Version2.1 2021-01-08T05:30:43Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 04-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)C(=O)N1C[C@@H](C2(C1)CC[NH2+]CC2)C(=O)NC[C@@H](c3ccc(cc3)OC)[NH+]4CCCC4 C39663999 RHF 6-31G(d) (6D,7F) CC(C)C(=O)N1C[C@@H](C2(C1)CC[NH2+]CC2)C(=O)NC[C@@H](c3ccc(cc3)OC)[NH+]4CCCC4 C01[X(C26H42N4O3)] 219 C1 579 COc1ccc(cc1)[C@@H]([NH+]1CCCC1)CNC(=O)[C@H]1CN(CC21CC[NH2+]CC2)C(=O)C(C)C COc1ccc(cc1)[C@@H]([NH+]1CCCC1)CNC(=O)[C@H]1CN(CC21CC[NH2+]CC2)C(=O)C(C)C COc1ccc(cc1)[C@H](CNC(=O)[C@H]2CN(CC23CC[NH2+]CC3)C(=O)C(C)C)[NH+]4CCCC4 InChIKey=HUBVIKWFFPHMGX-PKTZIBPZSA-P InChI=1S/C26H40N4O3/c1-19(2)25(32)30-17-22(26(18-30)10-12-27-13-11-26)24(31)28-16-23(29-14-4-5-15-29)20-6-8-21(33-3)9-7-20/h6-9,19,22-23,27H,4-5,10-18H2,1-3H3,(H,28,31)/p+2/t22-,23+/m1/s1 InChI=1/C26H40N4O3/c1-19(2)25(32)30-17-22(26(18-30)10-12-27-13-11-26)24(31)28-16-23(29-14-4-5-15-29)20-6-8-21(33-3)9-7-20/h6-9,19,22-23,27H,4-5,10-18H2,1-3H3,(H,28,31)/p+2/t22-,23+/m1/s1/fC26H42N4O3/h27-29H/q+2 CC(C)C(=O)N1C[C@@H](C2(C1)CC[NH2+]CC2)C(=O)NC[C@@H](c3ccc(cc3)OC)[NH+]4CCCC4 C01[X(C26H42N4O3)] 219 C01 579 COc1ccc(cc1)[C@@H]([NH+]1CCCC1)CNC(=O)[C@H]1CN(CC21CC[NH2+]CC2)C(=O)C(C)C CO[C]1[CH][CH][C]([CH][CH]1)[C@@H]([NH]1CCCC1)CNC(=O)[C@H]1CN(CC21CC[NH2]CC2)C(=O)C(C)C CO[C]1[CH][CH][C]([CH][CH]1)[C@H](CNC(=O)[C@H]2CN(CC23CC[NH2]CC3)C(=O)C(C)C)[NH]4CCCC4 InChIKey=AJMKDFOGXGPVFB-PKTZIBPZSA-N InChI=1S/C26H42N4O3/c1-19(2)25(32)30-17-22(26(18-30)10-12-27-13-11-26)24(31)28-16-23(29-14-4-5-15-29)20-6-8-21(33-3)9-7-20/h6-9,19,22-23,29H,4-5,10-18,27H2,1-3H3,(H,28,31)/t22-,23+/m1/s1 InChI=1/C26H42N4O3/c1-19(2)25(32)30-17-22(26(18-30)10-12-27-13-11-26)24(31)28-16-23(29-14-4-5-15-29)20-6-8-21(33-3)9-7-20/h6-9,19,22-23,29H,4-5,10-18,27H2,1-3H3,(H,28,31)/t22-,23+/m1/s1/f/h28H 3612.3421281142 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19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 50 51 52 53 54 55 56 57 58 59 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 6 6 6 6 8 7 6 6 1 6 6 6 6 7 1 1 6 6 6 8 7 6 6 1 6 6 6 6 6 6 8 6 7 1 6 6 6 6 1 1 1 1 1 1 1 1 1 1 1 1 1 1 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 15.99491 14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 15.99491 14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 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 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 13096.3437 22486.3861 32877.1536 0.99997 -0.00723 0.00240 0.00722 0.99996 0.00514 -0.00243 -0.00512 0.99998 1 0.00661 0.00385 0.00263 0.13780 0.08026 0.05489 10.01 17.75 30.16 46.29 53.48 54.67 69.47 75.20 79.12 87.58 105.82 122.06 143.62 153.77 186.87 206.01 232.92 261.72 265.76 277.83 292.16 318.73 328.65 337.60 354.85 377.84 381.15 396.09 407.20 414.64 427.58 449.37 480.67 497.21 519.29 542.07 557.60 598.88 609.77 654.82 672.31 691.75 699.02 714.05 717.69 763.70 787.18 802.80 848.40 860.98 871.66 933.33 985.78 1000.05 1018.68 1036.48 1085.11 1123.71 1157.18 1165.59 1199.34 1224.04 1240.54 1250.08 1260.35 1268.78 1293.64 1301.07 1344.27 1349.63 1353.27 1362.55 1372.67 1379.73 1402.14 1406.84 1463.92 1466.59 1482.45 1510.77 1515.13 1522.22 1536.91 1544.25 1557.28 1572.79 1575.76 1586.82 1589.64 1590.60 1600.28 1624.29 1632.13 1641.27 1656.48 1664.87 1676.50 1688.91 1713.26 1734.53 1749.41 1758.99 1764.82 1780.54 1808.51 1831.15 1849.17 1856.69 1872.55 1886.61 1899.66 1900.29 1911.20 1914.24 1932.27 1936.21 