Version2.0 2020-07-30T11:06:45Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 11-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1cc2c(cc1[C@@H]3CCC[NH+]3CC(=O)NC(=O)NC4CCCC4)OCCCO2 C08310469 RHF 6-31G(d) (6D,7F) c1cc2c(cc1[C@@H]3CCC[NH+]3CC(=O)NC(=O)NC4CCCC4)OCCCO2 C01[X(C21H30N3O4)] 168 C1 480 O=C(NC(=O)C[NH+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)NC1CCCC1 O=C(NC(=O)C[NH+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)NC1CCCC1 O=C(C[NH+]1CCC[C@H]1c2ccc3OCCCOc3c2)NC(=O)NC4CCCC4 InChIKey=PBDQXBLJKYQBHZ-KRWDZBQOSA-O InChI=1S/C21H29N3O4/c25-20(23-21(26)22-16-5-1-2-6-16)14-24-10-3-7-17(24)15-8-9-18-19(13-15)28-12-4-11-27-18/h8-9,13,16-17H,1-7,10-12,14H2,(H2,22,23,25,26)/p+1/t17-/m0/s1 InChI=1/C21H29N3O4/c25-20(23-21(26)22-16-5-1-2-6-16)14-24-10-3-7-17(24)15-8-9-18-19(13-15)28-12-4-11-27-18/h8-9,13,16-17H,1-7,10-12,14H2,(H2,22,23,25,26)/p+1/t17-/m0/s1/fC21H30N3O4/h22-24H/q+1 c1cc2c(cc1[C@@H]3CCC[NH+]3CC(=O)NC(=O)NC4CCCC4)OCCCO2 C01[X(C21H30N3O4)] 168 C01 480 O=C(NC(=O)C[NH+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)NC1CCCC1 O=C(C[NH]1CCC[C@H]1[C]1[CH][CH][C]2[C]([CH]1)OCCCO2)NC(=O)NC1CCCC1 O=C(C[NH]1CCC[C@H]1[C]2[CH][CH][C]3OCCCO[C]3[CH]2)NC(=O)NC4CCCC4 InChIKey=REMKOAGLFZOTAZ-KRWDZBQOSA-N InChI=1S/C21H30N3O4/c25-20(23-21(26)22-16-5-1-2-6-16)14-24-10-3-7-17(24)15-8-9-18-19(13-15)28-12-4-11-27-18/h8-9,13,16-17,24H,1-7,10-12,14H2,(H2,22,23,25,26)/t17-/m0/s1 InChI=1/C21H30N3O4/c25-20(23-21(26)22-16-5-1-2-6-16)14-24-10-3-7-17(24)15-8-9-18-19(13-15)28-12-4-11-27-18/h8-9,13,16-17,24H,1-7,10-12,14H2,(H2,22,23,25,26)/t17-/m0/s1/f/h22-23H 2599.8832099473 -1275.329634 1-A 18373.7849 104 376 480 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -20.68748 -20.67894 -20.67638 -20.63247 -15.83444 -15.73828 -15.68581 -11.51307 -11.49300 -11.44865 -11.43929 -11.42801 -11.40276 -11.40154 -11.37723 -11.37460 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104.3331 129.6371 142.1389 148.2557 172.7285 190.1696 222.3650 244.6290 258.9232 278.1675 284.0484 345.8591 367.5175 373.3952 382.7233 385.3045 405.0664 444.6418 484.1145 488.6893 496.6262 503.5470 529.7099 543.0413 586.9075 598.8063 616.4282 645.4566 657.8799 668.5856 677.0661 686.5324 722.1942 758.1889 802.6420 816.0746 819.0777 831.2869 838.8458 864.4057 875.7063 889.5291 908.3313 918.1486 942.4124 943.2221 963.4365 970.3451 990.0955 1000.2770 1005.6538 1017.6110 1027.0831 1042.0506 1048.2899 1052.7396 1065.6434 1069.3352 1081.1280 1088.4815 1097.7981 1106.0827 1118.4418 1132.2634 1152.9703 1183.2203 1184.4063 1191.3464 1201.1747 1222.9016 1226.8321 1233.9396 1252.5420 1272.5242 1298.3163 1304.3364 1321.5088 1323.6264 1332.1504 1341.3477 1346.1205 1357.8234 1362.2552 1378.1159 1388.7127 1390.9355 1402.4678 1416.5356 1431.4696 1432.2728 1433.1490 1435.6272 1452.4599 1464.0865 1469.6130 1474.2163 1478.9225 1485.6091 1492.2135 1509.2900 1522.9775 1530.6736 1539.0431 1543.2604 1558.1641 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1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 