Version2.1 2021-01-12T23:07:49Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 06-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@H](C(=O)N1CCCCCC1)OC(=O)c2cc(ccc2N3CCOCC3)S(=O)(=O)N(C)C C08725773 RHF 6-31G(d) (6D,7F) C[C@H](C(=O)N1CCCCCC1)OC(=O)c2cc(ccc2N3CCOCC3)S(=O)(=O)N(C)C C01[X(C22H33N3O6S1)] 189 C1 550 C[C@H](C(=O)N1CCCCCC1)OC(=O)c1cc(ccc1N1CCOCC1)S(=O)(=O)N(C)C C[C@H](C(=O)N1CCCCCC1)OC(=O)c1cc(ccc1N1CCOCC1)S(=O)(=O)N(C)C C[C@@H](OC(=O)c1cc(ccc1N2CCOCC2)[S](=O)(=O)N(C)C)C(=O)N3CCCCCC3 InChIKey=XAPVUKPRBRXIMV-QGZVFWFLSA-N InChI=1S/C22H33N3O6S/c1-17(21(26)25-10-6-4-5-7-11-25)31-22(27)19-16-18(32(28,29)23(2)3)8-9-20(19)24-12-14-30-15-13-24/h8-9,16-17H,4-7,10-15H2,1-3H3/t17-/m1/s1 InChI=1/C22H33N3O6S/c1-17(21(26)25-10-6-4-5-7-11-25)31-22(27)19-16-18(32(28,29)23(2)3)8-9-20(19)24-12-14-30-15-13-24/h8-9,16-17H,4-7,10-15H2,1-3H3/t17-/m1/s1 C[C@H](C(=O)N1CCCCCC1)OC(=O)c2cc(ccc2N3CCOCC3)S(=O)(=O)N(C)C C01[X(C22H33N3O6S1)] 189 C01 550 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978.9772 992.5440 1016.7484 1020.3810 1039.0173 1058.7872 1077.9707 1078.3560 1098.1312 1115.9739 1122.8217 1126.5617 1135.2638 1153.3721 1161.3361 1169.3907 1191.7476 1196.3959 1202.0240 1218.8593 1226.8384 1229.3659 1229.6728 1242.0699 1253.1180 1258.0677 1271.3891 1280.7552 1285.0454 1295.5081 1306.7501 1330.4732 1335.4379 1346.2976 1347.9008 1352.7730 1369.7307 1393.8151 1409.4381 1411.8570 1423.8115 1425.4837 1435.6418 1438.3392 1450.2012 1455.5246 1468.9664 1480.9528 1494.9064 1499.8673 1505.1029 1524.4941 1536.0881 1539.6717 1541.5140 1542.9187 1546.0489 1551.6488 1560.4213 1561.6300 1562.5356 1587.6400 1590.1526 1614.8715 1618.7931 1630.9528 1635.7455 1637.0628 1638.8664 1641.2819 1643.0690 1645.5767 1646.8210 1647.7636 1647.9494 1649.8242 1654.9215 1658.9843 1664.5092 1665.9765 1668.2698 1668.8444 1751.3566 1798.8640 1925.5147 1982.2336 3150.4642 3157.9673 3181.4938 3188.6224 3192.1224 3196.4868 3197.3769 3206.5359 3211.0163 3212.0448 3225.4538 3225.8739 3228.2218 3233.8493 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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 14030.1368 20714.4934 30324.9155 0.99980 -0.02003 -0.00192 0.02001 0.99974 -0.01057 0.00214 0.01053 0.99994 1 0.00617 0.00418 0.00286 0.12863 0.08712 0.05951 13.10 24.31 35.54 47.72 54.62 67.26 89.27 98.40 101.27 121.16 126.46 128.15 147.90 179.24 231.50 247.89 259.09 283.80 300.47 306.12 315.05 324.86 339.14 349.75 363.87 407.77 426.93 434.27 454.79 470.65 476.17 496.30 513.06 550.99 572.97 587.85 594.44 621.91 627.57 647.67 674.04 683.76 720.90 740.44 760.99 774.43 788.01 800.54 831.48 873.76 905.15 927.57 976.89 992.40 1045.58 1094.87 1129.62 1135.43 1177.63 1182.58 1201.05 1265.42 1277.80 1285.52 1306.14 1356.32 1369.73 1372.02 1382.43 1391.70 1408.53 1428.05 1462.87 1468.10 1494.91 1523.36 1550.96 1551.51 1579.97 1605.64 1615.49 1620.87 1633.39 1659.45 1670.90 1682.49 1714.66 1721.35 1729.44 1753.67 1765.15 1768.78 1769.22 1787.06 1802.96 1810.08 1829.25 