Version2.1 2020-12-18T12:29:02Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 13-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC1=N[C@@H](N=C1)CCNC(=O)C[C@H]2C(=O)NCC[NH+]2Cc3cccc(c3)Oc4ccccc4 C39398720 RHF 6-31G(d) (6D,7F) CC1=N[C@@H](N=C1)CCNC(=O)C[C@H]2C(=O)NCC[NH+]2Cc3cccc(c3)Oc4ccccc4 C01[X(C25H30N5O3)] 183 C1 555 O=C(C[C@H]1C(=O)NCC[NH+]1Cc1cccc(c1)Oc1ccccc1)NCC[C@@H]1N=CC(=N1)C O=C(C[C@H]1C(=O)NCC[NH+]1Cc1cccc(c1)Oc1ccccc1)NCC[C@@H]1N=CC(=N1)C CC1=N[C@H](CCNC(=O)C[C@@H]2[NH+](CCNC2=O)Cc3cccc(Oc4ccccc4)c3)N=C1 InChIKey=CICDBUMMPNMDMW-XZOQPEGZSA-O InChI=1S/C25H29N5O3/c1-18-16-28-23(29-18)10-11-26-24(31)15-22-25(32)27-12-13-30(22)17-19-6-5-9-21(14-19)33-20-7-3-2-4-8-20/h2-9,14,16,22-23H,10-13,15,17H2,1H3,(H,26,31)(H,27,32)/p+1/t22-,23+/m0/s1 InChI=1/C25H29N5O3/c1-18-16-28-23(29-18)10-11-26-24(31)15-22-25(32)27-12-13-30(22)17-19-6-5-9-21(14-19)33-20-7-3-2-4-8-20/h2-9,14,16,22-23H,10-13,15,17H2,1H3,(H,26,31)(H,27,32)/p+1/t22-,23+/m0/s1/fC25H30N5O3/h26-27,30H/q+1 CC1=N[C@@H](N=C1)CCNC(=O)C[C@H]2C(=O)NCC[NH+]2Cc3cccc(c3)Oc4ccccc4 C01[X(C25H30N5O3)] 183 C01 555 O=C(C[C@H]1C(=O)NCC[NH+]1Cc1cccc(c1)Oc1ccccc1)NCC[C@@H]1N=CC(=N1)C O=C1NCC[NH]([C@H]1C[C]([NH]CC[C@@H]1N=CC(=N1)C)[O])C[C]1[CH][CH][CH][C]([CH]1)O[C]1[CH][CH][CH][CH][CH]1 CC1=N[C@H](CCN[C]([O])C[C@@H]2[NH](CCNC2=O)C[C]3[CH][CH][CH][C]([CH]3)O[C]4[CH][CH][CH][CH][CH]4)N=C1 InChIKey=NPNUIMRWUMOZDP-XZOQPEGZSA-N InChI=1S/C25H30N5O3/c1-18-16-28-23(29-18)10-11-26-24(31)15-22-25(32)27-12-13-30(22)17-19-6-5-9-21(14-19)33-20-7-3-2-4-8-20/h2-9,14,16,22-23,30H,10-13,15,17H2,1H3,(H,26,31)(H,27,32)/t22-,23+/m0/s1 InChI=1/C25H30N5O3/c1-18-16-28-23(29-18)10-11-26-24(31)15-22-25(32)27-12-13-30(22)17-19-6-5-9-21(14-19)33-20-7-3-2-4-8-20/h2-9,14,16,22-23,30H,10-13,15,17H2,1H3,(H,26,31)(H,27,32)/t22-,23+/m0/s1/f/h26-27H 3134.6030481950 -1460.8431741 1-A 27676.5687 119 436 555 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.68992 -20.66054 -20.65843 -15.82640 -15.72140 -15.70892 -15.64328 -15.63140 -11.49124 -11.48335 -11.44913 -11.43083 -11.43069 -11.41436 -11.40856 -11.38591 -11.37245 -11.36891 -11.36032 -11.35799 -11.35543 -11.35148 -11.34439 -11.34228 -11.33952 -11.33187 -11.32002 -11.30869 -11.30847 -11.30734 -11.30708 -11.30184 -11.29597 -1.53719 -1.52463 -1.52428 -1.47590 -1.40156 -1.37794 -1.36100 -1.27511 -1.24964 -1.23067 -1.22542 -1.18897 -1.16463 -1.14575 -1.13368 -1.09759 -1.09590 -1.08159 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0.03641 7.11 18.93 22.20 25.71 44.83 52.68 59.20 69.32 73.18 96.20 105.65 123.85 136.79 170.01 192.46 195.67 209.64 250.16 310.38 328.35 336.93 354.23 369.84 398.79 415.49 443.49 474.69 509.53 546.48 568.18 590.42 627.79 634.59 667.16 668.25 683.38 722.13 739.40 763.01 788.49 807.24 811.97 879.97 908.84 928.19 936.83 947.94 972.37 978.93 997.93 1004.21 1022.87 1064.05 1099.58 1109.44 1118.08 