Version2.2 2021-02-27T08:16:05Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 31-Jan-2021 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1c(c(n[nH]1)C)[C@H](C)NC(=O)[C@@H]2CN(CC23CC[NH2+]CC3)C(=O)c4c(noc4C)C C44714274 RHF 6-31G(d) (6D,7F) Cc1c(c(n[nH]1)C)[C@H](C)NC(=O)[C@@H]2CN(CC23CC[NH2+]CC3)C(=O)c4c(noc4C)C C01[X(C22H33N6O3)] 186 C1 531 Cc1noc(c1C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)N[C@H](c1c(C)[nH]nc1C)C)C Cc1noc(c1C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)N[C@H](c1c(C)[nH]nc1C)C)C C[C@H](NC(=O)[C@@H]1CN(CC12CC[NH2+]CC2)C(=O)c3c(C)onc3C)c4c(C)[nH]nc4C InChIKey=KOLJLLBDESSVDQ-SJCJKPOMSA-O InChI=1S/C22H32N6O3/c1-12(18-13(2)25-26-14(18)3)24-20(29)17-10-28(11-22(17)6-8-23-9-7-22)21(30)19-15(4)27-31-16(19)5/h12,17,23H,6-11H2,1-5H3,(H,24,29)(H,25,26)/p+1/t12-,17-/m0/s1 InChI=1/C22H32N6O3/c1-12(18-13(2)25-26-14(18)3)24-20(29)17-10-28(11-22(17)6-8-23-9-7-22)21(30)19-15(4)27-31-16(19)5/h12,17,23H,6-11H2,1-5H3,(H,24,29)(H,25,26)/p+1/t12-,17-/m0/s1/fC22H33N6O3/h23-25H/q+1 Cc1c(c(n[nH]1)C)[C@H](C)NC(=O)[C@@H]2CN(CC23CC[NH2+]CC3)C(=O)c4c(noc4C)C C01[X(C22H33N6O3)] 186 C01 531 Cc1noc(c1C(=O)N1C[C@H](C2(C1)CC[NH2+]CC2)C(=O)N[C@H](c1c(C)[nH]nc1C)C)C O=[C]([NH][C@H]([C]1[C](C)[NH][N][C]1C)C)[C@@H]1CN(CC21CC[NH2]CC2)C(=O)[C]1[C](C)ON=[C]1C C[C]1[N]N[C](C)[C]1[C@H](C)NC(=O)[C@@H]2CN(CC23CC[NH2]CC3)C(=O)[C]4[C](C)ON=C4C InChIKey=QIQBEWNXWCVLJM-SJCJKPOMSA-N InChI=1S/C22H33N6O3/c1-12(18-13(2)25-26-14(18)3)24-20(29)17-10-28(11-22(17)6-8-23-9-7-22)21(30)19-15(4)27-31-16(19)5/h12,17H,6-11,23H2,1-5H3,(H,24,29)(H,25,26)/t12-,17-/m0/s1 InChI=1/C22H33N6O3/c1-12(18-13(2)25-26-14(18)3)24-20(29)17-10-28(11-22(17)6-8-23-9-7-22)21(30)19-15(4)27-31-16(19)5/h12,17H,6-11,23H2,1-5H3,(H,24,29)(H,25,26)/t12-,17-/m0/s1/f/h24-25H 3246.3658824938 -1403.3687025 1-A 16662.7541 115 416 531 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2.0185 0.3458 0.6759 1.0147 2.2262 5.6523 2.0419 11.4942 8.1397 1.8701 63.6735 11.3693 3.9147 84.3388 6.5255 3.1685 9.5033 5.8558 12.9338 1.1725 9.2439 15.6401 14.2729 4.7855 5.3995 20.9607 7.8562 3.0014 8.1230 4.3516 2.7086 6.6682 39.2887 21.6211 2.0943 5.1876 12.2980 14.2538 16.5440 21.2097 2.9578 8.9616 27.0874 7.8558 21.7901 13.1113 14.8642 15.4054 6.3167 4.0647 1.6563 7.9321 11.1930 4.1798 0.0794 2.3278 2.1501 10.9246 98.0391 72.7012 7.0028 11.2945 17.6779 16.6916 67.2225 54.1354 14.5916 3.8076 2.6434 99.3781 51.9771 12.6658 28.4139 38.0782 15.6997 3.5464 9.3463 34.3448 11.4987 83.9597 14.4388 8.2686 3.6163 15.5192 3.6161 3.6259 27.0336 59.6794 27.1970 32.3527 32.0740 23.4478 8.3006 50.6150 16.5058 308.5589 35.7508 7.9302 5.1330 11.3575 1.5278 23.7755 18.8573 12.8973 12.2164 18.4566 1.3689 9.5769 5.3309 8.7237 4.6815 20.9775 52.4460 334.5406 184.3605 51.0695 42.1862 123.3164 55.5466 399.4813 262.2709 39.9605 21.5858 6.8633 17.1237 40.6556 19.4789 16.6990 3.4065 37.6007 5.5695 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1.00783 1.00783 8688.9642 23067.9969 28195.6493 0.99997 0.00715 -0.00138 -0.00714 0.99997 0.00325 0.00140 -0.00324 0.99999 1 0.00997 0.00375 0.00307 0.20770 0.07824 0.06401 14.12 29.96 37.16 53.40 58.50 71.14 80.56 82.61 97.50 151.47 154.34 190.16 197.32 209.30 223.48 231.07 238.58 262.91 266.18 276.97 299.99 314.38 339.79 359.54 369.22 391.17 405.46 438.52 447.55 487.03 507.25 510.86 525.74 536.24 549.69 566.10 631.63 660.58 679.46 696.47 709.01 721.29 774.72 793.09 819.65 843.18 852.15 893.75 906.73 957.45 988.53 1004.49 1048.26 1071.32 1072.66 1093.80 1157.53 1168.18 1194.74 1195.37 1217.31 1242.26 1251.39 1269.53 1274.67 1343.00 1370.70 1393.17 1417.11 1459.41 1502.23 1508.37 1533.39 1554.40 1560.13 1567.86 1580.92 1604.31 1610.41 1613.00 1627.42 1635.03 1646.62 1664.21 1670.49 1677.24 1684.81 1691.17 1696.07 1701.40 1734.26 1751.50 1767.82 1778.67 1825.17 1856.75 1876.37 1888.76 1893.71 1914.92 1933.10 1940.43 1997.39 2032.75 2043.17 2055.39 2073.86 2083.74 2088.20 2115.76 2124.86 2145.58 2160.45 2167.85 2196.42 2210.67 2222.98 2224.72 2236.08 2241.01 2244.39 2249.50 2256.04 2257.36 2259.95 2278.51 2281.37 2304.35 2326.21 2326.62 2332.88 2334.15 2338.77 2339.29 2342.59 2351.33 2352.72 2354.19 2356.95 2365.22 2378.46 2383.63 2384.49 2404.10 2422.32 2431.76 2444.95 2489.72 2579.19 2628.78 2631.21 2743.44 2771.94 4613.37 4615.61 4626.62 4630.33 4637.56 4640.16 4643.20 4645.20 4687.05 4695.72 4700.18 4703.30 4703.74 4717.13 4720.77 4733.55 4740.64 4741.62 4742.71 4748.24 4754.30 4761.81 4790.07 4799.15 4801.02 4802.61 4804.02 4824.98 4849.29 5275.70 5367.79 5587.92 5627.85 0.594948 0.624210 0.625154 0.531660 -1402.773755 -1402.744493 -1402.743549 -1402.837042 3.135771D-04 MUNgauss RevisionA2.1 retrievium 27-Feb-2021 DUDE Cc1c(c(n[nH]1)C)[C@H](C)NC(=O)[C@@H]2CN(CC23CC[NH2+]CC3)C(=O)c4c(noc4C)C C44714274 RHF 6-31G(d) (6D,10F) C1 429.261414 |X|Y|Z| 62.907415 34.511234 107.304354 61.530894 24 6 7 8 17 6 1 |36.858105| |12.707916|36.858105| |7.250360|13.873915|36.858105| |5.149617|8.615168|13.334318|36.858105| |5.228026|8.540187|8.477868|14.660604|53.358707| |7.688730|14.244528|8.797805|9.090213|19.465468|53.358707| |6.868738|9.083409|6.073827|6.288409|12.887569|26.086414|0.500000| |3.695017|5.163085|7.176797|12.682421|10.712721|7.349277|0.120569|36.858105| |5.815622|7.416222|12.660077|7.181232|6.992430|7.143249|0.115865|5.692057|36.858105| |6.727776|7.149116|9.010703|5.470693|5.973956|6.587674|0.111133|4.357200|17.612964|0.500000| |4.317991|5.179946|7.486115|5.824540|5.855516|5.662334|0.095817|5.452065|12.450105|0.249470|36.858105| |4.532747|5.457384|7.838626|5.910220|5.995757|5.875722|0.099053|5.329511|12.907061|0.256440|7.695718|53.358707| |3.811858|4.150601|5.187139|4.173840|4.593517|4.607826|0.081213|3.933770|7.704061|0.202829|5.972034|19.315808|36.858105| |3.672204|3.782796|4.515013|3.597940|4.068740|4.171646|0.074715|3.367419|6.765976|0.204524|5.885265|11.549398|15.806141|73.516695| |3.104767|3.355033|3.973243|3.496543|4.007021|3.950417|0.071378|3.443953|4.968766|0.130409|4.174737|10.654880|12.478185|14.240722|36.858105| |3.143738|3.494983|4.139246|3.777630|4.343554|4.211062|0.075891|3.747591|4.814284|0.121935|3.932956|10.397623|8.871056|10.469913|17.546530|0.500000| |2.876056|2.942069|3.265829|2.864636|3.432818|3.485810|0.064577|2.750143|3.901846|0.110113|3.317667|7.136936|7.458744|11.554949|12.312101|0.245700|36.858105| |2.358931|2.427439|2.680604|2.443565|2.963780|2.961229|0.055509|2.422430|3.112611|0.086191|2.801336|5.413931|5.169860|8.460388|7.967800|0.182483|12.944899|53.358707| |2.253153|2.388969|2.702924|2.535015|3.035874|2.957235|0.055091|2.605759|3.123305|0.083209|2.887493|5.533916|5.066911|7.897386|8.131075|0.199405|8.025164|17.890927|36.858105| |2.536406|2.747100|3.239794|2.994967|3.461884|3.338174|0.061039|3.119196|3.948672|0.102224|3.703929|7.442811|7.311105|10.711060|12.241314|0.247917|7.770948|10.983815|12.370857|36.858105| |2.420726|2.712959|3.271883|3.191330|3.639027|3.385500|0.061605|3.545144|3.841945|0.094649|3.758407|7.029436|5.738366|8.323730|7.407215|0.201071|4.991102|6.930516|7.426246|12.402233|36.858105| |2.043283|2.253974|2.645677|2.622373|3.071041|2.860789|0.052875|2.938896|3.027618|0.076385|3.096644|5.060455|4.066987|6.471385|4.840120|0.129424|3.841256|5.752995|6.030330|7.480220|12.480950|36.858105| |1.975882|2.143001|2.499595|2.423588|2.845424|2.688706|0.049839|2.664216|2.931409|0.075485|3.116198|4.712523|3.907756|6.665047|4.334015|0.108616|3.603753|5.375144|5.134084|6.473266|7.663410|12.658205|53.358707| |1.790798|1.930811|2.219829|2.173395|2.588782|2.447470|0.045734|2.389902|2.549319|0.066204|2.717452|3.988010|3.239005|5.597781|3.553342|0.091084|3.087205|4.663371|4.313369|4.928223|5.666596|9.179884|25.686714|0.500000| |2.058623|2.250040|2.660062|2.579808|2.992964|2.813018|0.051851|2.868870|3.160694|0.080461|3.499977|4.973476|4.032042|6.964109|4.178453|0.104655|3.394684|4.810409|4.359547|5.771702|6.996778|9.207146|25.674711|0.328388|0.500000| |2.027016|2.148891|2.472320|2.323784|2.746785|2.652861|0.049328|2.459571|2.960671|0.078690|3.072867|4.793732|4.267260|7.647635|4.836259|0.113269|4.274927|6.648940|6.085307|7.474225|6.475469|7.560708|17.154079|0.254028|0.255576|36.858105| |2.395499|2.538870|2.966510|2.699487|3.137268|3.059675|0.056257|2.792917|3.717644|0.099294|3.730830|6.379385|6.351522|11.422838|7.374051|0.152470|6.031421|8.608781|7.471423|12.333990|7.624147|6.504274|10.489827|0.157876|0.196151|12.526602|36.858105| |2.116636|2.137464|2.323149|2.118784|2.600778|2.617123|0.049547|2.097205|2.685569|0.075766|2.486710|4.416793|4.108258|7.302110|5.336800|0.125005|7.642309|18.783644|7.867988|5.727615|4.012692|3.642498|4.957095|0.090762|0.090364|4.735453|5.588368|36.858105| |1.916398|1.948472|2.127173|1.966477|2.414290|2.407716|0.045669|1.977858|2.450209|0.068431|2.337983|3.953985|3.583327|6.447517|4.459814|0.106550|5.448036|11.493743|7.075772|5.304682|3.924377|3.826588|5.421425|0.101591|0.096095|5.420189|5.647527|15.805206|73.516695| |2.111322|2.076912|2.202521|1.987288|2.475584|2.534784|0.048439|1.927375|2.515884|0.072838|2.304158|3.998