1842.72 1848.89 1863.95 1880.12 1914.25 1921.40 1937.02 1939.33 1946.34 1970.74 2005.39 2027.87 2031.35 2048.55 2050.95 2065.57 2069.45 2086.52 2094.18 2113.52 2130.76 2150.84 2157.97 2165.51 2193.41 2210.09 2215.24 2217.89 2219.92 2224.42 2232.48 2245.10 2246.84 2248.14 2284.26 2287.87 2323.44 2329.08 2346.58 2353.47 2355.37 2357.96 2361.44 2364.01 2367.62 2369.41 2370.76 2371.03 2373.73 2381.06 2386.91 2394.86 2396.97 2400.27 2401.09 2519.81 2588.16 2770.39 2851.99 4532.82 4543.61 4577.46 4587.72 4592.75 4599.03 4600.31 4613.49 4619.94 4621.42 4640.71 4641.31 4644.69 4652.79 4659.10 4666.48 4693.82 4700.49 4720.77 4722.24 4729.55 4735.74 4745.70 4760.96 4773.98 4790.96 4821.08 4825.01 4826.18 4842.79 4897.34 4920.09 4959.42 0.592757 0.622679 0.623623 0.528040 -1861.681261 -1861.651339 -1861.650394 -1861.745978 3.205903D-04 MUNgauss RevisionA2.0 retrievium 12-Jan-2021 DUDE C[C@H](C(=O)N1CCCCCC1)OC(=O)c2cc(ccc2N3CCOCC3)S(=O)(=O)N(C)C C08725773 RHF 6-31G(d) (6D,10F) C1 467.209008 |X|Y|Z| 101.636721 81.098851 38.056229 67.945970 23 6 7 8 19 2 2 |36.858105| |12.479351|36.858105| |8.837257|17.702539|0.500000| |7.557727|12.415413|0.242738|36.858105| |5.829553|8.035628|0.166978|15.853054|73.516695| |5.949926|7.664112|0.194428|14.032288|15.125310|53.358707| |4.271772|4.992782|0.127582|7.941421|12.718421|17.733106|36.858105| |3.407563|4.127979|0.110838|5.918616|10.346230|10.435242|12.457470|36.858105| |3.032841|3.616883|0.103442|4.617692|7.545591|8.221230|7.387623|12.438237|36.858105| |3.360089|4.083664|0.124942|4.867331|7.320848|8.853712|6.200435|7.331526|12.413732|36.858105| |3.867715|4.437316|0.136231|5.138214|7.276915|10.343695|6.516007|5.932362|7.417692|12.405355|36.858105| |5.584035|6.469106|0.194506|7.603985|9.415003|17.797377|7.624526|5.678135|5.616021|7.344517|12.404964|36.858105| |7.917931|13.473658|0.261704|8.113501|13.217068|7.214452|4.026128|3.590691|3.131251|3.398578|3.459062|4.460351|73.516695| |6.065953|8.054218|0.213463|5.343715|8.787731|5.523126|3.217246|2.982572|2.724978|3.011927|3.038431|3.720514|25.536676|36.858105| |5.828776|7.126856|0.224976|4.677635|7.300716|5.211332|3.007745|2.790505|2.642137|3.018581|3.103121|3.765771|15.322037|15.999792|73.516695| |4.345032|5.204739|0.135189|4.146461|7.477836|4.438453|2.758930|2.633958|2.394247|2.556254|2.516450|2.947925|14.600877|12.726470|14.065073|36.858105| |4.111189|4.735934|0.115471|4.109586|7.993984|4.337918|2.786274|2.645654|2.336556|2.413968|2.374530|2.780976|12.888312|7.728323|9.479733|13.699234|36.858105| |3.182418|3.541386|0.089257|3.249540|6.387544|3.600575|2.400858|2.330185|2.076088|2.111242|2.054682|2.336975|8.499722|5.074800|7.064393|7.887885|13.783915|36.858105| |2.745184|3.047497|0.079973|2.776947|5.289009|3.176167|2.124741|2.096917|1.914342|1.964032|1.897229|2.115362|6.998717|4.450947|6.603831|6.833326|7.961650|13.753912|36.858105| |2.810234|3.159139|0.085615|2.785157|5.126527|3.211021|2.110091|2.088299|1.942848|2.035195|1.964538|2.183275|7.234765|5.005727|7