1940.20 1951.75 1960.11 1976.79 2016.86 2027.18 2031.98 2070.16 2083.57 2089.88 2094.10 2098.08 2100.61 2106.28 2114.03 2114.95 2122.12 2140.98 2162.09 2174.23 2184.98 2188.84 2201.03 2212.02 2227.52 2227.99 2233.19 2235.86 2247.64 2255.10 2263.52 2264.99 2270.72 2281.41 2283.71 2298.56 2344.66 2345.78 2352.73 2355.67 2356.17 2357.01 2365.37 2369.03 2369.10 2370.76 2373.33 2374.83 2376.95 2384.28 2388.53 2407.30 2417.93 2429.18 2449.14 2463.35 2538.75 2599.97 2627.93 2771.95 2806.69 4603.95 4610.96 4614.79 4617.79 4628.90 4642.29 4644.27 4656.08 4664.17 4686.85 4691.05 4693.85 4700.13 4706.18 4713.34 4717.87 4721.80 4726.61 4728.43 4732.70 4741.70 4746.98 4750.56 4762.49 4765.94 4775.14 4777.01 4780.68 4798.91 4805.37 4809.13 4818.70 4824.81 4830.10 4840.22 4852.46 4901.71 4917.68 5267.61 5322.72 5358.01 5593.59 0.725142 0.756632 0.757577 0.657126 -1450.258758 -1450.227267 -1450.226323 -1450.326773 3.369110D-04 MUNgauss RevisionA2.0 retrievium 08-Jan-2021 DUDE CC(C)C(=O)N1C[C@@H](C2(C1)CC[NH2+]CC2)C(=O)NC[C@@H](c3ccc(cc3)OC)[NH+]4CCCC4 C39663999 RHF 6-31G(d) (6D,10F) C1 458.325692 |X|Y|Z| 31.028441 108.320850 81.917381 65.055301 25 6 7 21 4 |36.858105| |12.442278|36.858105| |7.517223|12.386029|36.858105| |7.616208|12.525186|7.674952|36.858105| |6.699818|7.986875|6.111225|15.893137|73.516695| |5.184561|7.658839|5.713153|13.885928|15.251062|53.358707| |4.407484|6.359206|5.135006|7.512778|9.424718|17.887435|36.858105| |3.303218|4.274222|3.767262|5.173692|7.521206|11.110823|12.345601|36.858105| |3.073501|3.987456|3.762044|4.777671|7.164978|9.480070|8.924839|17.506262|0.500000| |3.232253|3.965976|3.394810|5.236735|8.242226|11.034642|7.810637|12.291665|0.248801|36.858105| |3.916876|4.979943|4.181876|7.826865|12.657231|17.878575|7.889894|8.103280|0.202912|12.372247|36.858105| |3.183796|3.675627|3.021349|4.610771|7.406256|8.520396|6.143694|7.369918|0.152047|12.316442|7.529673|36.858105| |2.858901|3.130923|2.626540|3.916956|6.839793|6.463518|4.280150|4.828061|0.113105|7.441563|6.037883|12.486389|36.858105| |2.405077|2.646612|2.323314|3.243475|5.745642|5.295595|3.614781|4.353967|0.108646|6.468119|5.096570|7.670454|12.643306|53.358707| |2.245214|2.417245|2.138965|2.924344|5.307651|4.577496|3.085773|3.560404|0.091012|4.913889|4.268037|5.667882|9.169183|25.668037|0.500000| |2.232195|2.457012|2.174209|2.923425|5.074212|4.777197|3.431133|4.228508|0.105070|5.805059|4.354017|7.025558|9.189503|25.664123|0.328150|0.500000| |2.421072|2.737500|2.468796|3.428053|6.109146|5.721826|3.836676|4.854673|0.129316|7.465372|6.001152|6.475619|7.594310|17.222619|0.254701|0.255598|36.858105| |2.603007|3.071463|2.781154|3.851620|6.480720|6.977186|4.996843|7.456400|0.200229|12.393105|7.417961|7.571741|6.489465|10.485340|0.157813|0.196463|12.501405|36.858105| |2.790091|3.426304|3.084836|3.796088|5.714923|6.977761|7.374911|12.510116|0.252520|7.220094|5.011178|6.069786|4.173033|5.311519|0.089822|0.112841|4.093978|5.842472|36.858105| |2.490011|2.933979|2.628739|3.256492|5.079769|5.728436|5.350128|7.903374|0.174436|6.456222|4.355394|6.281921|4.443074|5.836549|0.097562|0.131473|4.273239|5.847321|15.808444|73.516695| |2.686670|3.307681|3.095922|3.443937|5.158932|5.937003|6.333506|7.856182|0.199127|4.966831|4.006885|4.327943|3.243729|4.160356|0.073065|0.087776|3.213040|4.258459|14.071974|15.166293|53.358707| |2.283247|2.696413|2.560161|2.747447|4.241354|4.482396|4.324246|5.024930|0.132470|