14.00307 1.00783 12.00000 12.00000 15.99491 14.00307 12.00000 15.99491 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 12.00000 15.99491 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 8245.4656 25671.2197 31417.3766 0.99993 0.01166 -0.00031 -0.01167 0.99993 -0.00094 0.00030 0.00095 1.00000 1 0.01050 0.00337 0.00276 0.21888 0.07030 0.05744 15.60 20.93 29.86 34.88 53.19 57.17 61.15 86.37 104.63 113.87 134.46 150.11 186.52 204.51 213.31 248.52 273.61 319.93 351.97 372.53 400.22 408.68 497.61 528.78 537.23 550.65 554.37 582.80 639.74 696.53 703.11 714.53 724.49 762.13 781.32 844.43 861.55 886.90 928.67 946.54 961.95 974.15 987.77 1039.08 1090.86 1154.82 1174.15 1178.47 1196.04 1206.91 1243.69 1259.95 1279.83 1306.89 1321.01 1355.92 1357.09 1386.17 1396.11 1424.53 1439.18 1446.91 1464.12 1477.74 1499.28 1508.26 1514.66 1533.22 1538.53 1555.50 1566.08 1579.49 1591.41 1609.19 1629.07 1658.87 1702.39 1704.10 1714.08 1728.22 1759.48 1765.14 1775.36 1802.13 1830.88 1867.99 1876.65 1901.36 1904.40 1916.67 1929.90 1936.77 1953.61 1959.98 1982.80 1998.05 2001.25 2017.84 2038.08 2059.57 2060.72 2061.98 2065.55 2089.77 2106.49 2114.45 2121.07 2127.84 2137.46 2146.96 2171.53 2191.22 2202.30 2214.34 2220.41 2241.85 2250.08 2257.18 2313.15 2318.76 2337.22 2346.76 2347.97 2358.62 2367.72 2368.68 2374.31 2377.89 2387.33 2404.48 2405.08 2442.27 2443.58 2448.93 2549.13 2601.01 2836.04 2948.11 4581.76 4595.28 4607.48 4618.73 4633.57 4644.53 4666.74 4687.98 4691.08 4700.86 4703.07 4704.32 4707.93 4712.27 4716.46 4727.50 4730.40 4742.51 4757.85 4770.37 4777.53 4780.14 4791.58 4825.73 4835.57 4857.81 4898.77 5249.87 5537.82 5545.25 0.541803 0.566836 0.567780 0.480109 -1274.787831 -1274.762798 -1274.761854 -1274.849525 2.940500D-04 MUNgauss RevisionA2.0 retrievium 30-Jul-2020 DUDE c1cc2c(cc1[C@@H]3CCC[NH+]3CC(=O)NC(=O)NC4CCCC4)OCCCO2 C08310469 RHF 6-31G(d) (6D,10F) C1 388.223632 |X|Y|Z| 116.075106 63.622552 29.197848 59.965346 26 6 7 8 21 3 2 |36.858105| |13.806429|36.858105| |7.897781|13.713403|36.858105| |6.843202|7.936249|13.666877|36.858105| |7.964650|6.927750|7.938224|13.729532|36.858105| |13.685925|7.936352|6.815829|7.867537|13.734886|36.858105| |7.516393|5.019350|4.428559|5.026592|7.621713|12.636204|36.858105| |5.580678|4.201297|3.998435|4.822887|7.432125|8.927002|17.593791|0.500000| |5.995134|4.258589|3.679412|3.930871|5.190198|7.337302|12.452719|0.245920|36.858105| |4.320604|3.299548|2.911919|3.087375|3.886257|4.975867|7.794545|0.190000|12.361780|36.858105| |4.323446|3.306519|2.930550|3.125335|3.959134|5.043368|7.902619|0.197785|7.758161|12.374178|36.858105| |6.083604|4.308267|3.722111|3.993071|5.324933|7.558701|12.534142|0.254449|8.077549|7.873921|12.641448|53.358707| |6.807106|4.680470|3.816316|3.867350|4.870202|7.122697|9.171395|0.181477|7.250703|6.858557|9.337604|25.618371|0.500000| |5.044446|3.950318|3.595722|3.932210|5.053446|6.127920|7.481182|0.195941|5.083822|5.064455|7.