.698047|7.919015|6.919713|7.967563|13.799781|36.858105| |3.383120|3.910053|0.107735|3.261119|5.827945|3.693166|2.352061|2.300819|2.147644|2.299457|2.236362|2.528913|9.361931|7.449821|11.209027|13.505983|7.869819|6.797712|7.851798|13.650396|36.858105| |3.184969|3.652271|0.106542|3.009371|5.185905|3.525122|2.229349|2.193068|2.104296|2.305396|2.245617|2.501147|8.046311|6.437137|11.821363|7.765345|5.129461|4.528432|5.140030|7.829165|13.563915|53.358707| |2.599674|2.961107|0.086925|2.564891|4.461331|3.093280|2.003979|2.015286|1.964284|2.137854|2.046044|2.210318|6.209419|4.448366|8.143817|5.156053|3.953345|3.780545|4.509988|6.637324|7.783938|17.826903|36.858105| |2.468277|2.787040|0.084462|2.415782|4.106912|2.994558|1.934722|1.951300|1.947929|2.161631|2.073244|2.201761|5.538326|3.859142|7.579860|4.003402|3.162000|2.961411|3.332377|4.366168|5.129957|10.746268|12.519843|36.858105| |2.466676|2.689656|0.081565|2.291346|3.855427|2.858021|1.837587|1.821596|1.819519|2.028895|1.993343|2.133719|5.243749|3.668093|7.514989|3.694724|2.941061|2.732484|3.020694|3.857136|4.552333|9.267488|7.918036|13.632123|73.516695| |2.918221|3.140298|0.095894|2.569021|4.261396|3.162853|1.993427|1.938084|1.918158|2.156493|2.161404|2.372311|6.144158|4.498737|9.896033|4.325883|3.313204|2.962086|3.177503|4.037593|5.135990|10.693525|6.769042|8.182352|24.135587|36.858105| |3.173570|3.422962|0.100372|2.763569|4.677760|3.293309|2.075315|2.003749|1.936183|2.136921|2.137699|2.394359|7.160191|5.595144|11.498289|5.956917|4.280371|3.785154|4.137477|5.603561|7.829882|17.719108|7.933594|6.786611|14.067601|12.551087|36.858105| |2.796918|3.005877|0.074796|2.924998|5.946208|3.310976|2.291806|2.221483|1.949955|1.931437|1.884239|2.124372|6.690114|3.673491|5.370450|4.713854|6.964053|10.749718|6.932145|4.726859|4.164403|4.336835|2.815431|2.328492|3.874751|2.328552|2.816973|388.023441| |2.340517|2.483142|0.063374|2.408896|4.769296|2.809559|1.962068|1.923872|1.721055|1.707064|1.661641|1.841477|5.335881|3.027711|4.610700|3.822852|4.960822|7.398021|6.559858|4.452172|3.681523|3.966484|2.673810|2.210809|3.688705|2.174913|2.609236|94.694611|73.516695| |3.064526|3.157898|0.076653|3.072587|6.275271|3.456742|2.389986|2.249789|1.954589|1.934302|1.924546|2.205593|6.892358|3.643946|5.347855|4.371957|6.354079|7.363740|5.027116|3.873008|3.676723|3.958144|2.522436|2.143927|3.644613|2.230738|2.673839|94.802506|13.596371|73.516695| |2.672668|2.964736|0.073867|3.054306|6.458077|3.480349|2.479364|2.464484|2.124520|2.053640|1.963647|2.185328|6.428314|3.373412|4.964308|4.070439|5.547783|6.930065|5.213268|3.941957|3.600001|3.903147|2.606122|2.198591|3.596450|2.129346|2.491458|82.663895|13.712130|13.732410|53.358707| |2.345155|2.637469|0.067672|2.718509|5.599661|3.178150|2.281047|2.338835|2.056568|1.984387|1.863010|2.027136|5.611943|3.039007|4.583833|3.663391|4.552318|5.717051|5.075913|3.928576|3.458565|3.831442|2.663164|2.237077|3.592326|2.077712|2.400013|51.188605|11.668628|8.900952|17.805508|36.858105| |3.