.112989|4.062790|7.562267|0.168782|7.259898|13.377979|36.858105| |1.922295|2.024974|4.228367|2.501655|3.118422|0.088702|3.260737|5.790270|0.125924|5.175333|8.502850|14.704846|53.358707| |1.791399|1.908703|3.949684|2.383842|2.940571|0.083408|3.218102|5.768632|0.118358|5.228926|8.686912|8.971626|19.220986|53.358707| 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|8.833229|17.523282|16.537414|7.258480|4.787021|0.118130|3.785399|4.145311|0.086822|2.696946|2.315742|2.243770|2.658852|2.514833|2.004089|3.355353|1.845677|1.780432|1.699341|1.676277|1.730289|1.816564|2.806331|1.516702|1.628250|1.554833|1.398808|1.322494|1.367645|1.512129|2.460894|2.620734|2.649087|0.081293|2.207781|2.052089|2.309857|4.812657|8.025112|0.173197|0.211810|0.212254|0.301093|0.500000| |4.710064|7.124213|16.492097|17.496380|8.814180|0.216376|6.795931|6.112814|0.116317|3.937132|3.051296|2.753105|3.168665|3.075815|2.576884|4.375537|2.470374|2.395103|2.291379|2.255545|2.317754|2.425356|3.727962|1.980003|1.942486|1.795286|1.594293|1.522807|1.610552|1.818522|2.876919|3.638447|3.350476|0.103038|2.669539|2.377152|2.586273|5.680786|10.134338|0.125493|0.115696|0.111439|0.214178|0.174422|0.500000| |4.740062|7.204882|16.551245|17.499819|8.848103|0.174804|6.959038|6.453545|0.132349|3.784488|3.044328|2.817574|3.244789|3.106421|2.563478|4.296158|2.336774|2.255240|2.105665|2.034391|2.093892|2.241841|3.332512|1.759578|1.964855|1.850021|1.637206|1.541995|1.607685|1.807206|2.998320|3.895717|3.908870|0.125868|3.012085|2.683404|3.046573|6.859560|12.633254|0.116299|0.126038|0.112156|0.176193|0.217592|0.299632|0.500000| |2.940044|3.637998|8.178783|6.526145|8.763611|0.217572|17.608992|12.360480|0.181905|7.129348|4.629394|3.677319|4.122647|4.186361|3.809364|6.632047|3.745257|3.626860|3.299100|3.109565|3.183965|3.477418|4.864079|2.460714|2.550431|2.276522|1.977521|1.892554|2.042609|2.377096|3.481009|6.810162|5.077150|0.148450|3.764569|3.179815|3.312439|7.734421|10.326854|0.080930|0.078401|0.072096|0.101128|0.096450|0.189947|0.161533|0.500000| |3.068032|3.875960|8.656003|7.211311|8.891962|0.174368|17.649657|12.462452|0.220741|5.595278|4.154350|3.525017|3.990699|3.955504|3.449689|5.876442|3.116086|3.022032|2.700807|2.509540|2.563836|2.836371|3.975606|2.030490|2.441287|2.253305|1.957895|1.839869|1.939328|2.223942|3.454243|7.472765|6.984021|0.238379|4.568652|3.740201|4.134860|10.502113|12.499621|0.080930|0.084058|0.075310|0.102610|0.109377|0.178197|0.219545|0.300994|0.500000| |2.824931|3.175535|7.346056|4.688554|7.315156|0.245660|7.371841|12.402918|0.218670|17.675099|8.988985|6.749114|6.442635|6.091364|5.669328|8.289028|4.467695|3.706985|3.259648|3.272947|3.760879|4.511393|4.924269|2.582255|3.363391|2.894750|2.406953|2.264488|2.470859|3.009237|6.290651|5.607313|4.183982|0.107445|3.274030|3.126236|3.359183|7.546020|11.748559|0.081007|0.078393|0.067950|0.084217|0.081391|0.120860|0.111983|0.189852|0.146701|0.500000| |2.364960|2.685789|5.856917|3.889728|5.319793|0.158703|6.876771|12.388082|0.181354|17.632265|8.886121|5.495715|5.955524|6.446068|6.871123|11.620561|6.718779|5.486588|4.543405|4.342163|4.882987|6.136456|6.159290|3.055848|3.622699|3.004079|2.518601|2.425742|2.720075|3.365995|4.453773|7.117839|4.583307|0.114792|3.697842|3.368842|3.357433|7.414529|8.182356|0.067013|0.064749|0.058513|0.073399|0.070529|0.106824|0.097743|0.211304|0.144523|0.302046|0.500000| |1.628667|1.804875|3.623524|2.317867|2.685902|0.074662|3.288899|5.224514|