576577|17.541195|0.265706|36.858105| |4.230344|3.490786|3.112516|3.210882|3.783035|4.488841|5.009169|0.127292|4.001922|4.190239|6.044545|10.673160|0.223324|12.431143|36.858105| |4.346365|3.546728|3.038972|3.022083|3.492395|4.300180|4.760462|0.115007|4.090178|4.331931|6.012268|10.013476|0.253154|8.119623|15.990485|73.516695| |3.393456|2.970481|2.755558|2.861644|3.252389|3.597446|3.854542|0.103478|3.167557|3.313337|4.455730|7.091876|0.142541|7.832298|14.055628|14.856587|53.358707| |2.813825|2.533377|2.351080|2.391111|2.634338|2.883312|3.050330|0.081695|2.649856|2.810445|3.601537|5.330076|0.110981|5.018609|7.725308|11.665854|18.133057|36.858105| |2.683453|2.401803|2.195481|2.205710|2.427425|2.702878|2.900242|0.076627|2.611267|2.832571|3.600892|5.091527|0.108799|4.422402|6.689841|11.917785|11.340859|16.073280|73.516695| |2.486254|2.304599|2.191777|2.237429|2.412341|2.553094|2.635481|0.071882|2.293883|2.390060|2.946209|4.358350|0.089365|4.045069|5.332937|8.154238|11.278802|14.134733|14.959817|53.358707| |2.125387|1.999514|1.905722|1.924929|2.043349|2.151937|2.211349|0.060254|1.979855|2.069431|2.473676|3.560090|0.073697|3.115723|3.908479|6.435446|7.040823|7.793052|11.993929|17.766732|36.858105| |1.893958|1.804864|1.752918|1.786087|1.878005|1.935644|1.976327|0.054662|1.772646|1.839668|2.157913|3.090382|0.062998|2.682872|3.152414|5.132047|5.471155|5.116248|7.940601|10.454937|12.449414|36.858105| |1.699472|1.636168|1.586302|1.597912|1.661149|1.713536|1.737676|0.047758|1.584405|1.639655|1.885317|2.680105|0.055224|2.255582|2.619967|4.417062|4.296199|3.913501|6.549399|6.935811|7.848371|12.344638|36.858105| |1.776066|1.712974|1.639693|1.627942|1.686394|1.761012|1.775593|0.048121|1.627688|1.680337|1.928669|2.757359|0.057822|2.294460|2.730711|4.737483|4.394477|4.117869|7.189477|6.917626|7.936441|7.697877|12.259045|36.858105| |2.072454|1.983237|1.879991|1.861803|1.941197|2.047967|2.061220|0.055404|1.863310|1.919415|2.244607|3.267725|0.069117|2.778269|3.453606|5.964755|5.762969|5.815780|9.813109|10.256366|12.449126|7.930735|7.740018|12.406754|36.858105| |4.614109|5.210052|7.896857|14.129566|8.148364|5.258594|3.942846|0.111469|3.226332|2.644704|2.673142|4.425278|0.086237|3.294063|2.744661|4.548460|3.451394|2.155168|3.523487|2.804258|1.791962|1.693495|1.519934|1.532139|1.729563|73.516695| |3.783150|4.371495|6.269998|7.982880|5.498094|4.068523|3.214521|0.090536|2.674393|2.280082|2.352842|3.844216|0.075900|2.971426|2.571457|4.242798|3.335204|2.113314|3.426371|2.808825|1.806025|1.726753|1.554349|1.561983|1.756464|23.906269|36.858105| |3.496938|4.297670|6.134919|6.135363|4.299406|3.490395|2.777730|0.076039|2.400462|2.057234|2.099896|3.384092|0.068566|2.567541|2.305406|3.897865|2.990681|1.939637|3.183045|2.584005|1.688957|1.613469|1.474491|1.496530|1.672943|13.857997|12.550388|36.858105| |4.075932|5.495460|7.983464|6.270297|4.372150|3.774334|2.916542|0.077117|2.528059|2.151283|2.201800|3.604075|0.074978|2.707902|2.479632|4.268872|3.172389|2.063049