032779|3.434106|0.083331|3.738172|8.456633|4.164632|3.011735|2.975498|2.469292|2.343841|2.235567|2.517579|7.357249|3.598219|5.229918|4.062133|5.427748|5.608115|4.215066|3.475523|3.407793|3.780040|2.489367|2.148648|3.522624|2.107175|2.426196|50.917916|8.878101|11.723969|17.747131|7.736248|36.858105| |17.598824|8.863217|0.214173|5.508044|8.099581|6.223586|3.469768|2.906222|2.664950|2.981647|3.379070|4.555461|12.675295|6.479110|12.052672|4.560128|4.124610|3.198059|2.810510|2.936553|3.600933|4.705230|2.761480|2.632671|4.787995|3.286351|3.594300|19.511274|4.139594|5.310433|3.468498|2.253406|2.798160|0.500000| |17.583728|8.782139|0.209390|6.814994|9.119964|8.646627|4.520669|3.480603|3.157396|3.546581|4.349083|6.625071|10.108311|4.652744|8.355309|3.518558|3.344837|2.702650|2.379897|2.438492|2.875439|3.775660|2.330305|2.260530|4.036044|2.648702|2.786965|17.307786|3.690748|4.711449|3.217972|2.105187|2.679511|0.301367|0.500000| |17.578332|8.861653|0.173826|6.960347|10.853740|7.276807|4.157073|3.291642|2.845047|3.021751|3.397132|4.667529|12.800614|5.385935|8.596515|4.223151|4.293338|3.340152|2.801571|2.781363|3.255263|4.037224|2.441654|2.277963|4.030096|2.643069|2.934408|21.581829|4.442038|6.146293|3.920365|2.461312|3.314414|0.299933|0.300670|0.500000| |4.249789|4.792623|0.116253|7.642492|14.530078|12.541205|17.668614|8.870936|5.462259|4.630563|4.801508|5.738070|7.191524|3.179359|5.158664|2.789170|2.908111|2.516306|2.189105|2.134945|2.352465|2.977905|1.958871|1.864685|3.152862|1.925678|2.035702|17.502139|3.704734|4.638392|3.663251|2.427231|3.359294|0.095279|0.121392|0.121735|0.500000| |3.885550|4.231144|0.111252|5.884591|9.299571|12.504962|17.564216|8.781519|6.851428|5.879675|6.931752|7.440911|6.071977|2.825517|4.809066|2.435946|2.444804|2.133713|1.909885|1.903555|2.110675|2.756614|1.833402|1.789806|3.053174|1.860365|1.915221|14.576035|3.164144|3.819565|2.980028|2.024667|2.600175|0.089344|0.119565|0.104676|0.303302|0.500000| |3.502876|4.463547|0.118789|6.487867|12.150020|9.776730|8.955227|17.559815|8.810119|6.450381|5.066748|5.148368|7.204456|3.325360|5.403497|2.962767|2.987470|2.616946|2.341531|2.326297|2.567542|3.290792|2.217373|2.119549|3.469300|2.071109|2.164348|17.560394|3.762233|4.378101|3.795378|2.660767|3.422361|0.083402|0.095706|0.094183|0.211988|0.174176|0.500000| |2.962223|3.442984|0.091365|4.694166|8.729177|7.638546|8.903277|17.517436|8.888760|5.436476|4.634317|4.416603|5.511249|2.617206|4.340291|2.375434|2.428658|2.184420|1.968736|1.937737|2.097079|2.706252|1.844614|1.779486|2.958605|1.758000|1.822770|15.171633|3.309946|3.847285|3.265103|2.286324|2.901639|0.071149|0.083884|0.081452|0.221840|0.206908|0.303981|0.500000| |2.683755|3.203557|0.091981|3.937869|6.690900|6.400691|5.462649|8.902337|17.529161|8.868632|5.467569|4.376353|5.137323|2.568326|4.416695|2.307118|2.252069|2.030972|1.893041|1.922484|2.103204|2.811427|1.959374|1.944937|3.194773|1.868274|1.881842|13.581587|3.021948|3.355614|2.861653|2.073248|2.420962|0.066745|0.076149