Version2.1 2020-12-28T10:55:31Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 05-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCN1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1[C@@H]4C(=N[C@@H](N(C4=O)c5c(cc(cc5C)C)C)O)O C64165285 RHF 6-31G(d) (6D,7F) CCN1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1[C@@H]4C(=N[C@@H](N(C4=O)c5c(cc(cc5C)C)C)O)O C01[X(C26H31N4O3)] 186 C1 557 CCN1CCC2=c3c(=[NH+][C@@H]2[C@@H]1[C@@H]1C(=N[C@@H](N(C1=O)c1c(C)cc(cc1C)C)O)O)cccc3 CCN1CCC2=c3c(=[NH+][C@@H]2[C@@H]1[C@@H]1C(=N[C@@H](N(C1=O)c1c(C)cc(cc1C)C)O)O)cccc3 CCN1CCC2=C3C=CC=CC3=[NH+][C@@H]2[C@@H]1[C@@H]4C(=N[C@H](O)N(C4=O)c5c(C)cc(C)cc5C)O InChIKey=YIOMUQYKBNIGNC-ZRAZWPEBSA-O InChI=1S/C26H30N4O3/c1-5-29-11-10-18-17-8-6-7-9-19(17)27-21(18)23(29)20-24(31)28-26(33)30(25(20)32)22-15(3)12-14(2)13-16(22)4/h6-9,12-13,20-21,23,26,33H,5,10-11H2,1-4H3,(H,28,31)/p+1/t20-,21+,23+,26+/m1/s1 InChI=1/C26H30N4O3/c1-5-29-11-10-18-17-8-6-7-9-19(17)27-21(18)23(29)20-24(31)28-26(33)30(25(20)32)22-15(3)12-14(2)13-16(22)4/h6-9,12-13,20-21,23,26,33H,5,10-11H2,1-4H3,(H,28,31)/p+1/t20-,21+,23+,26+/m1/s1/fC26H31N4O3/h27,31H/q+1 CCN1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1[C@@H]4C(=N[C@@H](N(C4=O)c5c(cc(cc5C)C)C)O)O C01[X(C26H31N4O3)] 186 C01 557 CCN1CCC2=c3c(=[NH+][C@@H]2[C@@H]1[C@@H]1C(=N[C@@H](N(C1=O)c1c(C)cc(cc1C)C)O)O)cccc3 CCN1CCC2=[C]3[C]([NH][C@@H]2[C@@H]1[C@@H]1C(=N[C@@H]([N@@]([C]1=O)[C]1[C]([CH][C]([CH][C]1C)C)C)O)O)[CH]=[CH][CH]=[CH]3 CCN1CCC2=C3C=CC=C[C]3N[C@@H]2[C@@H]1[C@@H]4C(=N[C@H](O)N([C]5[C](C)[CH][C](C)[CH][C]5C)C4=O)O InChIKey=YUORNSOGEMZEBN-ZRAZWPEBSA-N InChI=1S/C26H31N4O3/c1-5-29-11-10-18-17-8-6-7-9-19(17)27-21(18)23(29)20-24(31)28-26(33)30(25(20)32)22-15(3)12-14(2)13-16(22)4/h6-9,12-13,20-21,23,26-27,33H,5,10-11H2,1-4H3,(H,28,31)/t20-,21+,23+,26+/m1/s1 InChI=1/C26H31N4O3/c1-5-29-11-10-18-17-8-6-7-9-19(17)27-21(18)23(29)20-24(31)28-26(33)30(25(20)32)22-15(3)12-14(2)13-16(22)4/h6-9,12-13,20-21,23,26-27,33H,5,10-11H2,1-4H3,(H,28,31)/t20-,21+,23+,26+/m1/s1/f/h31H 3594.9398982197 -1444.8239741 1-A 15002.9818 119 438 557 |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| -20.71794 -20.67315 -20.64334 -15.74346 -15.70029 -15.67317 -15.65586 -11.47091 -11.46430 -11.46389 -11.45616 -11.43076 -11.42468 -11.42151 -11.40386 -11.38882 -11.38696 -11.37845 -11.37303 -11.37236 -11.36898 -11.36603 -11.35301 -11.34162 -11.31973 -11.31815 -11.31043 -11.30357 -11.29978 -11.29182 -11.29072 -11.28948 -11.28241 -1.55643 -1.51899 -1.49818 -1.46168 -1.37652 -1.36596 -1.32198 -1.28935 -1.24926 -1.23099 -1.20243 -1.16889 -1.15573 -1.13657 -1.13493 -1.12351 -1.10582 -1.04816 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1962.27 1970.30 2013.18 2020.50 2023.83 2032.12 2061.14 2090.03 2093.43 2115.34 2129.63 2145.94 2155.71 2179.19 2212.69 2217.03 2221.48 2239.39 2249.78 2251.90 2255.83 2264.53 2270.22 