|3.403637|2.720862|1.777000|1.672862|1.534725|1.580671|1.784091|11.112903|7.508572|12.550517|36.858105| |5.271430|8.140405|14.160849|7.913333|5.217729|4.604965|3.376086|0.086867|2.951286|2.427611|2.433841|4.030742|0.084749|2.908680|2.621087|4.585967|3.251315|2.095681|3.496172|2.706371|1.760240|1.636478|1.499374|1.552234|1.759623|11.820409|6.258573|7.801281|13.446197|73.516695| |17.696009|8.998244|5.646448|4.935618|5.635584|8.824371|6.870760|0.138882|6.274183|4.670324|4.616043|8.547624|0.219117|4.890775|4.369995|8.542865|4.646860|2.883844|5.011726|3.403243|2.153456|1.894504|1.709997|1.805604|2.112374|6.507411|3.127319|2.958753|3.437388|7.602463|0.500000| |8.903835|17.744457|9.002389|5.666556|4.982841|5.636322|4.078660|0.096233|3.679280|2.964584|2.958118|5.037889|0.114465|3.416255|3.180318|5.905325|3.735363|2.406490|4.108883|2.991719|1.936286|1.744496|1.600261|1.692296|1.952360|7.491224|3.759603|3.924133|5.232412|13.391856|0.216386|0.500000| |5.638203|4.980994|5.674165|9.038026|17.714503|8.854835|7.021154|0.227927|4.879392|3.821782|3.909763|6.789827|0.120626|4.899812|3.589253|5.750890|4.308182|2.561258|4.173871|3.223077|2.005793|1.864700|1.640700|1.645531|1.880052|13.489437|5.250299|3.934436|3.765375|7.512251|0.123318|0.108048|0.500000| |6.800764|4.707904|3.835672|3.863347|4.809592|6.978371|8.842909|0.174342|17.593090|8.751418|6.251120|9.313384|0.200071|4.532942|3.819088|7.272279|4.108557|2.574315|4.563737|3.030717|1.939527|1.727094|1.558062|1.618036|1.854242|5.546232|2.610839|2.405062|2.595259|5.494909|0.221551|0.115799|0.119103|0.500000| |5.137111|3.926724|3.548079|3.875888|5.032811|6.333285|8.824151|0.219012|17.622061|8.655486|5.727294|7.849498|0.144136|4.157164|3.323782|5.930453|3.738449|2.333907|4.071716|2.807845|1.800229|1.634895|1.469056|1.499944|1.697615|5.816592|2.667250|2.389532|2.469514|5.136524|0.141410|0.094532|0.136678|0.303815|0.500000| |3.932755|3.077435|2.677595|2.755253|3.326776|4.199793|5.766064|0.138902|8.731609|17.622470|8.748614|8.322648|0.167192|4.244112|3.809483|7.354177|4.152323|2.675008|4.911462|3.091534|1.998703|1.768744|1.594083|1.647823|1.873967|4.221657|2.076226|1.909330|2.015758|4.044518|0.123267|0.079028|0.089277|0.225343|0.187948|0.500000| |3.626901|2.892344|2.638857|2.849014|3.550391|4.246688|6.259179|0.175014|8.725625|17.614159|8.824208|8.100625|0.141270|4.354678|3.608848|6.422138|4.069062|2.568186|4.578149|3.028420|1.943301|1.752055|1.563408|1.586128|1.790926|4.463539|2.168911|1.946993|2.001086|3.970146|0.104960|0.072413|0.100831|0.176455|0.221991|0.303633|0.500000| |3.872277|3.047112|2.674857|2.776602|3.371885|4.207792|5.754706|0.142945|5.827683|8.583111|17.668299|12.285494|0.237035|6.611794|6.430870|12.509040|6.392132|3.947678|7.344318|4.256713|2.644230|2.261156|1.982091|2.049248|2.398694|4.257109|2.152166|1.952081|2.066138|4.025489|0.118752|0.077772|0.091136|0.146692|0.125610|0.221900|0.183301|0.500000| |3.726537|2.965837|2.724972|2.979158|3.769960|4.476358|6.684689|0.196586|6.111382|