664|3.633424|6.670992|4.332157|0.104619|6.360350|10.633566|5.061939|4.190489|3.156351|2.865720|3.931363|0.073341|0.074085|3.589560|4.183419|12.947018|14.502986|36.858105| |1.958880|1.902032|1.998819|1.801950|2.258554|2.324061|0.044674|1.744671|2.279254|0.066748|2.131655|3.492612|3.107221|5.935504|3.449809|0.083950|4.543644|6.913084|3.824365|3.399566|2.678922|2.502698|3.546034|0.067331|0.067758|3.234951|3.619680|7.345309|11.301446|13.207489|36.858105| |1.921742|1.838270|1.898114|1.710293|2.169660|2.253759|0.043682|1.638911|2.128603|0.062890|1.973861|3.203316|2.775884|5.267080|3.009879|0.075217|3.897215|5.581005|3.181147|2.872789|2.336070|2.173640|3.039435|0.058087|0.058778|2.673692|2.978093|5.227572|8.078071|8.510632|14.899701|53.358707| |2.027481|1.936392|1.984293|1.788762|2.281412|2.379143|0.046214|1.701971|2.197665|0.064809|1.993564|3.346197|2.877314|5.299416|3.188380|0.081317|4.289774|6.009140|3.323262|2.938060|2.389063|2.181697|2.969948|0.056418|0.057370|2.560837|2.900588|5.268161|7.620778|8.760075|8.964716|18.879710|73.516695| |2.149273|2.087147|2.169228|1.957428|2.473026|2.558599|0.049296|1.872515|2.420770|0.070565|2.172253|3.806405|3.344549|6.004795|3.917838|0.099245|5.729726|8.405345|4.237910|3.571168|2.807606|2.518979|3.372219|0.063297|0.064388|2.934467|3.401203|7.409574|9.510746|14.042748|8.682257|11.759780|25.853825|36.858105| |2.216556|2.164041|2.226991|2.028538|2.588955|2.680833|0.051883|1.930147|2.422284|0.069872|2.129639|3.842447|3.266160|5.600317|3.904806|0.104869|5.572471|7.756699|4.117086|3.429322|2.778817|2.452823|3.175194|0.059586|0.060782|2.659908|3.076576|5.652408|7.619481|7.240697|5.175590|7.230387|14.261340|12.771407|36.858105| |1.824392|1.781356|1.886024|1.708797|2.133848|2.182006|0.041900|1.671715|2.165374|0.063125|2.085222|3.264893|2.884425|5.635644|3.109357|0.075257|3.781156|5.755891|3.477014|3.213182|2.585528|2.491545|3.669079|0.070617|0.070275|3.421452|3.652323|5.874239|10.807264|7.186196|12.732282|10.748887|9.508696|5.200242|3.710710|36.858105| |17.556757|8.891863|6.042598|4.536273|6.269582|8.650983|0.165287|3.392868|5.168569|0.167680|4.216941|5.351574|3.397862|6.027566|2.769675|0.076632|2.578970|2.934911|2.067373|2.328773|2.233449|1.918387|2.560903|0.047649|0.054803|1.928781|2.251749|1.966988|3.200853|1.967473|1.854380|2.479861|3.372754|1.987622|2.020204|1.749702|0.500000| |17.572331|8.905781|5.559815|4.448323|6.577769|9.780966|0.204693|3.299169|4.501780|0.138253|3.498444|5.198599|3.304408|5.614292|2.822059|0.080569|2.676939|3.025659|2.113701|2.324439|2.221668|1.892924|2.475032|0.046099|0.052162|1.864172|2.176519|2.002339|3.219180|2.015817|1.870391|2.525015|3.514121|2.083735|2.181704|1.729558|0.301655|0.500000| |17.606418|8.890993|6.647113|4.595302|5.965236|7.804756|0.141724|3.464831|6.276293|0.226399|4.457758|6.879867|4.414220|7.704895|3.501528|0.096445|3.303033|3.584414|2.463368|2.779938|2.576567|2.153205|2.849618|0.052380|0.060320|2.186060|2.634117|2.357673|3.746589|2.373317|2.194168|2.930162|4.050755|2.421114|