3.750193|3.103890|3.488835|2.767266|3.628199|0.064983|0.078189|2.742951|3.444307|7.786874|12.293104|17.967682|36.858105| |2.278547|2.622686|2.442680|2.597171|4.011142|4.111097|3.890619|4.126930|0.104173|3.275316|2.781505|3.261408|2.621025|3.347144|0.060706|0.072142|2.440468|2.933780|5.789330|9.909630|10.533306|12.365995|36.858105| |2.346328|2.674722|2.424796|2.685545|4.153034|4.288884|4.033421|4.314038|0.104309|3.527225|2.923762|3.684801|2.917171|3.667649|0.066094|0.079870|2.605841|3.112401|6.168565|11.451610|9.596419|8.903488|17.621373|0.500000| |2.480688|2.858712|2.681775|2.705270|4.122117|4.157723|3.954343|3.810705|0.097048|3.017711|2.695232|2.988380|2.423507|3.034763|0.055599|0.063974|2.221737|2.632552|4.764768|7.611826|8.639520|7.457966|12.600951|0.247735|36.858105| |2.755032|3.112152|2.821422|2.868027|4.338146|4.313574|4.040820|3.654589|0.090424|2.993268|2.727427|3.077857|2.499716|3.044165|0.056027|0.063602|2.186546|2.541855|4.292311|6.955897|6.933251|5.207970|7.561048|0.204686|13.646675|36.858105| |2.884744|3.189193|2.937920|2.806286|4.257913|4.042117|3.639674|3.156955|0.079990|2.646658|2.514981|2.694419|2.246380|2.731895|0.050881|0.056331|1.973850|2.256062|3.460710|5.569819|5.449717|3.958538|5.022618|0.133678|7.889213|13.857012|36.858105| |2.679845|2.980235|2.894769|2.599399|3.980796|3.695788|3.276090|2.875428|0.075457|2.400062|2.317107|2.370620|2.006143|2.484511|0.046514|0.051071|1.826193|2.086987|3.105227|4.946044|5.023704|3.705863|4.412951|0.110641|6.790992|7.921192|13.631412|36.858105| |2.427515|2.758125|2.748205|2.477273|3.812672|3.596658|3.230210|2.948529|0.079157|2.411250|2.296636|2.327434|1.964744|2.477461|0.046233|0.051218|1.845224|2.134796|3.268593|5.161075|5.570146|4.304513|4.989716|0.116082|7.862406|6.878093|7.920684|13.685971|36.858105| |2.353324|2.714005|2.656582|2.525529|3.878066|3.794781|3.513781|3.353527|0.089492|2.672625|2.461441|2.569513|2.133206|2.709722|0.050101|0.056638|2.019960|2.378092|3.958368|6.229257|7.224514|6.114498|7.505147|0.155039|13.720249|7.987106|6.904501|7.930413|13.744566|36.858105| |2.662215|2.868417|2.835880|2.448618|3.799867|3.373657|2.873597|2.500652|0.066261|2.144542|2.118511|2.122338|1.832837|2.270234|0.042895|0.046347|1.668710|1.876944|2.612952|4.205223|4.075853|2.959085|3.377477|0.087282|4.613113|5.323398|8.246427|14.351854|7.899108|5.221057|73.516695| |2.379744|2.555832|2.623921|2.203236|3.470702|3.014358|2.518901|2.233991|0.060472|1.930091|1.921836|1.883598|1.648512|2.069832|0.039313|0.042206|1.535913|1.719420|2.314972|3.737296|3.609760|2.644920|2.908598|0.074271|3.765700|3.980481|5.245848|7.990485|6.678443|4.496877|23.987389|36.858105| |1.935636|2.171996|2.053743|2.151639|3.401954|3.321702|2.975307|3.171807|0.082600|2.667006|2.302674|2.681152|2.253426|2.941863|0.054244|0.063942|2.134885|2.490021|4.157301|7.579128|6.848938|7.607531|12.522229|0.254804|7.643222|5.433632|4.077470|3.766176|4.311572|6.047195|5.334535|2.668576|53.358707| |1.865396|2.097608|2.020151|2.062743|3.269310|3.156085|2.809072|2.970456|0.079316|2.484789|2.183101|2.444560|2.074176|2.727085|0.050537|0.058796|2.007665|2.339550|3.777399|6.660124|6.406950|7.054398|9.252226|0.182409|7.116490|4.903285|3.904627|3.823480|4.635341|6.666233|5.427047|2.781882|25.716081|0.500000| |1.767411|1.969233|1.860367|1.995882|3.204294|3.096398|2.702588|3.001247|0.078743|2.612922|2.216256|2.643643|2.265378|3.034507|0.056076|0.067231|2.191451|2.531915