2272.05 2282.34 2293.10 2315.86 2317.99 2320.00 2351.04 2353.04 2353.37 2354.75 2357.45 2358.98 2372.31 2373.22 2381.40 2400.01 2404.07 2409.18 2516.14 2552.60 2566.79 2601.24 2664.97 2721.94 2831.00 4604.37 4616.92 4619.66 4620.70 4626.75 4638.78 4648.25 4680.69 4692.53 4695.25 4702.42 4706.19 4717.26 4720.48 4722.73 4734.74 4736.57 4745.36 4766.03 4772.20 4776.91 4782.83 4838.06 4839.98 4875.45 4890.81 4909.07 4916.47 5347.22 5802.22 5872.85 0.580463 0.608445 0.609389 0.521468 -1444.243511 -1444.215529 -1444.214585 -1444.302506 2.948885D-04 MUNgauss RevisionA2.0 retrievium 28-Dec-2020 DUDE CCN1CCC2=c3ccccc3=[NH+][C@@H]2[C@@H]1[C@@H]4C(=N[C@@H](N(C4=O)c5c(cc(cc5C)C)C)O)O C64165285 RHF 6-31G(d) (6D,10F) C1 447.239616 |X|Y|Z| 99.132957 61.240967 37.750713 61.196759 25 6 7 21 4 |36.858105| |12.487854|36.858105| |7.671804|13.010734|53.358707| |5.955209|7.692001|17.875249|36.858105| |4.615375|5.129411|10.574434|12.387303|36.858105| |3.899632|4.524066|9.409886|7.851493|12.831698|36.858105| |3.056120|3.473664|6.450026|5.274151|7.344790|14.077655|36.858105| |2.595006|2.864610|4.981181|4.245644|5.707507|7.420563|13.198223|36.858105| |2.224035|2.445080|4.091889|3.329423|4.098726|5.140643|7.964232|14.211238|36.858105| |2.139365|2.375185|3.939189|3.042134|3.571784|4.656609|6.884751|7.855434|13.142383|36.858105| |2.339418|2.640783|4.451794|3.291962|3.798521|5.300904|7.647797|6.600871|7.705932|14.084508|36.858105| |2.830034|3.256232|5.833119|4.271701|5.121921|8.464491|13.187756|7.629729|6.810216|8.069500|13.408311|36.858105| |3.223616|3.801148|6.959277|4.588847|5.140983|8.291490|8.422996|5.284945|4.656778|5.265484|7.730607|14.544832|53.358707| |3.029424|3.589111|6.194877|3.942124|4.145354|5.866833|5.924920|4.236313|3.952628|4.642628|6.798316|9.267183|25.791696|0.500000| |4.213417|5.109950|10.829187|6.594035|7.419586|12.699408|8.186028|5.068030|4.100729|4.154265|5.199640|8.387203|17.928741|0.245745|36.858105| |4.433094|4.961783|9.631627|5.704209|6.623849|9.085281|6.397502|4.385012|3.627548|3.660667|4.454021|6.471180|12.497010|0.199018|17.527377|0.500000| |5.242253|7.639588|18.031132|7.639432|6.261707|7.423490|5.343471|3.871372|3.259205|3.291234|3.940394|5.398545|10.037666|0.186009|12.177860|0.248112|36.858105| |5.377073|7.418679|12.820314|5.683295|4.896682|5.578087|4.335617|3.281470|2.853529|2.938271|3.527012|4.590906|8.686515|0.177347|8.923490|0.233402|17.627711|0.500000| |3.965277|5.622526|9.895330|5.716303|4.703045|5.576433|4.745878|3.641427|3.209784|3.336940|4.007576|5.108651|8.778063|0.181749|7.268641|0.152265|12.002749|0.246532|36.858105| |3.426614|4.549019|8.173011|5.475860|4.848267|6.126261|5.635376|4.276970|3.779908|3.960329|4.800704|6.171822|9.742829|0.192533|7.179936|0.143675|8.643593|0.177818|17.584329|0.500000| |3.983666|5.848713|8.667209|5.395855|4.082178|4.296518|3.720501|3.083440|2.744468|2.774841