2.481236|2.025006|0.301847|0.302351|0.500000| |3.450749|4.606888|6.469584|8.825673|8.052768|6.181469|0.103769|17.539114|5.876468|0.122848|5.544431|8.548332|4.557267|6.646247|4.074680|0.125908|3.108686|3.729625|3.020986|3.715755|4.411879|3.505341|4.194999|0.075522|0.092086|2.801983|3.217574|2.328008|3.899749|2.100716|1.878125|2.377517|3.228710|2.023326|2.085846|1.795711|0.087008|0.085818|0.093392|0.500000| |3.291432|4.440900|5.471894|8.982580|10.323277|6.818710|0.117392|17.611314|4.370182|0.098825|4.168351|5.760812|3.305658|5.091838|3.025643|0.092655|2.482806|3.029838|2.398530|2.783140|3.176472|2.705238|3.304107|0.061385|0.071665|2.230402|2.480888|1.938072|3.261989|1.787944|1.620646|2.083385|2.835891|1.749822|1.819468|1.550501|0.084258|0.084515|0.084900|0.300799|0.500000| |3.420408|4.572940|6.174435|8.865022|8.488738|6.339532|0.107044|17.558852|5.349576|0.115726|5.883315|6.457538|3.655141|5.776514|3.153448|0.092094|2.546423|3.090997|2.444474|2.944340|3.352237|2.866736|3.632848|0.066909|0.081428|2.442274|2.732471|1.998122|3.387442|1.837630|1.683153|2.147839|2.882443|1.770559|1.800692|1.632687|0.090542|0.084033|0.089252|0.302105|0.301715|0.500000| |3.760960|4.194001|5.490615|4.437702|4.740654|4.666818|0.081539|4.300908|8.827314|0.218210|17.588444|9.507459|6.424324|12.612324|4.390645|0.109176|3.515375|4.064546|3.063432|4.014193|3.933494|3.280605|4.683114|0.082471|0.108963|3.481755|4.313500|2.686992|4.522189|2.474839|2.308182|2.874010|3.737450|2.289320|2.198031|2.289911|0.102898|0.086537|0.111896|0.126221|0.096066|0.127269|0.500000| |3.720519|4.615867|6.702141|6.177566|6.003378|5.424290|0.092039|6.708686|8.763851|0.174289|17.579777|9.424669|5.315020|8.764759|4.022892|0.108428|3.127952|3.695268|2.890027|3.731390|4.046096|3.348675|4.504303|0.080119|0.105060|3.120650|3.679204|2.394908|4.051217|2.184865|2.010145|2.524466|3.335571|2.054956|2.029506|1.972731|0.099965|0.086826|0.103906|0.194179|0.136070|0.218029|0.300274|0.500000| |4.470733|5.230296|6.867923|5.460627|5.814673|5.768855|0.098790|4.910628|8.843551|0.214426|17.576379|7.604800|4.590323|8.345646|3.413473|0.090390|2.852505|3.326881|2.488074|3.067719|3.100768|2.649934|3.659480|0.066568|0.083244|2.658561|3.124759|2.212307|3.716094|2.086816|1.960456|2.500587|3.288610|1.985989|1.947497|1.926801|0.128595|0.099506|0.123476|0.129239|0.108072|0.152833|0.301213|0.301375|0.500000| |4.370473|5.489638|7.701348|6.508228|6.596251|6.240863|0.104714|5.926914|9.008845|0.189169|5.964569|26.073582|9.451414|10.902786|7.479659|0.244238|5.047996|5.323805|4.083926|5.246291|5.233321|3.711357|4.493478|0.078384|0.095012|3.279400|4.202304|3.128593|4.969415|2.822635|2.435374|3.062403|4.241596|2.733998|2.842975|2.252692|0.102949|0.106049|0.130726|0.203910|0.132802|0.136057|0.146529|0.163269|0.129660|0.500000| |2.954671|2.933452|3.215322|2.752765|3.309986|3.417567|0.063503|2.602911|3.939669|0.116384|3.384845|6.799840|7.332496|13.469037|8.746516|0.176521|17.660950|12.276196|6.024468|6.283035|4.257350|3.427442|4.612591|0.081357|0.