|0.070446|0.123797|0.139258|0.219058|0.212604|0.500000| |2.774678|3.163691|0.089825|3.927931|6.466534|6.987503|6.523981|8.856615|17.494864|8.905514|6.918894|5.050038|4.870106|2.409521|4.187603|2.133868|2.094523|1.878607|1.737289|1.757179|1.927210|2.577312|1.774244|1.767411|2.965671|1.756859|1.766044|12.699621|2.824548|3.207418|2.632260|1.868154|2.229515|0.068157|0.081748|0.072951|0.139046|0.194701|0.173957|0.220876|0.304468|0.500000| |3.615303|4.674086|0.148454|5.435399|8.053546|9.057782|5.717664|6.704927|8.787061|17.511545|8.791960|7.037518|6.987050|3.494039|6.218184|2.919570|2.706053|2.337932|2.178708|2.281651|2.616460|3.584554|2.429462|2.452498|4.034348|2.415779|2.397915|14.898374|3.272852|3.690699|3.029573|2.158867|2.536980|0.089603|0.102566|0.089026|0.124024|0.139714|0.189837|0.137476|0.209941|0.173632|0.500000| |2.889354|3.403569|0.104986|3.837114|5.954258|6.496459|4.644152|5.448259|8.923356|17.539792|8.896797|5.504522|5.198250|2.678165|4.846596|2.312130|2.171374|1.927098|1.819196|1.896596|2.126378|2.944264|2.041246|2.097369|3.502997|2.067447|2.016494|12.549785|2.808888|3.123024|2.543799|1.827181|2.097043|0.073129|0.084588|0.072540|0.102744|0.127644|0.137370|0.123920|0.221812|0.214590|0.304240|0.500000| |3.619339|4.028315|0.128390|4.276325|6.156011|7.675255|4.782792|4.470718|5.513385|8.811837|17.534877|8.995937|5.679296|2.909853|5.447060|2.406308|2.235192|1.943034|1.816558|1.902210|2.172861|3.027654|2.037550|2.102884|3.631120|2.215444|2.147148|12.573226|2.797764|3.200735|2.477007|1.736045|2.036138|0.091072|0.113622|0.087062|0.105724|0.140620|0.111680|0.102426|0.124852|0.147650|0.200020|0.227680|0.500000| |3.451119|3.767746|0.110457|4.438611|6.598181|8.759164|6.496147|5.777885|7.185635|8.857604|17.544903|8.802949|5.368740|2.655329|4.769839|2.251709|2.163243|1.896636|1.749159|1.792632|2.010680|2.728018|1.838643|1.855160|3.185966|1.932285|1.919534|12.596204|2.790577|3.237701|2.522401|1.755843|2.112145|0.083898|0.108989|0.086956|0.134342|0.222588|0.129164|0.132986|0.145409|0.220324|0.174196|0.203180|0.305736|0.500000| |5.630606|5.595967|0.159528|6.184905|8.191381|12.365343|6.500659|4.684851|4.564184|5.456589|8.860065|17.514617|7.050512|3.359677|6.084307|2.703647|2.581281|2.187556|1.978304|2.029545|2.329656|3.131744|2.033331|2.026167|3.544404|2.226549|2.247948|14.333101|3.121694|3.775634|2.791518|1.888544|2.346691|0.127771|0.206708|0.132917|0.147196|0.197923|0.116443|0.108098|0.101660|0.122099|0.140870|0.123937|0.209103|0.223910|0.500000| |6.266104|7.641563|0.272754|7.260340|8.887722|12.493873|5.636709|4.655652|4.694623|6.382009|8.942204|17.675746|8.927554|4.311519|8.109371|3.264556|2.972424|2.460661|2.244553|2.359443|2.796608|3.834180|2.453948|2.468612|4.275049|2.717468|2.713641|15.502751|3.362484|3.995906|3.003827|2.052884|2.502923|0.147270|0.200272|0.135010|0.128369|0.146823|0.125763|0.103278|0.108249|0.115471|0.191417|0.141807|0.230904|0.176346|0.304269|0.500000| |4.755438|5.406252|0.123386|4.803556|9.763418|4.871012|3.119504