|3.148523|3.759913|5.864249|0.119984|4.874627|0.112296|7.295130|0.170687|12.649667|0.253205|36.858105| |3.709466|5.199958|6.765197|4.186883|3.290106|3.400850|3.013479|2.570107|2.339447|2.386536|2.684109|3.091967|4.803616|0.101321|3.872853|0.094340|5.450958|0.144478|7.748245|0.166597|15.285419|53.358707| |3.481880|4.625143|5.933639|3.530590|2.927043|3.106090|2.784905|2.362141|2.183738|2.277288|2.605341|2.964666|4.745970|0.104567|3.709073|0.093276|5.086143|0.150367|6.716023|0.142674|8.243495|18.111450|36.858105| |2.969243|3.738853|4.783751|2.981557|2.528979|2.666604|2.448240|2.125713|1.995099|2.086727|2.356209|2.607171|4.061445|0.089608|3.090730|0.078730|3.963073|0.115632|5.043054|0.116797|6.114820|12.724577|17.681294|0.500000| |3.199486|4.121569|5.783476|3.432330|2.989362|3.351263|3.069244|2.549844|2.386177|2.563132|3.032894|3.445206|5.731044|0.134470|4.207537|0.104329|5.539367|0.168335|7.757376|0.165464|7.027785|10.704006|13.140795|0.259323|53.358707| |3.350637|4.377119|6.817548|4.006058|3.563894|4.245232|3.880218|3.081853|2.853333|3.107908|3.829269|4.546709|8.071627|0.198036|5.692242|0.132210|7.528803|0.214537|12.445147|0.250756|7.650474|9.135616|7.777294|0.163419|19.355674|36.858105| |2.968450|3.657772|5.809108|3.552998|3.378604|4.209534|4.049826|3.194464|3.032653|3.448740|4.467669|5.170646|9.583228|0.280944|5.748083|0.136058|6.253607|0.180631|8.022588|0.205639|5.295301|6.420551|5.341897|0.124522|11.578055|15.749718|73.516695| |2.672864|3.227976|4.461062|2.745386|2.484184|2.777613|2.621359|2.232580|2.138971|2.332817|2.743370|2.984000|4.839811|0.115757|3.404199|0.087760|4.061467|0.125259|5.005266|0.119666|4.612266|7.024348|7.708780|0.209921|17.922084|7.889456|12.395895|36.858105| |2.283110|2.708683|3.760660|2.415549|2.209526|2.455895|2.380197|2.081168|2.030717|2.226589|2.571762|2.698332|4.182430|0.098268|2.882742|0.073884|3.304988|0.097018|4.123148|0.105362|3.990595|6.084417|5.896616|0.183666|10.656029|5.766763|9.635109|13.667405|36.858105| |2.007258|2.308429|3.178779|2.069514|1.925664|2.123786|2.078029|1.846425|1.821213|2.000632|2.281895|2.346379|3.576745|0.083266|2.455891|0.064333|2.723507|0.080402|3.204673|0.083540|3.097784|4.642305|4.271530|0.132589|7.007239|4.189121|7.438477|7.975044|13.738930|36.858105| |1.982796|2.236066|3.052361|1.969536|1.848711|2.032378|1.976308|1.752372|1.724070|1.890515|2.158955|2.229561|3.430596|0.079911|2.370186|0.063495|2.599240|0.078571|2.916921|0.075248|2.769980|4.104797|3.790391|0.113285|6.138863|3.769292|6.861349|6.857756|7.866930|13.731500|36.858105| |2.225416|2.507972|3.403388|2.143083|2.007190|2.212217|2.116668|1.846932|1.795844|1.962696|2.268432|2.394168|3.785543|0.089022|2.646772|0.071925|2.934591|0.091831|3.201062|0.080409|2.967416|4.375975|4.178791|0.119015|6.971859|4.241031|7.736011|7.994380|6.870143|7.996998|13.737602|36.858105| |2.629764|3.056666|4.158257