8.712232|17.635102|12.373852|0.183729|7.342742|5.633938|9.121857|6.099440|3.596649|6.258267|4.075135|2.501541|2.212691|1.912848|1.924789|2.223739|4.652042|2.319484|2.043409|2.103697|4.065330|0.105878|0.073552|0.108209|0.135290|0.139925|0.178577|0.228367|0.300846|0.500000| |4.103071|3.348102|3.169040|3.563479|4.554679|5.090905|6.436366|0.194812|4.629110|4.852074|7.230532|12.351482|0.184381|17.627088|8.696300|10.759333|9.682152|4.743448|7.372504|5.390897|3.064653|2.700681|2.245803|2.234730|2.659879|5.540489|2.825837|2.411689|2.475461|4.656541|0.109419|0.081169|0.131732|0.110681|0.109851|0.111086|0.123366|0.170400|0.234699|0.500000| |5.732271|4.591958|4.289410|4.808533|6.252003|7.182114|7.247446|0.190807|4.700755|4.297618|5.593423|12.408514|0.215176|17.605419|8.851931|11.491636|9.203298|4.519833|6.922472|5.258944|2.992324|2.624083|2.215044|2.251365|2.722834|6.973708|3.538451|2.985923|3.160321|5.999666|0.143144|0.106776|0.162957|0.119321|0.110613|0.101744|0.104679|0.136769|0.150443|0.300327|0.500000| |3.245094|2.879104|2.750627|2.930615|3.338893|3.551553|3.780413|0.105495|3.048925|3.149943|4.154176|6.599795|0.126167|7.572178|9.405797|10.815535|26.010221|9.171850|10.932834|10.571153|4.885328|4.081050|3.128037|3.079606|3.910802|4.699976|2.574629|2.266711|2.359705|4.244198|0.088129|0.073010|0.092526|0.079337|0.074790|0.079238|0.080712|0.116125|0.121233|0.215460|0.193898|0.500000| |2.558995|2.402344|2.318619|2.380615|2.543769|2.642159|2.671462|0.073345|2.285157|2.333606|2.848111|4.328268|0.088013|4.103443|5.125176|7.616984|10.676255|9.444577|10.927792|26.023710|9.059007|7.121304|4.769609|4.620083|6.508264|3.921155|2.238633|2.046288|2.146370|3.745590|0.070257|0.063273|0.069459|0.061480|0.057414|0.061021|0.060468|0.081926|0.080628|0.111542|0.113720|0.230736|0.500000| |2.047065|1.906958|1.805332|1.824943|1.952794|2.075861|2.169793|0.059102|1.972319|2.098101|2.513261|3.519431|0.072841|3.017287|3.798283|6.397823|6.596759|7.406759|13.289513|12.657470|17.616343|8.843420|6.775066|6.956944|8.873098|3.014452|1.691435|1.582789|1.662925|2.957324|0.058180|0.051355|0.053392|0.053619|0.049753|0.056730|0.054891|0.075860|0.070746|0.083151|0.078587|0.124307|0.181004|0.500000| |1.825184|1.728120|1.684807|1.733956|1.837432|1.887860|1.951902|0.054550|1.756202|1.839434|2.160523|3.045382|0.061294|2.639586|3.039714|4.900189|5.241912|4.735278|7.439429|8.987070|8.702796|17.579167|8.624443|5.664078|5.660282|2.937531|1.675754|1.554741|1.596979|2.787201|0.050621|0.046139|0.051195|0.047150|0.045166|0.048970|0.049104|0.062710|0.062419|0.075472|0.070938|0.111174|0.168771|0.217198|0.500000| |1.946920|1.872405|1.837617|1.878249|1.959675|1.994842|2.009511|0.055773|1.781664|1.824268|2.132188|3.108276|0.063129|2.730903|3.146394|5.043345|5.479799|4.806499|7.158954|9.905765|8.859838|17.497594|8.766961|6.266581|6.826781|3.184962|1.847787|1.721741|1.778621|3.059145|0.053521|0.050114|0.054097|0.048165|0.045783|0.048390|0.048248|0.061212|0.060762|0.076240|0.075834|0.117281