|2.881735|2.480567|2.534986|2.525779|3.025842|14.915956|7.254213|8.958841|8.954367|17.801459|8.957661|5.666520|4.982821|5.624789|5.666073|3.309812|2.776186|4.657591|2.962397|3.658481|47.389469|8.105244|12.640352|7.687381|4.341805|6.179350|0.126989|0.104970|0.145639|0.092532|0.075255|0.090159|0.073443|0.065519|0.061839|0.078214|0.062488|0.065164|0.064242|0.078482|0.088476|0.500000| |2.392242|2.613709|0.068944|2.434208|4.647980|2.839655|1.932054|1.919889|1.760514|1.790460|1.725975|1.900705|5.764527|3.558926|5.470288|4.934257|5.661001|8.929083|17.753320|8.924301|5.610078|5.678077|3.919291|2.985249|4.838635|2.795694|3.505613|46.992763|13.545973|8.289850|6.869697|5.220470|3.886832|0.067749|0.058588|0.068138|0.055425|0.048614|0.059148|0.050634|0.048643|0.044697|0.054646|0.046403|0.045984|0.044568|0.049671|0.055518|0.124560|0.500000| |2.465875|2.736712|0.075463|2.441380|4.451986|2.881193|1.911124|1.907004|1.799068|1.886988|1.816345|1.987679|5.991628|4.066762|6.624542|5.635125|4.980556|5.677603|9.001935|17.769600|8.915471|9.774000|7.410055|4.678862|7.253622|4.036063|5.386016|27.849512|6.962685|5.799458|4.590382|3.482553|2.973741|0.071780|0.060543|0.067385|0.053403|0.048336|0.058553|0.049412|0.049777|0.045452|0.058448|0.049412|0.049237|0.046209|0.051510|0.059567|0.108103|0.216944|0.500000| |2.351179|2.606790|0.075254|2.286014|4.015515|2.773554|1.819613|1.823874|1.772780|1.907854|1.838145|1.980254|5.419667|3.772457|6.812185|4.471417|3.629972|3.636387|4.520809|6.617131|6.616414|12.199335|17.458316|8.919846|12.601800|5.890153|7.052577|19.609788|4.796504|4.370354|3.413508|2.575866|2.345961|0.069560|0.058849|0.062217|0.049781|0.046550|0.055340|0.046849|0.049149|0.044886|0.059348|0.050781|0.050852|0.046385|0.051198|0.060393|0.084611|0.113445|0.237584|0.500000| |2.526007|2.939556|0.085708|2.617111|4.617948|3.152803|2.063944|2.110682|2.052491|2.211307|2.075847|2.222058|6.201023|4.276159|7.476656|5.042586|4.013395|3.919672|4.719967|6.729675|7.252505|12.447198|17.578618|8.876780|10.163417|5.035011|5.702914|20.829105|4.941216|4.563737|3.795593|2.927774|2.655474|0.072898|0.063057|0.066351|0.056072|0.052072|0.065296|0.053761|0.057484|0.051143|0.070279|0.058619|0.056912|0.051821|0.056270|0.067846|0.093183|0.114749|0.206287|0.300150|0.500000| |2.171141|2.429323|0.072947|2.158863|3.701198|2.710636|1.779666|1.812009|1.820606|2.001908|1.906457|1.993408|4.762428|3.194245|6.117160|3.345221|2.762515|2.657057|3.013821|3.821986|4.176861|7.719711|8.848711|17.599131|16.920929|5.879882|5.048049|15.253340|3.680180|3.495165|2.784517|2.112527|1.986657|0.063660|0.055862|0.056191|0.047693|0.045970|0.054475|0.046288|0.050938|0.046138|0.062493|0.054518|0.053766|0.047781|0.051156|0.061272|0.068056|0.077151|0.117511|0.217827|0.210676|0.500000| |2.632195|3.046345|0.094784|2.636408|4.419364|3.288512|2.103999|2.136752|2.156947|2.434695|2.311515|2.438926|5.953941|4.118173|8.268021|4.043844|3.171419|2.895270|3.151910|3.998758|4.863842|9.657887|8.880043|17.508230|16.541000|7.274