|2.537283|2.337684|2.597968|2.439162|2.081311|1.994380|2.172689|2.550744|2.771850|4.532617|0.108276|3.212498|0.086387|3.713262|0.119985|4.113312|0.099118|3.717277|5.508576|5.653606|0.151356|10.514109|5.899955|10.307273|13.683675|7.835685|6.845682|7.846781|13.722397|36.858105| |3.047251|3.481384|4.678344|2.752950|2.543693|2.812824|2.569640|2.157983|2.034204|2.191042|2.582107|2.890493|4.870813|0.114772|3.592261|0.100644|4.182656|0.145927|4.193563|0.098479|3.672039|5.266241|5.164917|0.127823|8.822945|5.626942|9.842184|7.488407|4.977335|4.438113|5.014195|7.599586|12.610729|36.858105| |1.729152|1.908799|2.599688|1.706051|1.619687|1.765562|1.731460|1.559834|1.547092|1.692038|1.902494|1.935605|2.918525|0.066835|2.018441|0.054631|2.165477|0.064767|2.373639|0.062306|2.273213|3.327753|2.932717|0.087265|4.521908|2.915238|5.357801|4.442429|5.006592|7.558953|12.612751|7.558969|5.000281|3.793043|36.858105| |2.204694|2.643950|3.720102|2.463695|2.239305|2.480032|2.436727|2.161338|2.120735|2.315080|2.632553|2.729760|4.094358|0.093821|2.817944|0.070566|3.220631|0.090075|4.232070|0.113199|4.315998|6.534394|5.597142|0.177768|9.045718|5.416142|8.742497|7.502863|12.594268|7.590982|5.014656|4.446183|4.982205|3.750308|3.790373|36.858105| |4.072213|5.335749|6.196900|3.524280|2.906106|3.003407|2.628787|2.226685|2.039230|2.104494|2.395246|2.753942|4.455224|0.096705|3.624793|0.095371|5.019175|0.161256|5.510748|0.117781|6.203873|11.196247|13.679336|0.261052|11.278939|6.018333|8.088633|6.167464|4.607787|3.682958|3.522506|4.094944|5.528178|5.821302|2.793756|4.108218|73.516695| |3.823727|5.369733|8.182572|6.080852|4.412967|4.384054|3.823166|3.281926|2.874095|2.804014|3.065418|3.631363|5.305821|0.103760|4.454560|0.102687|5.940936|0.133428|8.051266|0.214108|14.339052|11.593017|5.368362|0.125132|6.460224|5.224483|7.322220|3.518835|3.208591|2.601719|2.341813|2.464016|2.955631|2.939090|1.978494|3.558973|7.988441|73.516695| |17.566460|8.816461|9.425529|5.240153|4.496185|3.955858|3.100213|2.602591|2.238770|2.172677|2.398303|2.914032|4.597135|0.088284|4.438867|0.138385|5.235862|0.158193|3.807689|0.091834|3.614533|4.582374|3.293958|0.078243|4.285625|3.337850|5.399404|2.679979|2.266926|2.010359|2.013337|2.289012|2.703143|3.230740|1.759624|2.152586|6.883855|6.018933|0.500000| |17.557890|8.742942|9.347882|6.397934|5.038964|3.952765|3.092983|2.680051|2.269132|2.139105|2.298266|2.771161|4.164109|0.078405|3.979381|0.115381|4.628399|0.124469|3.588204|0.089504|3.617903|4.500257|3.030279|0.073109|3.833124|2.989121|4.785782|2.378444|2.074163|1.835200|1.803637|1.996230|2.321776|2.630731|1.588494|2.033675|6.025882|6.506366|0.301380|0.500000| |17.556535|8.838551|7.593623|4.601042|3.680459|3.205967|2.615160|2.268997|1.981237|1.918013|2.084533|2.462067|3.778761|0.073937|3.455652|0.100022|4.246771|0.123838|3.465749|0.083524|3.615596|4.811190|3.369931|0.081