0.092439|4.138220|4.135457|3.235154|4.323955|5.346599|4.985666|13.318155|8.933861|17.732223|8.922718|5.626218|4.954106|5.660639|7.604195|3.326188|3.679944|3.051985|2.745581|2.833877|3.313810|3.897667|2.634039|4.644768|3.632024|0.090030|3.718622|3.335265|2.859963|5.502518|4.464706|0.045484|0.044704|0.041913|0.050077|0.049076|0.065156|0.062688|0.098808|0.085836|0.095243|0.136612|0.500000| |1.528510|1.683535|3.314577|2.090546|2.330429|0.066517|2.721034|3.953776|0.070829|3.181974|3.031770|2.503250|3.316134|3.860905|3.365944|7.546991|5.653157|8.923186|17.744234|8.945629|5.665847|4.960317|13.511592|4.874852|2.701526|2.302819|2.142925|2.260936|2.633398|2.950091|2.151024|3.178718|2.622122|0.068859|2.600567|2.352328|2.125731|4.096870|3.773376|0.043127|0.041365|0.039704|0.047658|0.045340|0.060559|0.055776|0.084795|0.070754|0.079107|0.106047|0.213638|0.500000| |1.678048|1.791428|3.594573|2.165596|2.491977|0.076198|2.664420|3.929052|0.072441|3.623892|3.622871|3.110113|4.104109|4.621091|3.877576|7.435525|5.677563|4.957100|5.634707|8.881059|17.769033|8.960137|12.470138|7.405242|3.102790|2.533540|2.300753|2.421304|2.902561|3.427272|2.681799|2.761123|2.264635|0.058974|2.117015|2.042123|1.966675|3.827919|4.091232|0.048806|0.045560|0.043002|0.050296|0.046797|0.061792|0.055398|0.080623|0.065509|0.097673|0.116897|0.107621|0.124197|0.500000| |1.810226|1.936395|3.989405|2.415511|2.931053|0.088900|3.177397|5.133290|0.095439|5.232080|6.108659|4.966640|6.650243|8.082052|7.190039|12.522650|8.917788|5.639681|4.959270|5.644104|8.919281|17.731886|7.449533|3.903237|4.889544|3.626553|3.081392|3.151131|3.878471|5.204571|3.823281|3.546631|2.810458|0.070432|2.591364|2.576931|2.489929|4.869172|4.996154|0.052221|0.050037|0.045784|0.053098|0.050846|0.066587|0.061997|0.092103|0.076656|0.133376|0.161174|0.124272|0.107672|0.217638|0.500000| |1.419932|1.517280|2.927509|1.762528|1.905860|0.056647|2.037338|2.828157|0.052601|2.345861|2.247817|1.993835|2.641690|2.892808|2.351937|4.601737|3.189146|3.416359|4.421681|5.888283|4.895667|3.610706|16.990390|17.664306|2.035909|1.775756|1.682063|1.783261|2.046475|2.225490|1.808940|2.064590|1.779815|0.047852|1.708724|1.612004|1.538207|2.949930|3.092333|0.041027|0.038041|0.037207|0.043535|0.040036|0.051629|0.045921|0.062505|0.052265|0.063614|0.074053|0.082135|0.121644|0.145135|0.088870|0.500000| |1.433274|1.522111|2.970475|1.779132|1.964497|0.058721|2.094313|2.990585|0.055897|2.555207|2.529257|2.250131|3.026311|3.360490|2.708336|5.297987|3.759931|3.814395|4.796343|7.074511|6.711728|4.576456|16.433106|17.570895|2.382156|2.036063|1.924965|2.066781|2.430492|2.671854|2.006473|2.171079|1.854270|0.049099|1.780736|1.707901|1.628484|3.109670|3.233896|0.041494|0.038727|0.037319|0.043174|0.040105|0.051328|0.046232|0.063353|0.053205|0.068980|0.080280|0.088637|0.120968|0.220726|0.112966|0.299930|0.500000| |1.604250|1.716066|3.360666|2.021610|2.224117|0.067622|2.356191|3.275384|0.060423|2.817958|2.662107|2.334437|3.040690|3.308608|2.733910|5.246279|3.723657|3.766169|4.725058|6.993042|6.693018|4.546199|16.424475|17.563868|2.263703|1.943630|1.805867|1.891387|2.181939|2.442849|2.113695|2.322503|1.960114|0.052497|1.840743|1.739692|1.680219|3.269152|3.571350|0.046767|0.042902|0.041630|0.049190|0.044778|0.059277|0.051810|0.072881|0.059089|0.077612|0.090327|0.087489|0.119082|0.223837|0.112523|0.300072|0.298564|0.500000| |1.576508|1.652687|3.331595|1.970213|2.319474|0.063883|2.471259|4.160007|0.090086