1154.90 1189.71 1216.05 1265.07 1281.45 1297.95 1304.00 1323.52 1350.50 1361.20 1376.88 1405.43 1432.38 1446.83 1467.08 1473.07 1488.20 1500.41 1504.56 1524.98 1538.64 1560.53 1573.48 1582.48 1585.73 1586.86 1598.94 1617.08 1618.58 1627.36 1635.83 1655.30 1675.19 1682.41 1689.08 1705.99 1721.10 1737.28 1742.94 1749.79 1753.43 1768.02 1789.57 1800.12 1833.09 1849.75 1910.30 1920.96 1922.59 1925.12 1932.60 1939.90 1966.42 1983.60 2003.09 2032.64 2040.50 2058.86 2062.32 2063.95 2100.89 2102.94 2110.12 2112.13 2118.61 2158.67 2168.62 2212.17 2221.89 2234.49 2256.01 2258.41 2266.08 2298.13 2325.13 2329.69 2330.85 2332.12 2333.35 2355.37 2363.35 2367.13 2382.74 2389.28 2396.20 2397.72 2401.45 2421.30 2516.35 2567.30 2582.61 2587.53 2611.12 2631.62 2695.69 2749.21 2852.32 4619.96 4630.43 4645.62 4650.00 4656.53 4691.44 4697.36 4697.80 4709.88 4712.55 4731.99 4752.45 4783.30 4794.97 4809.16 4826.82 4835.62 4835.93 4848.73 4859.93 4863.96 4872.59 4873.03 4878.02 4882.71 4893.37 4921.43 5034.74 5519.13 5561.62 0.571322 0.599766 0.600710 0.503782 -1460.271852 -1460.243408 -1460.242464 -1460.339392 3.250981D-04 MUNgauss RevisionA2.0 retrievium 18-Dec-2020 DUDE CC1=N[C@@H](N=C1)CCNC(=O)C[C@H]2C(=O)NCC[NH+]2Cc3cccc(c3)Oc4ccccc4 C39398720 RHF 6-31G(d) (6D,10F) C1 448.234865 |X|Y|Z| 147.201536 72.028019 28.639718 67.214172 30 6 7 8 24 5 1 |36.858105| |12.745252|36.858105| |7.767749|15.116269|53.358707| |5.237628|8.771521|17.931400|36.858105| |4.481285|6.655081|12.569195|17.533886|0.500000| |5.168187|8.406416|11.038798|13.109402|0.256377|53.358707| |7.175853|12.754937|11.539923|8.819263|0.185657|20.631323|36.858105| |4.075405|5.752302|10.573544|12.476676|0.246017|10.517205|5.763970|36.858105| |3.175586|4.184326|6.811903|7.527111|0.192537|8.648234|4.603237|12.498614|36.858105| |2.696786|3.342112|5.295508|4.998351|0.129301|5.976277|3.531993|7.790252|13.019257|53.358707| |2.318764|2.788426|4.236082|3.851789|0.102198|4.954094|3.007161|5.173829|7.771947|19.606634|36.858105| |2.223020|2.668415|3.954793|3.631214|0.098002|4.934436|2.973070|4.499551|6.781478|11.560648|15.613368|73.516695| |2.042932|2.375869|3.571526|3.060792|0.081358|3.920828|2.492236|3.951924|4.988299|10.679641|12.507424|14.279338|36.858105| |1.780127|2.039022|3.019620|2.558111|0.069636|3.343964|2.150770|3.105044|3.856861|7.024503|7.523101|12.140595|12.403888|36.858105| |1.659852|1.874224|2.761436|2.288154|0.062115|2.986024|1.954480|2.742617|3.250866|5.736364|5.503808|8.836451|8.851818|17.585606|0.500000| |1.733152|1.987472|2.975983|2.528611|0.070849|3.248060|2.079401|3.011875|3.762053|6.511109|6.279908|10.509797|7.632773|12.361554|0.250400|36.858105| |1.769905|2.027197|3.080835|2.593244|0.073169|3.240027|2.081122|3.119671|3.796220|6.623447|5.747310|8.862079|6.905402|8.133153|0.195917|15.942770|73.516695| |1.622119|1.850996|2.739853|2.325941|0.066025|3.044017