505|4.100146|3.038673|4.780350|2.565912|2.207317|1.958488|1.943773|2.177140|2.544571|2.931429|1.705012|2.123095|7.214110|6.144302|0.300885|0.302423|0.500000| |8.897777|17.635887|12.495057|5.683924|4.229069|4.041123|3.221259|2.650830|2.314078|2.300963|2.596922|3.161179|5.163746|0.103499|4.878529|0.132694|7.607083|0.241578|5.935580|0.126465|6.126246|8.004561|5.680599|0.122543|6.697244|4.984137|7.182048|3.776702|3.057211|2.579232|2.515068|2.877900|3.608416|4.225445|2.113623|2.903966|13.020026|8.969258|0.213128|0.173098|0.213871|0.500000| |8.839041|17.518868|12.316394|7.206036|4.637858|4.023602|3.205448|2.725263|2.343285|2.259263|2.470753|2.979346|4.573298|0.088654|4.283601|0.111790|6.060649|0.155772|5.240984|0.121236|6.246516|7.737946|4.648911|0.106602|5.333503|4.035977|5.929662|3.073012|2.646968|2.251105|2.150068|2.365395|2.843112|3.110562|1.843257|2.649665|9.160267|11.013616|0.173140|0.208651|0.214259|0.304973|0.500000| |4.734918|6.271014|12.219388|17.579412|8.830764|6.901323|5.195910|4.339187|3.445094|3.135807|3.350755|4.245161|5.987328|0.106692|5.751095|0.131743|6.759310|0.139260|6.117889|0.172793|6.218450|6.239533|3.661815|0.086563|4.792998|4.108618|6.371415|2.787393|2.498504|2.120235|1.984666|2.127672|2.510736|2.642922|1.715729|2.619973|6.201566|14.476719|0.115621|0.137618|0.109070|0.139168|0.183241|0.500000| |6.732483|7.602299|12.581029|17.637228|8.888640|5.671799|4.188349|3.602435|2.898545|2.635366|2.793747|3.469897|5.003283|0.090282|4.939049|0.128151|5.640310|0.129712|4.483726|0.117966|4.537812|5.117723|3.194680|0.076418|4.109000|3.370407|5.345638|2.471343|2.193616|1.904517|1.823969|1.979593|2.313198|2.515471|1.595574|2.230699|5.823810|9.171030|0.153311|0.229136|0.144115|0.149082|0.212847|0.303816|0.500000| |3.848405|4.164501|7.634455|8.730956|17.596219|8.920688|6.822856|6.262253|4.356816|3.585215|3.616464|4.603345|5.865330|0.098810|5.468223|0.137050|4.755352|0.107548|3.969222|0.117509|3.602556|4.020104|2.607633|0.063827|3.597868|3.092114|5.255195|2.234069|2.028161|1.782230|1.703664|1.825982|2.094482|2.238764|1.506678|2.083669|4.546511|7.208267|0.102634|0.119273|0.088865|0.097361|0.110447|0.215970|0.208094|0.500000| |4.977135|5.001535|9.466207|8.839045|17.546674|9.042432|5.896617|4.788155|3.609982|3.202892|3.409487|4.462084|6.282726|0.105761|6.576134|0.189974|5.519407|0.129983|4.026752|0.111129|3.528283|4.029118|2.711998|0.065483|3.765003|3.228553|5.515524|2.343878|2.073226|1.829639|1.780903|1.949210|2.256154|2.504099|1.570658|2.065826|4.927513|6.538198|0.141301|0.155533|0.108220|0.114836|0.121076|0.173976|0.218814|0.300755|0.500000| |2.605668|2.823662|4.834501|4.326674|5.980202|6.548738|8.706353|17.745695|9.025818|5.581139|4.811258|5.490268|5.828413|0.098185|4.416409|0.109655|3.553420|0.084102|3.297386|0.104571|2.905388|3.323235|2.220942|0.055747|3.188500|2.765646|4.979479|2.052088|1.916679|1.708