|3.272946|4.331457|5.068259|9.863103|9.904677|5.048044|7.514570|3.313395|2.810840|2.373157|2.269329|2.512477|3.062541|3.486301|1.836432|8.934774|17.759203|8.894276|5.637221|4.954684|5.643807|4.065028|3.137498|2.990144|0.071290|3.024100|3.697139|3.602666|5.912368|4.503424|0.043898|0.045465|0.040284|0.043638|0.045205|0.051411|0.053815|0.064435|0.065230|0.082616|0.082859|0.078591|0.059647|0.065293|0.092232|0.046411|0.052506|0.051005|0.500000| |1.309677|1.363420|2.686349|1.579582|1.797192|0.049676|1.908881|3.055513|0.064384|2.371365|2.883706|3.117544|5.304613|5.705097|3.351754|5.619304|2.675099|2.389780|2.085277|1.997325|2.156959|2.506800|3.141698|1.667144|5.663459|8.947739|17.727984|8.908932|5.649798|4.951053|2.689538|2.351195|2.278933|0.056081|2.397735|2.825656|2.646708|4.307591|3.399776|0.036487|0.037531|0.033923|0.036373|0.037426|0.041876|0.043366|0.050919|0.051143|0.060909|0.062761|0.067354|0.053541|0.056646|0.073418|0.042680|0.048242|0.045550|0.214813|0.500000| |1.201015|1.252824|2.452653|1.447689|1.632416|0.045658|1.745654|2.743877|0.056118|2.171487|2.569876|2.631075|4.295858|4.923725|3.068185|5.514225|2.772708|2.526670|2.249361|2.166615|2.317880|2.632158|3.427894|1.821334|4.963297|5.643524|8.910076|17.728822|8.917885|5.642367|2.255492|2.124692|2.004648|0.050020|2.112868|2.354069|2.157318|3.636414|3.001485|0.033660|0.034035|0.031255|0.033826|0.034223|0.039003|0.039491|0.047684|0.046528|0.055798|0.059525|0.070418|0.057947|0.060928|0.075614|0.046669|0.053661|0.048823|0.123977|0.214666|0.500000| |1.268033|1.331929|2.624328|1.562135|1.776997|0.050428|1.921408|3.028149|0.060262|2.488436|2.945318|2.867968|4.596048|5.671639|3.690156|7.049899|3.734821|3.338157|2.974525|2.900233|3.152279|3.607583|4.478297|2.358632|5.665600|4.952202|5.648857|8.914172|17.728654|8.943970|2.380135|2.339323|2.111125|0.052694|2.184355|2.333706|2.126473|3.726616|3.192814|0.035791|0.035596|0.032891|0.036264|0.036081|0.042564|0.042123|0.053551|0.050386|0.063352|0.070358|0.089580|0.074678|0.081731|0.102105|0.059277|0.071111|0.062111|0.107569|0.124132|0.214787|0.500000| |1.503556|1.595011|3.209843|1.932406|2.270787|0.065352|2.490258|4.075079|0.079439|3.587583|4.526402|4.154982|6.715961|9.673945|6.442275|12.566977|6.510676|4.882157|4.036401|3.984270|4.739436|6.361673|5.677365|2.924199|8.899393|5.632511|4.953836|5.647608|8.927475|17.760803|3.177142|3.094126|2.627601|0.064459|2.615206|2.746648|2.528433|4.610605|4.043469|0.042653|0.042095|0.038543|0.043381|0.042822|0.052580|0.051377|0.069789|0.063473|0.088759|0.102736|0.121970|0.094184|0.117054|0.188112|0.070609|0.087316|0.078512|0.124143|0.107554|0.124234|0.216091|0.500000| |2.667524|2.754222|6.074577|3.389013|4.447371|0.136445|3.954022|6.330890|0.142792|5.742432|6.402129|8.887951|8.260573|6.244359|4.639900|6.341108|3.248273|2.694265|2.411071|2.468330|2.872489|3.400031|3.834039|2.090840|3.497815|3.172655|2.598050|2.360672|2.488398|2.980874|17.544297|3.588237|3.144397|0.080275|2.643455|2.757081|3.094160|6.323552|9.249146|0.077267|0.077814|0.064367|0.070579|0.071063|0.084490|0.084887|0.098712|0.093791|0.193059|0.125427|0.070462|0.059638|0.078456|0.108948|0.052215|0.057908|0.062031|0.094621|0.066759|0.058074|0.062621|0.083731|0.500000| |2.291299|2.342478|4.961157|2.781776|3.457417|0.098869|3.250439|5.328436|0.124652|4.411008|5.482190|8.994914|10.292716|6.763552|4.452905|6.036794|2.954546|2.473812|2.187019|2.198313|2.515476|2.991392|3.428040|1.860888|3.903970|3.775044