|1.955479|2.669658|3.313538|5.295398|4.901860|9.224022|5.229053|7.670252|0.174556|14.194942|15.117263|53.358707| |1.575329|1.792839|2.609966|2.218858|0.062562|2.989590|1.926496|2.498909|3.098453|4.778608|4.474276|9.249875|4.563279|6.500265|0.150238|7.709348|9.489122|17.947240|36.858105| |1.552839|1.756187|2.534808|2.133573|0.058917|2.901812|1.888934|2.428326|2.959206|4.684336|4.498342|9.126361|4.972800|7.669873|0.186512|6.719513|8.422091|10.746156|12.597927|36.858105| |1.723125|1.968547|2.856735|2.428657|0.065913|3.292061|2.122726|2.857415|3.556830|5.979359|6.308812|12.610549|7.536038|12.642879|0.252882|7.456851|9.328875|9.187219|7.754894|12.761296|53.358707| |1.852571|2.144313|3.109924|2.699791|0.073178|3.708053|2.350968|3.184567|4.128958|6.843710|7.663920|18.486400|7.479472|9.449645|0.183617|6.694806|8.768861|8.503922|7.342881|9.264754|25.435908|0.500000| |1.669515|1.882762|2.692437|2.244448|0.059872|3.083925|2.028544|2.619765|3.113342|5.124403|4.978819|9.392635|6.062728|7.584218|0.202293|4.906397|6.992685|6.075135|5.003909|7.676052|17.169009|0.256302|36.858105| |1.624892|1.823484|2.563042|2.132780|0.056861|3.012529|1.996762|2.417031|2.841643|4.401072|4.065127|8.179080|4.347026|4.961548|0.129582|3.767412|5.544385|5.014815|4.397604|6.286725|10.360852|0.200657|12.626037|36.858105| |1.762766|1.995106|2.774920|2.337105|0.061828|3.391727|2.234388|2.622238|3.110213|4.647712|4.224370|8.953029|4.106216|4.299829|0.107335|3.423213|5.151156|4.572565|3.972039|5.012764|8.281411|0.190615|7.576002|13.676559|36.858105| |1.672141|1.870753|2.562178|2.132396|0.056621|3.148285|2.108962|2.319695|2.679244|3.841489|3.311858|6.889726|3.173300|3.301952|0.084529|2.791896|4.304101|3.825221|3.321574|3.961680|5.890975|0.131699|5.042975|7.965954|13.788571|36.858105| |1.492146|1.646802|2.254636|1.847753|0.049434|2.694892|1.829201|1.993551|2.261507|3.251237|2.762855|5.573747|2.738156|2.928733|0.077386|2.522329|3.910850|3.507787|3.056513|3.677110|5.121710|0.108038|4.442978|6.855009|7.892736|13.726541|36.858105| |1.406727|1.547385|2.137962|1.742877|0.046810|2.494420|1.693116|1.900172|2.153136|3.165389|2.718431|5.373843|2.807623|3.114214|0.084591|2.650503|4.074759|3.694055|3.235150|4.095640|5.515347|0.109774|5.030938|7.916350|6.841697|7.957734|13.750426|36.858105| |1.458889|1.615107|2.256679|1.849375|0.049630|2.609824|1.755349|2.056417|2.359602|3.576100|3.164201|6.208101|3.400823|3.923227|0.107922|3.181881|4.782203|4.368191|3.843706|5.333931|7.372040|0.138177|7.615883|13.780560|7.919026|6.904464|7.924054|13.679325|36.858105| |1.280177|1.394933|1.924864|1.552430|0.041888|2.208687|1.512699|1.678463|1.875217|2.741307|2.310406|4.479373|2.407864|2.677001|0.074289|2.342376|3.654514|3.290321|2.835802|3.480822|4.518110|0.088421|3.957161|5.299449|4.614518|5.204208|7.865818|14.140275|8.228635|73.516695| |1.222084|1.322532|1.811268|1.451469|