299|1.625200|1.711216|1.920465|1.998560|1.454422|1.992961|3.760699|5.635773|0.071873|0.076423|0.063331|0.071331|0.075492|0.122511|0.105235|0.205922|0.139895|0.500000| |2.017730|2.189358|3.572061|2.923179|3.519201|4.104138|5.629859|9.049857|17.754281|8.762459|5.587053|4.924816|5.021429|0.089986|3.353506|0.084464|2.779232|0.068591|2.755851|0.088435|2.432314|2.868326|1.966268|0.050447|2.886838|2.477260|4.633265|1.922813|1.845464|1.671741|1.584011|1.638065|1.799060|1.826217|1.435288|1.935149|3.275316|4.572069|0.056183|0.057566|0.050441|0.057535|0.058907|0.084356|0.072568|0.106571|0.087810|0.215538|0.500000| |1.911787|2.104406|3.400446|2.604589|2.976949|3.688106|4.959599|5.653974|8.791781|17.722107|9.100417|5.697841|5.721146|0.108447|3.399650|0.085287|2.810819|0.071148|2.892713|0.093545|2.467524|2.947701|2.084018|0.053776|3.183361|2.769098|5.470371|2.173422|2.109747|1.922794|1.817122|1.865127|2.031934|2.025804|1.644838|2.200556|3.421336|4.422001|0.053890|0.053031|0.048168|0.057059|0.056010|0.074756|0.063898|0.083531|0.075485|0.123979|0.215616|0.500000| |2.193801|2.471825|4.055880|2.910802|3.233566|4.303648|5.493931|4.812087|5.516350|8.946094|17.755869|8.752038|9.269284|0.192110|4.551733|0.111682|3.635929|0.093684|3.795109|0.122810|2.996324|3.558393|2.601958|0.066010|4.218255|3.878160|8.444880|2.888288|2.734716|2.450222|2.321977|2.426240|2.699025|2.689775|2.047818|2.769087|4.232075|5.058284|0.062752|0.059189|0.054910|0.068843|0.064249|0.082107|0.069613|0.084792|0.082337|0.105155|0.123093|0.216539|0.500000| |1.826722|2.084022|2.874915|1.906890|1.783379|1.956106|1.934297|1.744601|1.735806|1.904935|2.141923|2.168345|3.233939|0.074214|2.215754|0.057948|2.423779|0.070298|2.845583|0.075820|2.796158|4.160283|3.642677|0.114036|5.688825|3.552168|6.325037|5.665137|8.954730|17.708716|8.933796|5.672160|4.937166|3.548884|7.022689|7.090516|5.591892|4.287123|0.050581|0.046860|0.049629|0.063695|0.057030|0.054642|0.049000|0.046321|0.046987|0.044978|0.044612|0.051369|0.063897|0.500000| |2.145409|2.362209|3.185846|2.011906|1.902403|2.082791|1.990097|1.744871|1.696671|1.846995|2.121460|2.235903|3.519494|0.081782|2.479159|0.068711|2.701894|0.085102|2.840070|0.071726|2.629161|3.829627|3.540304|0.099318|5.653067|3.607346|6.653739|5.675606|4.949902|5.674086|8.944483|17.709120|8.960417|7.112541|7.030385|3.554054|6.449416|3.952358|0.061988|0.053504|0.058603|0.074908|0.061479|0.054923|0.052040|0.048121|0.051913|0.045090|0.043150|0.048886|0.062901|0.124578|0.500000| |3.156430|3.616770|5.103427|2.972839|2.806470|3.197194|2.916572|2.397895|2.253333|2.452248|2.956673|3.365336|5.910686|0.144041|4.267446|0.121075|4.796049|0.172468|4.619071|0.109075|3.771492|5.131991|4.749813|0.114017|8.542838|6.302406|12.031063|6.570528|4.553094|3.998650|4.350245|6.017731|8.882044|17.541525|3.396316|3.594322|9.075661|5.393140|0.094652|0.076155|0.082023|0.