|0.221672|0.174597|0.302552|0.500000| |1.590955|1.525611|1.477976|1.492622|1.557511|1.609136|1.646198|0.045383|1.515435|1.581131|1.809575|2.532997|0.052017|2.106395|2.424474|4.114406|3.909303|3.522881|6.081171|5.919992|6.300687|8.750785|17.581698|8.718249|5.864334|2.529399|1.447004|1.372342|1.422690|2.483302|0.044605|0.041445|0.042907|0.041323|0.039149|0.042855|0.042116|0.053009|0.051210|0.058749|0.056921|0.079013|0.110900|0.173835|0.221915|0.176534|0.500000| |1.621632|1.576662|1.541930|1.553099|1.600084|1.634314|1.642157|0.045262|1.495872|1.534392|1.747111|2.497939|0.051361|2.094722|2.382791|4.008667|3.851225|3.356488|5.554498|5.824868|5.781774|8.740608|17.588882|8.660160|6.018725|2.647422|1.536422|1.463170|1.516579|2.611400|0.045042|0.042894|0.043955|0.040886|0.038751|0.041359|0.040757|0.050533|0.049256|0.057969|0.057875|0.079063|0.117713|0.137915|0.189159|0.226098|0.304409|0.500000| |1.703859|1.634541|1.555404|1.542033|1.603948|1.686325|1.714993|0.046385|1.590858|1.657049|1.894621|2.668681|0.056114|2.186670|2.604735|4.596486|4.104211|3.852765|7.092232|6.069560|6.631090|6.060195|8.738123|17.565033|8.820253|2.574753|1.465528|1.406618|1.486299|2.615330|0.048491|0.044977|0.043486|0.044017|0.040718|0.045480|0.043505|0.056421|0.052409|0.059249|0.058908|0.078956|0.109512|0.189089|0.138096|0.135117|0.228626|0.179140|0.500000| |1.706533|1.665139|1.599492|1.577347|1.616560|1.679512|1.674708|0.045294|1.539089|1.573898|1.785089|2.567630|0.054037|2.116390|2.478247|4.330708|3.898424|3.496935|6.084091|5.686517|5.711853|5.790257|8.634390|17.590686|8.715083|2.648978|1.529526|1.479097|1.566495|2.718020|0.048089|0.046001|0.043667|0.042708|0.039565|0.042949|0.041271|0.052344|0.049254|0.056945|0.058372|0.076324|0.110597|0.139664|0.124951|0.146803|0.184298|0.222985|0.304010|0.500000| |2.158148|2.092704|1.997150|1.969258|2.030238|2.122619|2.097650|0.056322|1.875312|1.900955|2.211749|3.289558|0.069663|2.822076|3.455099|5.895650|5.749700|5.390918|8.561167|9.614736|8.866639|6.941375|6.518970|8.773342|17.499949|3.257295|1.882090|1.798518|1.926534|3.340234|0.060521|0.057293|0.054358|0.051945|0.047553|0.051259|0.049161|0.064756|0.060696|0.074349|0.078737|0.110415|0.194299|0.174583|0.139577|0.196274|0.135822|0.159734|0.174592|0.219809|0.500000| |2.149844|2.046626|1.910928|1.873002|1.957364|2.096265|2.114821|0.056159|1.929898|1.995205|2.331746|3.384583|0.072814|2.825835|3.595888|6.470691|5.772285|5.891769|10.958561|8.852664|8.699090|5.644758|5.604853|8.643765|17.588606|3.062301|1.734616|1.661572|1.789991|3.172168|0.061732|0.056404|0.052220|0.053827|0.048530|0.054638|0.051287|0.070210|0.063245|0.073914|0.076157|0.104503|0.152474|0.216232|0.124790|0.138406|0.131233|0.127292|0.219838|0.193802|0.301485|0.500000| |3.863396|4.368173|5.923573|7.332230|5.515165|4.174581|3.318803|0.093438|2.693830|2.329239|2.465578|4.092113|0.080701|3.285672|2.850135|4.622193|3.747744|2.348533|3.750350|3.144273|1.996971|1.908518|1.701558|1.706411|1.936259|16.511490|17.519449