|3.943862|7.726932|6.000826|6.340285|7.406262|0.192637|4.905999|3.947131|3.132675|2.907889|3.230620|4.157893|4.314078|2.202861|17.099553|0.257025|36.858105| |1.590700|1.738185|1.645377|1.748398|2.839262|2.656329|2.256789|2.440278|0.064262|2.193575|1.903359|2.255601|1.989974|2.666120|0.050086|0.058875|1.903872|2.135195|3.026956|5.874450|4.462522|4.235414|5.020330|0.136814|3.911632|3.371181|2.796935|2.613914|2.840434|3.452572|3.976784|2.049686|10.618070|0.185778|12.354988|36.858105| |1.616751|1.755462|1.665314|1.732001|2.800112|2.596065|2.210916|2.310986|0.060725|2.060275|1.824007|2.121325|1.867228|2.457514|0.046336|0.053475|1.755440|1.963215|2.804671|5.243311|4.231718|3.931766|5.042279|0.133168|4.323223|3.769489|3.166270|2.973283|3.221905|3.867276|4.493955|2.303292|10.951807|0.201934|7.778809|12.396884|36.858105| |1.851009|2.028956|1.905666|1.983069|3.158611|2.993485|2.614509|2.690595|0.069524|2.340853|2.063287|2.418874|2.076235|2.680557|0.050043|0.058017|1.912452|2.171599|3.334212|6.117694|5.177602|4.901795|7.461770|0.192693|6.387680|5.387283|4.195594|3.782780|4.084062|5.167658|5.454140|2.696856|17.182740|0.260382|7.937906|7.916752|12.536013|36.858105| |17.615055|8.801763|6.828298|6.946067|12.870680|6.357701|3.827348|3.009479|0.079414|3.026553|3.754525|2.945756|2.733276|3.176411|0.061238|0.059649|2.371386|2.500261|2.531153|4.057056|3.297290|2.076229|2.048845|0.058425|2.197593|2.393988|2.485173|2.344985|2.161044|2.103914|4.159707|2.136342|2.401758|0.047428|1.630202|1.474203|1.490099|1.685347|0.500000| |17.569697|8.835101|6.892970|5.531833|8.726606|5.722142|3.851103|2.948901|0.076935|2.816930|3.275494|2.784701|2.502359|2.915460|0.055768|0.055951|2.151433|2.318336|2.575748|4.100682|3.461852|2.200786|2.226750|0.063131|2.473755|2.775501|3.003632|2.827846|2.513761|2.379534|5.134721|2.583457|2.594651|0.051319|1.724669|1.563222|1.606351|1.841165|0.300729|0.500000| |17.556392|8.751818|5.464549|6.881850|11.041669|6.894222|4.327397|3.299082|0.083092|3.318196|3.928280|3.429786|3.106536|3.461813|0.066081|0.065480|2.494230|2.646626|2.821279|4.554068|3.631155|2.280960|2.307678|0.067143|2.488602|2.809770|2.906186|2.625909|2.359659|2.312179|4.596885|2.279327|2.669727|0.051983|1.798816|1.624716|1.649203|1.891269|0.301883|0.301522|0.500000| |8.901080|17.548681|8.871723|8.874087|10.501055|10.042117|7.462227|4.652478|0.116488|4.074206|4.732719|3.856463|3.158787|3.612120|0.066656|0.069558|2.706812|3.101075|3.840561|5.748919|5.149180|3.046113|3.016870|0.085599|3.375198|3.774591|3.888646|3.541601|3.209638|3.153227|5.939429|2.882809|3.322024|0.065121|2.171899|1.902713|1.936378|2.278577|0.173831|0.214164|0.212760|0.500000| |6.846971|8.790641|17.584711|6.990752|11.549015|6.880060|4.287021|3.356439|0.094549|3.160696|3.990287|2.811113|2.522215|3.070528|0.058345|0.058150|2.416235|2.659994|2.750120|4.247763|3.698942|2.283208|2.168424|0.060004|2.337162|2.437893|2.519666|2.488973|2.384512|2.318193|4.370961|2.313173|2.524406|0.050739|1.703829|1.518218|1.528568|1.727031|0.203473|0.169903|0.139821|0.173591|0.500000| |5.456156|8.688893|17.530378|6.944237|9.693497|8.153751|5.735216|4.231822|0.122161|3.634665|4.418520|3.102715|2.649102|3.244724|0.060411|0.062305|2.584509|2.993128|3.411239|5.041052|4.744523|2.823459|2.622230|0.071291|2.865714|2.928450|2.995674|2.996696|2.933673|2.875256|5.104816|2.679934|2.974121|0.060099|1.975509|1.727011|1.738910|1.992327|0.139486|0.140594|0.121992|0