119382|0.087839|0.078459|0.074131|0.067796|0.076849|0.060965|0.055563|0.062375|0.085931|0.090988|0.157864|0.500000| |3.527987|4.090382|5.229282|2.988340|2.680804|2.891663|2.577216|2.160747|2.008151|2.124707|2.474786|2.819406|4.733223|0.107700|3.677924|0.103155|4.546500|0.163843|4.447912|0.100882|4.044808|5.952426|6.003903|0.142587|9.152290|5.604731|8.946810|6.712421|4.555113|3.948058|4.249491|5.824984|8.825387|17.622096|3.309696|3.605565|13.974243|5.666683|0.103182|0.082328|0.095412|0.145617|0.100430|0.079056|0.076492|0.065054|0.073488|0.056159|0.050159|0.054246|0.070171|0.089906|0.151456|0.301029|0.500000| |2.780445|3.046964|4.052266|2.440653|2.290286|2.502101|2.306540|1.967897|1.867033|2.006009|2.334015|2.571146|4.227741|0.097738|3.110386|0.089153|3.478414|0.117944|3.405018|0.082447|3.050396|4.363603|4.078167|0.105165|6.487551|4.281391|7.709014|5.564639|4.164798|3.997776|4.797395|7.369766|8.889440|17.596179|3.854278|3.207317|8.238655|4.495995|0.082823|0.067272|0.075352|0.100305|0.076083|0.064768|0.062909|0.056524|0.063485|0.050928|0.046942|0.051982|0.067736|0.090932|0.229980|0.302451|0.301675|0.500000| |1.652487|1.816152|2.505397|1.655503|1.590724|1.747126|1.731558|1.565832|1.566232|1.728252|1.944923|1.952285|2.923654|0.067201|1.991440|0.053976|2.095191|0.062295|2.283872|0.060755|2.153339|3.092727|2.670620|0.077906|4.181277|2.793220|5.276099|3.990448|4.453703|6.294581|8.865455|6.269964|4.439154|3.502820|17.537118|3.510320|4.506087|3.361426|0.046919|0.042412|0.044976|0.055354|0.048541|0.046214|0.042889|0.041213|0.042876|0.040395|0.040401|0.046982|0.058795|0.169671|0.168678|0.090427|0.084048|0.099169|0.500000| |1.714966|1.870550|2.521443|1.649479|1.566282|1.694158|1.649992|1.486990|1.467886|1.594029|1.785663|1.829539|2.765151|0.062819|1.936294|0.053005|2.078272|0.062698|2.231254|0.058155|2.143239|3.141364|2.765668|0.081627|4.172368|2.697903|4.921624|3.975661|4.189491|5.642325|8.839300|7.106581|4.702710|3.779677|17.580863|3.245985|4.836540|3.328668|0.048704|0.043654|0.047275|0.057686|0.050003|0.045741|0.043125|0.040419|0.042509|0.038692|0.037893|0.042955|0.053026|0.143294|0.214186|0.092445|0.092160|0.111530|0.302078|0.500000| |1.635373|1.805467|2.449808|1.623802|1.536200|1.662886|1.634999|1.485610|1.476573|1.606886|1.788189|1.811660|2.699378|0.061160|1.876243|0.050507|2.018450|0.059642|2.231436|0.058965|2.178261|3.211733|2.787164|0.084630|4.178173|2.686519|4.857426|3.974055|4.699971|7.090156|8.839072|5.650935|4.187801|3.250512|17.579168|3.767807|4.665363|3.404385|0.045861|0.041943|0.044970|0.055172|0.048946|0.045664|0.042359|0.039943|0.041249|0.038634|0.038250|0.043557|0.053182|0.212831|0.143738|0.081505|0.081458|0.090338|0.302102|0.301573|0.500000| |2.250268|2.719425|3.952860|2.644198|2.428397|2.748507|2.745687|2.421732|2.391620|2.648605|3.049885|3.135669|4.666699|0.107911|3.120028|0.076490|3.503484|0