0.039195|2.078942|1.436206|1.548693|1.710718|2.458828|2.032838|3.930184|2.082113|2.264025|0.062460|2.023926|3.207199|2.847006|2.418425|2.833915|3.704131|0.074069|3.124162|3.988845|3.780438|4.494305|6.673131|8.019291|5.283586|24.533215|36.858105| |1.202949|1.292621|1.760541|1.399002|0.037571|2.007813|1.399903|1.488546|1.622243|2.324273|1.896028|3.615540|1.943467|2.067184|0.057322|1.842020|2.957339|2.550575|2.116657|2.451967|3.301427|0.066276|2.811001|3.485433|3.380177|3.993038|5.494901|5.968950|4.352565|14.195691|13.783005|36.858105| |1.139398|1.216491|1.648633|1.302409|0.035052|1.874306|1.316106|1.371342|1.481852|2.098871|1.689876|3.212842|1.715135|1.807311|0.049960|1.636995|2.654027|2.272791|1.869358|2.110527|2.833502|0.057376|2.346961|2.817522|2.802606|3.295275|4.231719|4.276593|3.335381|9.288925|7.986588|13.749845|36.858105| |1.099327|1.173870|1.590969|1.258514|0.034074|1.812586|1.271531|1.316176|1.425577|2.004408|1.610521|3.080363|1.621188|1.717827|0.047234|1.580056|2.562472|2.219886|1.835946|2.038703|2.688959|0.054709|2.171521|2.582699|2.587367|3.040097|3.837389|3.814936|3.017163|8.188756|6.912015|7.923984|13.741217|36.858105| |1.114242|1.196576|1.628823|1.296895|0.035287|1.865097|1.298963|1.358001|1.485439|2.090429|1.693354|3.270769|1.700851|1.827983|0.050049|1.692173|2.722575|2.409521|2.024603|2.245654|2.897042|0.058915|2.309721|2.772522|2.757005|3.246653|4.181969|4.224601|3.286584|9.295688|7.985750|6.863231|7.940327|13.748013|36.858105| |1.173454|1.268848|1.736573|1.392323|0.037867|1.996733|1.379415|1.471644|1.627208|2.313097|1.901258|3.699743|1.922930|2.098715|0.057464|1.922347|3.053873|2.749916|2.352120|2.673010|3.404246|0.068706|2.747892|3.401819|3.301679|3.908552|5.389752|5.832149|4.246503|14.226820|13.791904|7.904360|6.864738|7.925100|13.742799|36.858105| |17.543756|8.926197|8.202552|4.518487|0.106010|6.378357|6.451995|3.766535|2.995181|3.541443|2.264683|3.863782|2.014861|1.754033|0.045634|1.686484|3.043435|2.145305|1.539790|1.533905|2.325458|0.050909|1.676570|1.640095|1.784572|1.699813|1.516882|1.426248|1.474556|2.306974|1.241510|1.229011|1.164973|1.119606|1.129398|1.187404|0.500000| |17.545704|8.934655|8.237865|4.533660|0.114119|6.367397|6.420692|3.505726|2.862665|3.310831|2.127983|3.679584|1.877983|1.661083|0.043052|1.628303|2.945399|2.096196|1.503659|1.475329|2.205080|0.048375|1.566743|1.536723|1.669004|1.598422|1.433210|1.347724|1.388697|2.188645|1.181204|1.162363|1.106225|1.071956|1.086974|1.140114|0.302281|0.500000| |17.626657|8.966287|9.972389|4.770017|0.116786|5.911401|5.400658|3.891544|3.010350|3.553534|2.235109|3.762441|1.996388|1.738777|0.045295|1.702256|3.120911|2.159102|1.526979|1.502957|2.265607|0.049331|1.610196|1.553442|1.666439|1.573434|1.413046|1.343094|1.399153|2.181904|1.169440|1.150969|1.089714|1.051162|1.065565|1.122613|0.299722|0.299955|0.500000| |6.325669|8.291053