966|5.909937|16.304582|3.808447|3.779296|3.001593|2.237924|2.197640|0.077270|0.067277|0.066497|0.055686|0.053887|0.064678|0.053577|0.059890|0.053911|0.077947|0.065774|0.065420|0.056747|0.061511|0.076845|0.078571|0.077813|0.113380|0.174382|0.216663|0.299936|0.500000| |2.751420|2.854760|0.086304|2.351947|3.897646|2.930209|1.858377|1.792521|1.777727|1.992747|2.025485|2.219567|5.453163|3.846098|8.335406|3.677619|2.940627|2.659346|2.824707|3.459890|4.186074|7.694869|5.050164|5.887035|16.907975|17.605517|8.856187|15.260522|3.593404|3.706727|2.657520|1.894448|1.931087|0.087081|0.070278|0.069574|0.049985|0.048669|0.052634|0.045422|0.047922|0.045682|0.061085|0.053301|0.058044|0.050755|0.058771|0.070180|0.074391|0.070244|0.096633|0.132413|0.110428|0.132291|0.147466|0.500000| |3.234258|3.549998|0.112774|2.846759|4.618002|3.523868|2.182057|2.116723|2.113162|2.424988|2.440280|2.688036|6.760029|4.964349|11.839031|4.385847|3.326750|2.892206|3.010248|3.725158|4.858630|9.588380|5.874887|7.261743|16.512812|17.542868|8.910606|16.288508|3.744313|3.933520|2.899248|2.069551|2.149006|0.101269|0.081919|0.079263|0.057864|0.056495|0.062762|0.052741|0.056856|0.053468|0.076282|0.064484|0.070100|0.059759|0.069380|0.087484|0.084237|0.073146|0.100318|0.134741|0.131495|0.147351|0.216600|0.299758|0.500000| |3.709900|3.885961|0.112459|3.018544|5.057135|3.548088|2.203612|2.086558|1.996839|2.208101|2.249312|2.578392|8.187723|6.654059|14.280396|6.588218|4.669093|3.927582|4.052882|5.138575|7.319678|12.402405|5.711267|5.054523|10.174425|8.910215|17.689621|20.844905|4.724451|5.091676|3.483245|2.402964|2.526199|0.121401|0.088562|0.094640|0.060284|0.056484|0.062316|0.052536|0.053290|0.050676|0.068548|0.057292|0.062582|0.056073|0.067800|0.081748|0.113132|0.094329|0.129246|0.143313|0.127382|0.110597|0.132435|0.210580|0.217900|0.500000| |2.781129|2.929836|0.084102|2.435917|4.189953|2.926853|1.877925|1.817377|1.752688|1.908445|1.908206|2.118249|6.075343|4.460866|8.584140|5.033442|3.918265|3.665977|4.163244|5.613285|6.727686|12.312108|7.120259|5.904108|12.539577|8.876609|17.446293|19.722016|4.696503|4.653523|3.281152|2.334658|2.298929|0.086689|0.068549|0.073080|0.051570|0.048412|0.054303|0.046425|0.047515|0.044741|0.058769|0.050280|0.053150|0.048161|0.055797|0.065560|0.092887|0.100779|0.160101|0.210503|0.144227|0.132224|0.135294|0.216440|0.174159|0.300395|0.500000| |2.195525|2.461820|0.063347|2.603069|5.393481|3.098067|2.274379|2.364789|2.069840|1.962919|1.830318|1.969471|5.083266|2.706298|4.146599|3.126207|3.751204|4.378464|3.948079|3.241306|2.943547|3.370116|2.367404|2.036113|3.279620|1.888866|2.139572|38.389649|8.945186|7.523325|12.565391|17.603221|7.190054|0.058067|0.055480|0.064020|0.067567|0.056191|0.074592|0.065277|0.058384|0.052433|0.058794|0.050307|0.047164|0.048290|0.051015|0.054771|0.102885|0.112327|0.081620|0.063453|0.072169|0.053826|0.057025|0.048110|0.052614|0.059559|0.057666|0.500000| |2.439109|2.814256|0.073058|2.880032|5.878653|3.350155|2.376010|2.469612|2.188