.095531|4.795589|0.134589|4.652938|6.543244|5.240119|0.151107|9.017785|6.163943|10.259841|6.667005|8.843923|5.921656|4.312559|3.997350|4.581827|3.622221|3.360209|17.547748|6.880593|6.867840|0.061142|0.058063|0.059326|0.081730|0.075283|0.078926|0.065450|0.062815|0.061473|0.061246|0.060088|0.069651|0.089621|0.154138|0.090959|0.100664|0.096114|0.085547|0.089515|0.080898|0.091114|0.500000| |1.961600|2.303350|3.228198|2.177622|2.005056|2.204159|2.192965|1.982858|1.969977|2.151853|2.406382|2.441200|3.581587|0.081135|2.454938|0.062157|2.732099|0.076190|3.441718|0.094188|3.520108|5.248204|4.315548|0.137384|6.593319|4.176778|7.054183|5.564928|8.880629|7.363180|4.794468|4.000930|4.163591|3.205982|3.849450|17.603997|6.021152|5.410556|0.053291|0.050722|0.052788|0.069381|0.064393|0.064246|0.055359|0.052420|0.051656|0.051015|0.050487|0.057662|0.070699|0.229277|0.090992|0.085334|0.085131|0.078766|0.099835|0.089981|0.110770|0.302399|0.500000| |2.317684|2.816408|3.885756|2.578751|2.289140|2.484755|2.403489|2.137162|2.070222|2.214971|2.486518|2.623692|3.923431|0.087752|2.790618|0.069700|3.286236|0.091034|4.377414|0.114698|4.874226|7.919955|6.571354|0.228276|9.107103|5.228650|7.880027|6.599174|8.759977|5.864159|4.262628|3.942486|4.515002|3.565246|3.325450|17.556400|8.074571|7.095164|0.061906|0.059303|0.062428|0.086015|0.080103|0.077019|0.065294|0.059255|0.058421|0.055339|0.052645|0.058112|0.071113|0.153396|0.089801|0.093795|0.099317|0.084682|0.084492|0.081673|0.092802|0.302258|0.302853|0.500000| |4.005619|5.081665|5.626453|3.319294|2.715601|2.734298|2.402604|2.071494|1.898452|1.939133|2.171440|2.471589|3.898734|0.083180|3.182371|0.084342|4.264572|0.131319|4.596621|0.102606|5.500523|10.242112|9.893186|0.236080|8.296710|4.729317|6.642682|4.945374|4.013683|3.323002|3.178242|3.586087|4.518108|4.672195|2.593430|3.705466|35.648336|7.586658|0.102982|0.093255|0.115566|0.185341|0.144363|0.091818|0.088188|0.067292|0.072259|0.055288|0.048073|0.049521|0.059673|0.080805|0.089947|0.114519|0.167294|0.109972|0.065141|0.070723|0.068742|0.095849|0.087244|0.116548|0.500000| |3.580068|4.837786|6.724617|5.022568|3.746561|3.628497|3.227929|2.862349|2.549799|2.484240|2.673448|3.076849|4.447816|0.088158|3.665750|0.087710|4.717162|0.112590|5.972247|0.157288|10.210625|11.411913|5.149466|0.125948|5.845092|4.414252|6.305464|3.294878|3.070430|2.517113|2.258762|2.351647|2.778512|2.733318|1.922889|3.445572|7.722590|35.509683|0.087006|0.095636|0.092929|0.127793|0.163453|0.176894|0.127568|0.098002|0.089440|0.077904|0.064529|0.062225|0.069741|0.065441|0.059053|0.076766|0.082795|0.066089|0.050749|0.050663|0.052169|0.100962|0.083061|0.110427|0.119768|0.500000| 1443.189828 -10539.522450 4254.032999 -197.464582 -5039.764206 3594.940157 -1444.824049 2.001132 40B440000000004F 44B4D5107412B1F3 443650675069B71C 42310EEC5FDFFFFE 3BC79CA100000000 43F445C0394B1C8B