|7.930099|5.940024|0.137977|12.619366|17.704691|4.461594|3.842293|4.193023|2.719170|4.869642|2.289196|2.007464|0.050949|1.929253|3.399718|2.493978|1.829018|1.805335|2.740543|0.061826|1.947115|1.948308|2.198887|2.113141|1.836437|1.684117|1.725707|2.679885|1.442470|1.412534|1.334989|1.290869|1.313910|1.387709|0.172835|0.171176|0.131161|0.500000| |4.217708|5.773424|9.602364|8.904542|0.174172|9.600632|5.793347|17.547940|8.849562|9.620659|4.967684|7.622263|3.953218|3.054231|0.075927|2.854375|5.191733|3.425522|2.385742|2.379790|3.864702|0.087301|2.686274|2.486010|2.711923|2.395735|2.050270|1.948919|2.108158|3.051638|1.584248|1.534488|1.411107|1.344900|1.378858|1.493289|0.113275|0.098201|0.110779|0.127925|0.500000| |3.839283|5.092511|9.837168|8.961566|0.213454|7.677100|4.657009|17.544256|8.823553|9.640731|4.751070|7.115430|3.857065|3.036796|0.075584|3.009579|5.730323|3.586487|2.409429|2.327294|3.691076|0.082062|2.476587|2.250052|2.384240|2.110152|1.842451|1.779555|1.935427|2.820828|1.462736|1.406487|1.297338|1.246109|1.285517|1.391558|0.097416|0.091769|0.106960|0.103403|0.301964|0.500000| |2.976357|3.863138|6.334910|6.881123|0.208263|7.741306|4.188547|8.816706|17.563655|12.410310|6.598150|10.987532|4.477259|3.692807|0.086400|3.840813|6.991712|4.723599|3.194940|2.929285|4.617464|0.108631|2.890817|2.649988|2.863434|2.500910|2.141144|2.048405|2.235105|3.199109|1.646427|1.551787|1.423559|1.380335|1.446534|1.582044|0.076597|0.076153|0.079088|0.098073|0.173206|0.210185|0.500000| |3.135745|4.121330|6.254644|6.805535|0.169907|9.592516|4.920264|8.825999|17.671181|12.521356|7.279622|13.220298|4.663993|3.742064|0.087318|3.545736|6.099565|4.381160|3.142875|3.041272|4.987171|0.122039|3.251617|3.066873|3.493487|3.019512|2.488125|2.320952|2.517375|3.550307|1.826085|1.729554|1.578109|1.517942|1.582862|1.736121|0.083484|0.079479|0.080503|0.117378|0.212355|0.173179|0.302811|0.500000| |2.681629|3.265814|5.271357|4.694104|0.121093|5.373960|3.300499|7.403009|8.982919|26.032453|9.532207|10.884229|7.503025|4.855632|0.115557|4.553519|8.757864|4.926468|3.185398|3.146792|5.369548|0.118903|3.473347|2.941870|3.025738|2.532708|2.187414|2.156498|2.439180|3.363352|1.700508|1.617380|1.464239|1.395547|1.449070|1.597116|0.071841|0.066590|0.073538|0.079757|0.192646|0.216857|0.198255|0.181180|0.500000| |2.047673|2.358973|3.492921|2.939483|0.076448|3.832467|2.477323|3.769583|4.500325|8.993597|8.955127|11.734446|17.580850|8.740991|0.212842|5.516199|8.992983|5.702122|3.895967|4.483144|9.235410|0.183775|6.653304|4.688510|4.407424|3.355646|2.880259|2.956807|3.610199|4.473332|2.168245|2.047142|1.794947|1.676829|1.743352|1.971519|0.056844|0.052050|0.055440|0.063788|0.109918|0.100806|0.108515|0.121037|0.179969|0.500000| |2.035772|2.352770|3.591189|3.021247|0.080859|3.749698|2.406786|3.934138|4.714677|9.991872|8.796379|10.543124|17.648968|9.000533