.210959|0.301479|0.500000| |6.881912|8.801370|17.576220|5.551394|8.283564|6.086652|4.310417|3.266877|0.090157|2.922790|3.426276|2.672572|2.340525|2.835043|0.053606|0.054743|2.184740|2.442212|2.803384|4.294980|3.926123|2.447086|2.379795|0.065102|2.673802|2.842755|3.062802|3.084847|2.877648|2.696505|5.537079|2.906954|2.748409|0.055509|1.811069|1.615145|1.654007|1.894905|0.169278|0.207102|0.140626|0.213306|0.301220|0.301556|0.500000| |4.524473|6.112428|4.648545|6.456879|8.372936|12.280366|17.539140|8.715434|0.175023|6.460712|6.088823|6.199737|4.258743|4.728230|0.082998|0.093138|3.485150|4.326722|6.988919|9.592838|8.376225|4.403514|4.260793|0.127214|4.435661|4.830971|4.262412|3.630428|3.454410|3.752996|5.581313|2.667418|4.336994|0.082007|2.840297|2.381903|2.362247|2.852604|0.105282|0.111700|0.129198|0.220901|0.107294|0.135448|0.114053|0.500000| |4.355267|6.546674|5.941838|6.687678|8.543956|12.288627|17.586105|8.706802|0.224832|5.680274|5.983982|4.572735|3.453884|4.139421|0.073752|0.081026|3.274184|4.169026|6.310102|8.152535|8.700167|4.389750|3.898805|0.107088|4.152354|4.142571|3.849279|3.606031|3.615627|3.868778|5.608503|2.788955|4.064339|0.080090|2.656441|2.220230|2.202364|2.609125|0.104954|0.109528|0.113054|0.218657|0.130877|0.202526|0.139265|0.302382|0.500000| |3.542095|4.484590|4.110364|6.610961|11.458966|12.325696|6.378076|6.896854|0.206154|8.738836|17.517435|5.507450|4.797764|6.123809|0.107897|0.108296|5.774140|7.120474|4.493880|6.926651|5.105573|2.946189|2.587709|0.073998|2.509005|2.489778|2.317965|2.183576|2.196011|2.345764|3.571135|1.851438|2.959687|0.058013|2.103846|1.810485|1.731158|1.937718|0.096962|0.083871|0.095494|0.115683|0.112388|0.124756|0.093089|0.135727|0.152023|0.500000| |3.953475|4.668632|3.841799|7.350334|14.020745|12.492067|5.833029|5.726514|0.144140|8.585212|17.659836|7.098464|6.791561|7.378257|0.130732|0.122453|6.024713|6.207015|4.060824|6.625355|4.532996|2.692568|2.478574|0.072978|2.412133|2.479535|2.313787|2.124742|2.081235|2.204739|3.500085|1.789274|2.848317|0.055013|2.028070|1.771025|1.701203|1.908626|0.108313|0.090397|0.113278|0.119517|0.105204|0.107583|0.088613|0.139901|0.129529|0.303870|0.500000| |3.724101|4.270034|3.322820|5.313198|8.231394|9.573440|6.783198|6.662326|0.137474|8.743618|7.116958|17.578161|9.027285|7.630170|0.127237|0.143391|4.881890|5.502188|5.492024|9.529038|5.695277|3.372598|3.275228|0.103246|3.113937|3.332896|2.951269|2.548028|2.444859|2.657737|4.070663|2.004765|3.625235|0.067428|2.557805|2.204686|2.116997|2.447584|0.093264|0.089174|0.115104|0.126966|0.084619|0.092560|0.081659|0.210762|0.136381|0.141514|0.193352|0.500000| |2.822283|3.222793|2.715885|3.800835|6.077929|6.734857|5.393849|6.812935|0.141760|8.781233|5.510119|17.618014|8.907399|9.348985|0.143840|0.204349|5.636038|6.741037|6.852952|14.649659|6.403540|3.902660|3.680090|0.119720|3.231077|3.289183|2.792138|2.431386|2.405616|2.711237|3.817841|1.898364|4.102984|0.074864|3.025034|2.546114|2.356266|2.696705|0.072155|0.070341|0.084066|0.096163|0.069741|0.078060|0.068150|0.158206|0.116778|0.122933|0.141449|0.303293|0.500000| |3.077779|3.319707|2.763300|4.304179|7.916379|6.786713|4.146062|4.404314|0.106618|6.617678|6.538513|8.703012|17.644891|12.443190|0.225070|0.181151|6.948886|5.698364|3.650805|6.599813|4.003767|2.503546|2.374425|0.072152|2.246859|2.331847|2.139976|1.928585|1.878601|2.009354|3.170713|1.612323|2.791560|0.053015|2.039614|1.807445|1.714