|8.816574|6.853229|9.949907|0.089046|0.104197|0.146045|0.072742|0.073130|0.058744|0.061169|0.062920|0.067779|0.086388|0.111749|0.081287|0.070637|0.051448|0.051222|0.057267|0.043693|0.046739|0.044147|0.046336|0.058141|0.052801|0.500000| |3.198114|3.550033|4.714616|5.917760|4.617818|3.499322|2.902738|0.083669|2.455940|2.127347|2.186761|3.487895|0.068135|2.700912|2.343160|3.851846|3.078800|1.967805|3.194616|2.638166|1.708673|1.652942|1.490163|1.484183|1.652479|17.030341|17.644179|8.866032|5.494850|8.413839|0.075314|0.086625|0.131260|0.065884|0.068905|0.053813|0.057040|0.055572|0.060689|0.073053|0.087407|0.066594|0.058334|0.044569|0.044865|0.049161|0.038695|0.041070|0.038724|0.040369|0.048981|0.045088|0.301297|0.500000| |2.986927|3.559216|4.667601|4.667769|3.560181|2.982109|2.454187|0.067618|2.137676|1.869876|1.924308|3.062138|0.062074|2.357384|2.154611|3.633768|2.846844|1.869299|3.059853|2.525255|1.663883|1.605835|1.474068|1.490817|1.655448|10.096638|8.951654|17.522994|8.949837|10.099248|0.072013|0.092761|0.092951|0.059351|0.058901|0.048451|0.049390|0.050133|0.052361|0.062050|0.075458|0.060199|0.055837|0.043119|0.042904|0.047885|0.038039|0.040917|0.038778|0.041145|0.049696|0.045388|0.212015|0.216921|0.500000| |3.266707|3.972382|5.512766|5.514114|3.975104|3.261525|2.633323|0.072271|2.331112|1.989863|1.995121|3.163863|0.064019|2.350635|2.108252|3.596201|2.719412|1.775700|2.942229|2.356112|1.551838|1.484363|1.364032|1.384017|1.536108|12.668824|8.911636|17.568763|8.909686|12.674142|0.077591|0.102073|0.102418|0.065050|0.065502|0.051503|0.052662|0.051431|0.053899|0.061761|0.074486|0.057006|0.051346|0.040697|0.039910|0.043704|0.035472|0.037570|0.036346|0.037996|0.045516|0.042516|0.173603|0.213582|0.301784|0.500000| |4.181570|5.514575|7.330931|5.918374|4.364680|3.852242|2.988072|0.078667|2.541541|2.189847|2.290197|3.800487|0.079557|2.933347|2.723909|4.655574|3.516590|2.278549|3.719488|3.019776|1.957005|1.835066|1.675295|1.731129|1.973891|9.931845|6.846300|8.811315|17.527497|16.513779|0.098561|0.145859|0.104186|0.072284|0.067738|0.056933|0.056223|0.060095|0.060785|0.073691|0.096734|0.072677|0.066873|0.050389|0.048296|0.054584|0.042811|0.046001|0.044895|0.047698|0.059877|0.054876|0.204882|0.140726|0.211911|0.173543|0.500000| |3.505031|4.617573|5.921580|4.716708|3.551518|3.192603|2.551012|0.067329|2.271671|1.957896|1.990952|3.196250|0.067027|2.383379|2.228467|3.885031|2.869275|1.900354|3.163568|2.517714|1.667534|1.574976|1.461100|1.511269|1.691506|8.408629|5.494658|8.865043|17.649004|17.032709|0.085211|0.130838|0.086762|0.065356|0.061823|0.051567|0.050741|0.052426|0.052775|0.060823|0.075563|0.058893|0.054861|0.043440|0.041681|0.046391|0.037688|0.040244|0.039567|0.041877|0.050714|0.047259|0.140794|0.123688|0.216710|0.213603|0.301455|0.500000| 1273.822000 -8158.736141 3182.467640 -172.766570 -3875.213070 2599.883397 -1275.329673 2.001184 40CF30000000000B 43F452FD05AB17EB 4378E509D37F8083 427F7A8783732003 C044800000000001 4427C09E4E67B56A