|0.217693|7.233695|14.021813|6.577879|3.990735|4.159205|7.565505|0.149183|4.693846|3.534869|3.336089|2.691569|2.377353|2.447332|2.907142|3.819596|1.879897|1.767382|1.574283|1.492350|1.559828|1.747118|0.055472|0.051797|0.055978|0.060909|0.108078|0.112110|0.120293|0.116213|0.229659|0.304143|0.500000| |1.586630|1.805843|2.682975|2.267306|0.065301|2.942133|1.894906|2.563584|3.136734|4.854334|4.234665|7.843178|4.351432|5.657563|0.136672|9.642251|13.973750|25.959173|9.000882|5.726832|6.801830|0.133746|3.617280|3.101563|2.892040|2.489369|2.303151|2.403690|2.767778|3.867809|1.913308|1.722970|1.551921|1.525848|1.654831|1.868174|0.042574|0.042018|0.043261|0.049226|0.066308|0.071091|0.093711|0.083608|0.093447|0.098793|0.117155|0.500000| |1.455877|1.641087|2.375805|1.994783|0.056530|2.694294|1.756001|2.205465|2.663376|4.003956|3.573464|7.186661|3.658063|4.907574|0.122802|5.785285|7.885410|12.548282|17.617053|8.983007|7.657750|0.146787|4.148204|3.821161|3.447828|3.014209|2.870662|3.071775|3.549993|4.937107|2.390155|2.074872|1.845028|1.832367|2.040666|2.367809|0.039526|0.038824|0.039277|0.046589|0.058559|0.059431|0.076789|0.074966|0.075432|0.089500|0.092061|0.221771|0.500000| |1.662936|1.909513|2.772501|2.393940|0.067860|3.268440|2.081603|2.669757|3.389464|5.055191|4.728272|10.601163|4.399465|5.636354|0.126493|6.370458|8.425821|12.341487|17.550629|8.870885|9.419050|0.214450|4.650962|4.344527|4.208374|3.552122|3.175191|3.229963|3.712839|4.954624|2.413243|2.115127|1.879469|1.854760|2.047785|2.366013|0.045029|0.044213|0.044471|0.054946|0.070172|0.070344|0.098247|0.097730|0.090890|0.104925|0.105346|0.203488|0.301880|0.500000| |1.459131|1.634669|2.360336|1.957661|0.054015|2.639037|1.737219|2.225089|2.642266|4.201631|3.893345|7.409458|4.556742|7.071889|0.201606|6.296824|8.239281|9.625172|8.839237|17.603861|12.400109|0.180762|6.949636|5.464883|4.218172|3.449133|3.329387|3.843783|5.051109|6.062102|2.761724|2.401998|2.065745|1.988775|2.181899|2.591634|0.040102|0.038499|0.039461|0.046145|0.060884|0.060060|0.072587|0.074216|0.080720|0.116432|0.110782|0.149211|0.216082|0.173414|0.500000| |1.511018|1.701617|2.427896|2.037112|0.056088|2.819801|1.846898|2.280366|2.748004|4.213069|3.931337|8.199139|4.143283|5.604560|0.141062|4.921896|6.688081|7.726865|8.863797|17.675172|12.398134|0.219353|7.272692|7.368467|5.763373|4.666381|4.436225|5.044204|6.595503|7.405760|3.306703|2.774864|2.358054|2.286772|2.561305|3.126615|0.041629|0.040056|0.040419|0.049543|0.062508|0.060090|0.075198|0.080180|0.078193|0.108649|0.097002|0.126013|0.211981|0.215902|0.300183|0.500000| |1.785282|2.018824|2.892884|2.406963|0.063248|3.292639|2.167585|2.868693|3.375475|5.726854|5.540795|9.747115|7.085864|7.305796|0.195110|4.621392|6.913808|5.422633|4.187417|5.628340|12.371656|0.219074|17.674660|8.905060|6.891911|4.670326|3.994763|4.297820|5.868394|6.140899|2.826437