929|1.902319|0.083349|0.073501|0.093207|0.090166|0.074979|0.076337|0.067675|0.112337|0.094091|0.143746|0.237958|0.214563|0.173029|0.500000| |2.683076|2.851704|2.392624|3.412932|5.957484|5.382761|3.691616|4.015618|0.094895|5.441738|4.602211|8.780848|17.628644|12.364259|0.222939|0.224180|5.579440|4.888978|3.699903|7.187854|4.032501|2.604370|2.536894|0.079457|2.345679|2.450919|2.203344|1.950643|1.894947|2.050962|3.178416|1.602600|3.011374|0.056185|2.235360|1.993296|1.873309|2.074690|0.070996|0.066114|0.082286|0.080761|0.063735|0.066326|0.060236|0.106259|0.084766|0.105510|0.141552|0.212576|0.217237|0.301864|0.500000| |2.553561|2.867748|2.588177|3.690686|6.861273|5.968916|3.753177|4.446428|0.120578|6.682836|6.545545|5.724759|6.967328|12.426059|0.223918|0.181020|17.623976|8.728012|3.609002|6.435583|3.983562|2.490667|2.240940|0.065922|2.086299|2.073961|1.902642|1.769402|1.775974|1.916923|2.903424|1.508390|2.671285|0.051630|1.987095|1.743316|1.628153|1.775341|0.070652|0.062324|0.072790|0.076863|0.071594|0.074574|0.062973|0.093695|0.089687|0.181616|0.200305|0.129050|0.131603|0.209734|0.143320|0.500000| |2.135470|2.387987|2.200428|2.898774|5.187489|4.685651|3.230974|4.034742|0.111350|5.449049|4.575655|4.870313|5.576316|12.356545|0.223143|0.223735|17.629554|8.767281|3.601148|6.798328|3.972860|2.566272|2.274978|0.066902|2.057473|2.004362|1.813570|1.692656|1.722982|1.887878|2.756937|1.438619|2.764004|0.053331|2.116800|1.852149|1.693405|1.819060|0.058402|0.053416|0.060742|0.065682|0.060142|0.064159|0.054728|0.082313|0.079097|0.128347|0.126509|0.107565|0.126739|0.143286|0.126460|0.301306|0.500000| |2.369378|2.765817|2.523668|3.312064|5.498239|5.838431|4.518440|6.880214|0.181778|8.826101|5.461339|6.777786|5.684076|9.438942|0.144728|0.207555|8.897115|17.558253|6.509129|12.955598|6.269140|3.834618|3.200696|0.095011|2.768118|2.624113|2.286231|2.109461|2.180260|2.473772|3.339597|1.719300|3.720976|0.070741|2.850989|2.366613|2.132365|2.346990|0.062696|0.059586|0.067147|0.079213|0.066440|0.075536|0.062727|0.113187|0.107197|0.144535|0.130824|0.138564|0.196658|0.131789|0.128146|0.172945|0.215415|0.500000| |2.530276|3.018034|2.833342|3.763819|6.392935|6.655365|4.722399|6.796680|0.216194|8.775908|6.916000|5.495625|4.871030|7.633825|0.127111|0.144144|8.998437|17.566755|5.238859|8.775782|5.577411|3.319231|2.770927|0.079472|2.519542|2.401192|2.159044|2.034696|2.103922|2.331320|3.269159|1.704029|3.228459|0.062946|2.399191|2.027318|1.872067|2.058332|0.068224|0.062900|0.070013|0.083457|0.076037|0.086370|0.068762|0.109723|0.115391|0.218478|0.156524|0.122970|0.138211|0.127784|0.107584|0.213052|0.212696|0.303410|0.500000| |2.881377|3.651173|3.515867|3.704675|5.448679|6.304920|6.946134|7.497360|0.206472|4.668500|4.055257|3.949617|3.019895|3.843524|0.068283|0.079366|3.014558|3.936856|9.338977|10.867965|26.070683|9.057662|6.340023|0.155515|6.170403|5.038983|4.182768|4.001072|4.504599|5.661321|5.768837|2.891065|5.959581|0.118859|3.748514|2.911061|2.839402|3.450139|0.071814|0.076189|0.077833|0.117152|0.084095|0.113419|0.091022|0.177765|0.223004|0.107509|0.092706|0.109001|0.113446|0.078101|0.076250|0.078215|0.075959|0.112891|0.108839|0.500000| |2.163891|2.551935|2.496147|2.564528|3.987482|4.089510|3.841190|4.310512|0.120423|3.279227|2.824912|2.991470|2.442121|3.235982|0.058706|0.069022|2.485202|3.074380|5.848325|9.118906|12.596103|17.593028|8.768900|0.173876|6.768694|4.642274|3.749343|3