|3.015394|2.623641|2.668909|3.154104|17.620687|3.294676|3.047407|0.076303|2.660218|2.930769|3.345109|6.407356|7.387126|0.064958|0.067868|0.056463|0.059881|0.062187|0.069494|0.072855|0.080846|0.081356|0.129263|0.100079|0.066116|0.054618|0.068119|0.094885|0.046855|0.052139|0.054107|0.119536|0.078621|0.064132|0.065687|0.084478|0.301271|0.500000| |2.713183|2.863860|6.351845|3.640420|4.857160|0.132858|4.437944|7.519811|0.196439|5.743265|6.389583|8.853949|8.206679|6.194483|4.610577|6.337744|3.088592|2.630206|2.305238|2.275922|2.554374|3.027694|3.539469|1.892453|3.491878|3.310297|2.677258|2.367055|2.433500|2.879091|17.566734|4.228170|3.918653|0.098067|3.182246|3.418630|4.133962|8.675817|11.708521|0.075637|0.080826|0.065521|0.071826|0.076300|0.087350|0.095239|0.103641|0.109192|0.171931|0.120556|0.071154|0.057820|0.067946|0.092479|0.047768|0.052077|0.055258|0.103350|0.069870|0.058258|0.060588|0.078628|0.301966|0.300750|0.500000| |2.072520|2.343936|4.934289|3.267344|4.159028|0.107438|5.671016|12.432909|0.213176|7.562305|7.424147|5.236629|6.251749|7.118669|7.227313|13.064090|5.495636|4.973646|3.768851|3.266269|3.406269|4.232362|4.797053|2.357020|4.150952|3.613508|2.968290|2.754929|2.974135|3.619418|4.087280|17.697404|8.891578|0.174239|7.162189|6.247881|5.553494|12.530407|7.347599|0.056850|0.058109|0.052122|0.062726|0.064489|0.086059|0.090144|0.146595|0.147518|0.148976|0.198276|0.150537|0.093665|0.081957|0.111614|0.059050|0.063403|0.066340|0.102308|0.074415|0.067016|0.074620|0.102221|0.101936|0.096587|0.118101|0.500000| |2.210271|2.584106|5.417545|3.801034|4.679106|0.117317|7.406433|12.325890|0.183172|6.519823|5.117110|3.853548|4.561913|4.970221|4.726519|9.037306|4.670142|4.760958|3.876310|3.310694|3.283332|3.777187|4.989292|2.419611|3.066139|2.722944|2.347060|2.238558|2.419193|2.835074|3.318639|17.604273|8.724172|0.215050|6.438993|4.731116|4.389096|10.233769|7.444260|0.060229|0.060761|0.055749|0.070515|0.071443|0.103894|0.106081|0.212921|0.203274|0.140091|0.196670|0.144699|0.100040|0.079264|0.096256|0.061341|0.063336|0.068587|0.076416|0.059889|0.055872|0.062711|0.082144|0.087539|0.079032|0.097555|0.301376|0.500000| |1.790197|2.021872|4.052494|2.656197|3.035180|0.076768|3.894715|6.340917|0.122098|3.831110|3.760061|3.193585|4.141631|4.586636|3.901671|7.593142|3.615267|3.761877|3.064702|2.591935|2.545826|2.910804|4.009165|1.968888|3.082712|2.915277|2.577876|2.421228|2.515646|2.821240|2.759927|7.276615|8.660527|0.188166|17.576711|8.656736|5.731540|10.458106|5.379518|0.048287|0.050148|0.046066|0.054527|0.057291|0.071097|0.077180|0.103494|0.116279|0.088897|0.106238|0.124669|0.082246|0.062472|0.075769|0.050807|0.052875|0.054299|0.082451|0.067045|0.060996|0.064555|0.077573|0.070007|0.069577|0.081046|0.208283|0.193998|0.500000| |1.849370|2.096563|4.143881|2.705884|2.983117|0.073393|3.690631|5.606779|0.114900|3.259869|3.147763|2.825954|3.627838|3.808178|3.101250|5.667451|2.780751|2.831469|2.427650|2.131569|2.111885|2.365479|3.381498|1.698132|2.568866|2.517073|2.253389|2.088253|2.118608|2.329584|2.580110|5.608591|8.815560|0.227995|17.586216|8.798462|6.766233|11.528708|5.434650|0.049092|0.052217|0.047828|0.055946|0.060748|0.071186|0.081617|0.094389|0.117309|0.079276|0.087432|0.088902|0.065755|0.053098|0.063021|0.044273|0.045616|0.047235|0.073151|0.060131|0.053363|0.054530|0.063445|0.065427|0.065829|0.078060|0.143581|0.144733|0.302663|0.500000| 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