|2.625833|2.219397|2.038300|2.130707|2.482153|0.050048|0.046143|0.047843|0.057525|0.083416|0.075090|0.084591|0.097502|0.108789|0.253408|0.147718|0.091925|0.097304|0.111264|0.144959|0.145791|0.500000| |1.545353|1.724115|2.466864|2.026555|0.054347|2.758115|1.834369|2.345642|2.722604|4.445541|4.128050|7.489308|5.211294|6.822397|0.214032|4.658133|6.764239|5.811717|4.663240|7.181973|12.371880|0.180744|17.626023|8.823533|5.576895|4.189339|3.975167|4.766254|7.304619|7.087744|3.106761|2.796572|2.327130|2.147834|2.282595|2.720317|0.043105|0.040370|0.041670|0.048963|0.066647|0.062624|0.071166|0.077499|0.086252|0.156517|0.120465|0.097247|0.112188|0.114759|0.214715|0.184700|0.302105|0.500000| |1.953321|2.246110|3.136085|2.690939|0.070477|3.935961|2.546911|3.069335|3.737604|5.597541|5.191957|11.464178|4.716194|4.612966|0.110607|3.644237|5.522422|4.740772|3.986618|4.766989|8.493134|0.216842|6.977468|8.841305|17.699849|8.929645|5.628753|4.934540|5.626248|6.507293|3.125589|2.866202|2.450600|2.283854|2.410865|2.803626|0.054851|0.051046|0.051033|0.069089|0.088630|0.076028|0.093268|0.120208|0.098180|0.140963|0.103611|0.083368|0.093788|0.120496|0.110061|0.141840|0.197104|0.140157|0.500000| |1.752425|1.963483|2.658513|2.217501|0.058678|3.346814|2.249481|2.371781|2.719292|3.780550|3.172608|6.619853|2.937802|2.965961|0.075385|2.570211|4.027356|3.518031|3.000035|3.403573|5.058915|0.115771|4.104422|5.657897|8.947152|17.730120|8.952216|5.664548|4.969337|7.458442|3.890880|3.586021|3.099731|2.902804|3.058195|3.523134|0.049618|0.046716|0.045421|0.063397|0.068163|0.059255|0.070365|0.086752|0.068850|0.085708|0.070037|0.064584|0.076009|0.090891|0.082630|0.107877|0.109937|0.096244|0.215923|0.500000| |1.432858|1.569760|2.133158|1.735447|0.046527|2.546467|1.745298|1.845303|2.066077|2.921058|2.429606|4.857014|2.385793|2.521942|0.066939|2.225100|3.499925|3.109551|2.674777|3.098776|4.249982|0.089875|3.554362|4.946842|5.634799|8.912419|17.770826|8.904895|5.636638|12.520201|7.375791|6.245128|4.981375|4.573845|4.963627|6.214316|0.040534|0.038446|0.037629|0.049094|0.052659|0.047427|0.054642|0.063080|0.054880|0.069280|0.058485|0.057607|0.070975|0.077533|0.079025|0.101612|0.090937|0.090522|0.124143|0.216203|0.500000| |1.378102|1.517438|2.129349|1.731640|0.046652|2.414444|1.630689|1.928057|2.192783|3.350780|2.939932|5.613397|3.264297|3.868248|0.111346|3.166120|4.780886|4.347769|3.755285|5.271626|6.928028|0.123151|6.992683|8.855575|5.618276|4.969100|5.661962|8.977341|17.720758|13.605908|4.927461|4.101479|3.173075|2.878258|3.130040|4.010151|0.038629|0.036440|0.036934|0.044372|0.054743|0.051017|0.058091|0.063889|0.064486|0.095684|0.079137|0.076722|0.098512|0.096952|0.151374|0.172830|0.149834|0.222226|0.123304|0.107817|0.124484|0.500000| |1.232475|1.323063|1.802710|1.428855|0.038173|2.045714|1.428710|1.529906|1.660434|2.396681|1.954519|3.691072|