.724933|4.589274|6.651108|5.314083|2.744841|9.310003|0.205984|5.634959|3.969568|3.773091|4.529301|0.055020|0.058479|0.059274|0.079267|0.062028|0.077278|0.066934|0.105822|0.113211|0.076261|0.068363|0.080752|0.090208|0.062455|0.063773|0.063522|0.065349|0.093331|0.084816|0.229347|0.500000| |2.107068|2.454270|2.322976|2.556819|4.020324|4.179299|3.866840|4.750491|0.126176|3.745637|3.014120|3.514082|2.832166|3.818006|0.068186|0.084061|2.881561|3.616834|7.453282|13.872954|12.663630|17.668673|8.769056|0.214424|5.470410|4.214746|3.307814|3.087660|3.488644|4.626459|4.528675|2.306447|9.549320|0.175182|7.270127|4.578475|3.932417|4.601073|0.053820|0.056051|0.058864|0.075505|0.058487|0.070604|0.061283|0.107960|0.105406|0.079860|0.073272|0.091398|0.112078|0.070182|0.074224|0.071292|0.076014|0.116787|0.095968|0.183310|0.302578|0.500000| |2.792454|3.106000|2.727939|2.923724|4.441528|4.434797|4.102946|3.752456|0.090122|3.163487|2.831753|3.399155|2.738998|3.280025|0.060193|0.068911|2.304657|2.657652|4.438087|7.484801|6.636877|4.879458|7.012204|0.227123|8.873940|17.694960|9.006314|5.648157|4.953034|5.658009|7.654257|3.331733|6.998522|0.122538|3.961671|3.413581|3.727928|5.260653|0.067307|0.077067|0.081099|0.104172|0.066082|0.077565|0.075265|0.141639|0.110864|0.070509|0.072247|0.103818|0.102858|0.070113|0.075703|0.060393|0.058327|0.076491|0.068378|0.127797|0.115554|0.115237|0.500000| |3.041181|3.240715|2.921740|2.806060|4.285903|3.943349|3.430216|2.929297|0.073780|2.534005|2.445425|2.631676|2.225546|2.675165|0.050156|0.054852|1.912749|2.151029|3.116995|5.095699|4.682779|3.335526|4.090234|0.114168|5.614683|8.907391|17.746180|8.948057|5.654025|4.970773|13.542524|4.869554|4.681333|0.090650|2.764884|2.526015|2.837514|3.628594|0.072089|0.089372|0.086454|0.109640|0.069940|0.080500|0.085399|0.112953|0.098651|0.062171|0.063507|0.081449|0.074977|0.059349|0.061228|0.051585|0.048695|0.060016|0.056895|0.098950|0.087158|0.080013|0.215966|0.500000| |2.257642|2.548290|2.611315|2.291490|3.569327|3.287470|2.881019|2.657377|0.072883|2.201132|2.121862|2.102125|1.800540|2.293592|0.043045|0.047295|1.721989|1.979180|2.889458|4.587709|4.846387|3.740612|4.084522|0.096231|5.631065|4.959155|5.625517|8.857051|17.771806|8.958989|12.493910|7.378755|5.058642|0.114050|2.901679|2.594622|2.920748|3.517637|0.056546|0.065260|0.060344|0.080501|0.063647|0.077787|0.076651|0.083386|0.090208|0.057145|0.053608|0.060841|0.059916|0.048136|0.048140|0.046252|0.044969|0.055968|0.054792|0.109667|0.114609|0.086581|0.107600|0.124049|0.500000| |2.154809|2.487294|2.478654|2.357625|3.662194|3.558765|3.247674|3.221624|0.088435|2.573273|2.359313|2.431715|2.038319|2.636235|0.048811|0.055302|1.987940|2.347734|3.830694|6.071791|7.094294|6.433171|6.880798|0.139145|8.854120|5.643257|4.965264|5.665711|9.023111|17.670438|7.499928|3.915378|8.352064|0.209675|4.346263|3.554027|3.885147|4.882556|0.054261|0.060140|0.058526|0.078462|0.060883|0.075409|0.069353|0.093136|0.099455|0.063425|0.058550|0.068551|0.071370|0.053307|0.054187|0.052224|0.052121|0.068405|0.064721|0.153672|0.223927|0.136580|0.123673|0.107778|0.219991|0.500000| |2.461509|2.695664|2.851158|2.312132|3.628760|3.159167|2.644935|2.335143|0.064063|1.997077|2.004851|1.916266|1.672042|2.107242|0.039946|0.042820|1.580162|1.780014|2.391979|3.809014|3.764782|2.717205|2.892479|0.073165|3.701465|3.772337|4.733224|6.992698|6.664270|4.544514|16.406868|17.585615|3.563283|0.076418|2.176