187|2.128740|1.973768|2.140461|6.076709|3.339684|5.007316|4.089651|4.914503|6.017307|5.604606|4.470747|3.928105|4.315879|3.027183|2.505589|3.942481|2.264370|2.619240|43.851961|9.768250|7.875162|12.217651|17.500765|6.802722|0.065223|0.060611|0.069924|0.069216|0.058174|0.079236|0.066211|0.061690|0.054608|0.065233|0.054456|0.051147|0.051170|0.054748|0.060717|0.125154|0.153533|0.109184|0.080113|0.094979|0.065550|0.070006|0.056595|0.062852|0.071960|0.070023|0.300353|0.500000| |2.146226|2.369864|0.061394|2.397529|4.824255|2.837744|2.029260|2.068974|1.848294|1.798093|1.699926|1.841572|4.997296|2.775957|4.259374|3.376026|4.101510|5.384579|5.177563|3.916296|3.309535|3.694507|2.607774|2.180644|3.520370|2.020385|2.339528|49.191030|13.853618|8.383768|12.426759|17.671388|5.639681|0.058060|0.053749|0.062410|0.059589|0.050667|0.064409|0.056241|0.051763|0.047022|0.054082|0.046391|0.044390|0.044622|0.048013|0.052030|0.106180|0.161786|0.099106|0.071608|0.079103|0.057688|0.059727|0.051472|0.055214|0.064571|0.064345|0.301820|0.298690|0.500000| |3.281024|3.585375|0.084917|3.898715|8.905661|4.300893|3.099580|2.944779|2.425625|2.311315|2.255022|2.585282|7.577060|3.613616|5.256397|3.966365|5.362453|5.262216|3.882951|3.245758|3.248368|3.629742|2.353967|2.052066|3.419865|2.072421|2.388408|48.987823|8.394006|13.943139|12.407537|5.640950|17.684862|0.083320|0.080034|0.103207|0.098183|0.074778|0.091910|0.079762|0.064964|0.061440|0.068765|0.057181|0.056975|0.059544|0.067946|0.071006|0.184594|0.098900|0.077173|0.061836|0.068401|0.052483|0.058222|0.053247|0.058794|0.070296|0.062914|0.146757|0.139725|0.127172|0.500000| |3.364622|4.019648|0.097031|4.439028|10.366435|4.779888|3.387884|3.389194|2.783153|2.656964|2.498991|2.833879|8.902339|4.224074|5.981821|4.715866|6.193242|5.843941|4.410862|3.773265|3.833365|4.224456|2.752357|2.368396|3.835661|2.301706|2.649842|43.457457|7.801275|9.825742|12.175551|6.812838|17.530627|0.085310|0.081656|0.100095|0.103564|0.079358|0.112132|0.089627|0.075793|0.068433|0.081444|0.065310|0.062798|0.064634|0.071902|0.078775|0.195813|0.108555|0.088358|0.070595|0.082445|0.060291|0.068171|0.057880|0.065944|0.076547|0.068488|0.172110|0.196013|0.139543|0.299578|0.500000| |2.700675|3.036304|0.074928|3.401707|7.629738|3.936548|2.953135|2.988110|2.466814|2.287957|2.160031|2.385012|6.203066|3.057406|4.580114|3.347740|4.173391|4.326709|3.508811|2.975833|2.907711|3.330050|2.242407|1.967276|3.223227|1.907491|2.154593|38.345199|7.538171|8.972422|12.561473|7.166945|17.602730|0.068961|0.067858|0.081259|0.092082|0.071219|0.095075|0.083137|0.067885|0.062251|0.067974|0.057138|0.054442|0.057311|0.061862|0.064953|0.128061|0.092706|0.072738|0.058917|0.066738|0.051083|0.056068|0.048802|0.054145|0.061797|0.056929|0.221918|0.170524|0.146839|0.301887|0.300268|0.500000| 1859.918182 -11770.591177 4571.225551 -220.965781 -5560.413225 3698.139166 -1862.274059 2.001267 406200000000002D 44A614E1BB880292 44269C8D09C291FE 42265673DE4FFFFB 3C400C756DFFFFFF 43AB0884741CB92D