2.023458|2.134641|0.059615|1.875835|3.019267|2.562940|2.104357|2.464232|3.390702|0.067667|2.963132|3.654491|3.499071|4.029017|5.335692|5.932099|4.544417|12.984946|8.941535|17.728766|8.866514|5.628543|4.948051|5.641152|0.035094|0.032951|0.032790|0.039985|0.044103|0.040179|0.043810|0.049077|0.046504|0.059976|0.051084|0.047896|0.056723|0.058111|0.067426|0.076470|0.077986|0.082315|0.082466|0.099512|0.157069|0.119674|0.500000| |1.118666|1.187943|1.604807|1.260160|0.033823|1.813492|1.281321|1.323996|1.418376|2.005039|1.600995|3.018669|1.625902|1.694729|0.046973|1.535231|2.507649|2.115251|1.719045|1.929419|2.621380|0.053134|2.172111|2.559064|2.560238|2.963121|3.637075|3.630520|2.953925|7.503444|5.670653|8.935483|17.726603|8.910122|5.646295|4.948452|0.031879|0.030174|0.029735|0.036193|0.037991|0.034836|0.037752|0.041870|0.039022|0.047474|0.041674|0.040243|0.046964|0.047993|0.052610|0.059052|0.057898|0.059883|0.063193|0.078657|0.115988|0.078555|0.213992|0.500000| |1.053775|1.119961|1.513643|1.191869|0.032305|1.717429|1.210771|1.239175|1.333769|1.864609|1.485905|2.830139|1.490251|1.568817|0.043123|1.454153|2.374453|2.040892|1.673524|1.834265|2.425730|0.049504|1.938313|2.263210|2.283814|2.649300|3.210697|3.149808|2.581428|6.500195|4.973206|5.641307|8.912816|17.729852|8.914767|5.641352|0.029826|0.028625|0.027998|0.034238|0.035149|0.032639|0.035948|0.039373|0.036156|0.042722|0.038332|0.039211|0.046486|0.047057|0.049760|0.056526|0.050962|0.053238|0.056944|0.071579|0.104506|0.068792|0.123814|0.214814|0.500000| |1.077368|1.155585|1.572798|1.251382|0.034202|1.798833|1.253638|1.302924|1.424053|1.992108|1.606344|3.105580|1.604513|1.725397|0.047106|1.618594|2.612927|2.321535|1.948581|2.122228|2.712549|0.055357|2.120401|2.499966|2.499365|2.901164|3.581613|3.574558|2.894380|7.510199|5.670398|4.947639|5.645940|8.912090|17.726230|8.931907|0.030254|0.029291|0.028632|0.035243|0.036575|0.034315|0.038756|0.042077|0.038369|0.045333|0.041063|0.044624|0.055060|0.054937|0.057229|0.066874|0.054392|0.058164|0.061648|0.077117|0.115487|0.077067|0.107453|0.124113|0.214836|0.500000| |1.178242|1.279169|1.758173|1.416461|0.038728|2.025298|1.391047|1.498096|1.669994|2.375397|1.964855|3.854384|1.983343|2.197423|0.059903|2.034508|3.208702|2.957635|2.574454|2.909734|3.596108|0.072464|2.837177|3.490582|3.350561|3.880296|5.170201|5.702742|4.339326|13.031906|8.948489|5.641883|4.948927|5.628755|8.862293|17.729813|0.032972|0.031820|0.031338|0.038726|0.041946|0.039396|0.045409|0.049425|0.045424|0.055849|0.049987|0.055835|0.073037|0.071900|0.078079|0.096267|0.070035|0.078049|0.079165|0.096512|0.155983|0.114668|0.124447|0.107469|0.123803|0.213848|0.500000| 1459.124436 -9657.557621 3801.444414 -198.457743 -4595.446513 3134.603274 -1460.843239 2.001178 408B000000000012 44C36F1B9310D4F4 4444D0FC54B08E69 42A188C70A9CFFFD BC0A903520000001 44CB60EF4D8987EB