620|1.997456|2.205335|2.566974|0.061610|0.074052|0.064443|0.084002|0.069427|0.082194|0.088540|0.076362|0.083157|0.054125|0.051482|0.056405|0.053305|0.045578|0.044778|0.043221|0.041103|0.049231|0.049434|0.085573|0.079498|0.065480|0.087818|0.119442|0.221861|0.112953|0.500000| |2.117618|2.272563|2.321216|2.004272|3.182062|2.773055|2.318199|2.105591|0.057174|1.825007|1.796278|1.784941|1.568806|1.986210|0.037779|0.040734|1.472256|1.645554|2.218142|3.621589|3.475222|2.619637|2.906811|0.073413|3.722649|3.799269|4.769588|7.037189|6.677411|4.559535|16.411415|17.588763|3.749076|0.081059|2.263289|2.132299|2.434972|2.821210|0.053308|0.062974|0.056825|0.070568|0.057535|0.066330|0.070112|0.067941|0.070562|0.048208|0.046492|0.052291|0.050403|0.042408|0.042495|0.039972|0.038531|0.046073|0.045305|0.076270|0.076360|0.063804|0.088433|0.120366|0.220123|0.113030|0.298050|0.500000| |2.344381|2.455803|2.524238|2.103593|3.347211|2.832279|2.316831|2.048983|0.055417|1.800917|1.811084|1.768333|1.565062|1.961818|0.037465|0.039868|1.451269|1.607678|2.095356|3.409911|3.197178|2.323201|2.537198|0.066041|3.173895|3.421218|4.429315|5.897712|4.888182|3.613323|16.969590|17.683161|3.194562|0.067263|1.978062|1.861306|2.079443|2.396044|0.058766|0.071715|0.062346|0.075900|0.062477|0.070311|0.078594|0.068097|0.070499|0.048481|0.047294|0.052454|0.049228|0.042775|0.042416|0.039799|0.037789|0.044439|0.044232|0.070545|0.066307|0.057151|0.082479|0.121977|0.144757|0.089137|0.299949|0.299955|0.500000| |1.711367|1.919095|1.837257|1.956206|3.152154|3.041467|2.643258|2.987762|0.080425|2.586028|2.198034|2.545563|2.192960|2.986936|0.055215|0.066046|2.199414|2.559867|3.901911|7.518252|6.027694|6.492995|6.315902|0.155530|4.405277|3.497231|2.857374|2.728464|3.096500|3.972342|4.086093|2.123992|12.219668|0.236456|17.658971|8.626769|5.960489|5.823900|0.044115|0.046306|0.048001|0.058301|0.046933|0.054676|0.049538|0.075356|0.072925|0.058772|0.055556|0.067605|0.079934|0.055118|0.059411|0.055317|0.059585|0.080564|0.068454|0.105389|0.172876|0.221324|0.095324|0.070052|0.079004|0.121178|0.059060|0.060680|0.052948|0.500000| |1.847376|2.061261|1.919356|2.118729|3.399936|3.330839|2.912565|3.310736|0.084995|2.916248|2.410169|3.010917|2.555038|3.423610|0.062687|0.077024|2.436920|2.827680|4.490779|9.420278|6.443809|6.482440|7.340218|0.222725|4.711650|3.963465|3.099125|2.801137|3.027701|3.828465|4.176549|2.110457|12.322523|0.183784|17.644016|8.680844|5.976403|6.537671|0.047284|0.049635|0.052638|0.063159|0.048862|0.056453|0.051442|0.085625|0.077648|0.062850|0.061266|0.079945|0.098582|0.062852|0.070330|0.060593|0.065105|0.090086|0.072966|0.107853|0.146592|0.222260|0.115513|0.077059|0.074939|0.107611|0.058015|0.059385|0.053025|0.301489|0.500000| |1.477582|1.611822|1.540782|1.624981|2.656702|2.456767|2.063920|2.240186|0.059908|2.028028|1.773656|2.059874|1.840288|2.496593|0.047182|0.055034|1.798869|2.004950|2.728135|5.249510|4.012412|3.743731|4.135539|0.110239|3.349466|2.892685|2.469220|2.359753|2.586597|3.088760|3.644029|1.911208|8.086907|0.158180|8.730250|17.625803|8.712579|5.750451|0.038283|0.040359|0.041729|0.048590|0.039725|0.045013|0.042031|0.059678|0.056736|0.047323|0.045932|0.055597|0.063897|0.046702|0.051018|0.045850|0.049080|0.061669|0.053412|0.073731|0.101186|0.113619|0.080271|0.062292|0.067054|0.090513|0.052037|0.055487|0.048399|0.223253|0.181140|0.500000| 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