090379|4.133711|5.868819|7.320393|9.426334|6.940981|5.206141|6.016580|8.379184|6.041349|5.301034|4.297339|0.074488|0.075690|0.096233|0.080142|0.064905|0.067997|0.102115|0.086204|0.081684|0.126356|0.500000| |2.989030|3.027228|3.266213|2.875632|3.515058|3.612275|0.067451|2.707130|3.726605|0.105824|3.076550|6.646828|6.174468|9.399446|8.766842|0.228693|17.618397|12.213874|6.240110|5.755333|4.236154|3.326485|4.165539|0.074434|0.080740|3.472712|4.529520|6.072238|7.966093|5.704831|4.140310|5.122964|7.815714|5.911678|6.626488|3.360270|0.073198|0.078833|0.095576|0.083996|0.068746|0.068610|0.087867|0.080660|0.074732|0.137541|0.301801|0.500000| |2.010794|2.119590|2.376885|2.253708|2.724988|2.649385|0.049730|2.338667|2.718602|0.072773|2.587976|4.607066|4.084545|6.698339|5.698631|0.142923|5.790759|12.480343|17.711651|8.540659|6.308723|6.184286|7.496233|0.133607|0.123326|6.756331|6.866543|7.678032|15.004363|4.838506|3.800083|4.240473|5.631824|3.939423|3.713648|3.586273|0.051875|0.052607|0.060554|0.074396|0.060356|0.061819|0.076772|0.072404|0.062845|0.093598|0.134695|0.132146|0.500000| |2.234701|2.396190|2.697960|2.583577|3.119509|3.012448|0.056264|2.673219|3.016993|0.079340|2.746501|5.351845|4.584757|6.901292|7.184309|0.211571|6.798303|12.464676|17.523957|8.826278|7.066067|5.649304|6.045728|0.106733|0.107050|4.748216|5.481168|5.943769|9.490851|4.310868|3.313221|3.900423|5.463600|3.885603|4.049918|2.977309|0.056506|0.058831|0.067150|0.086643|0.069340|0.068554|0.078818|0.077336|0.066120|0.115130|0.139926|0.168262|0.302432|0.500000| |2.408431|2.728278|3.258280|3.270231|3.772892|3.469842|0.063322|3.666538|3.644387|0.089313|3.438887|6.662053|5.090637|7.219830|6.753928|0.216269|4.737300|6.550299|6.906142|8.762395|17.561817|8.996486|7.616015|0.127080|0.143142|4.863608|5.511330|3.720113|6.343272|2.987785|2.512422|3.031821|4.125794|2.737531|2.801980|2.379962|0.061090|0.062168|0.070545|0.128628|0.093495|0.093345|0.096255|0.103338|0.080129|0.148714|0.108966|0.118354|0.159902|0.216760|0.500000| |2.617697|3.000818|3.757732|3.681710|4.057735|3.718064|0.066683|4.220864|4.530027|0.107087|4.610503|8.304131|6.293779|9.009970|6.797297|0.183387|4.480601|5.786113|5.454500|8.798013|17.524374|8.873846|9.332867|0.143443|0.203370|5.658031|6.833853|3.471488|5.992686|2.852538|2.479960|2.981345|3.963186|2.570558|2.539528|2.414373|0.067334|0.065717|0.076814|0.151162|0.101416|0.112430|0.133124|0.144017|0.102019|0.166708|0.110982|0.107562|0.131742|0.144397|0.303912|0.500000| |1.902133|2.072164|2.381776|2.358413|2.815596|2.645837|0.049374|2.595813|2.679153|0.068809|2.682474|4.439608|3.601819|5.791537|4.448589|0.120626|3.776113|6.024090|6.592818|6.697175|8.745212|17.629091|12.443552|0.225286|0.181272|6.903079|5.706630|3.865588|7.416538|2.981004|2.578271|3.034897|3.990571|2.610926|2.549612|2.554458|0.049541|0.049470|0.055772|0.084441|0.067494|0.069723|0.078480|0.079097|0.064870|0.091586|0.092468|0.091828|0.208671|0.175950|0.214227|0.172958|0.500000| |1.962246|2.187923|2.570839|2.616910|3.073295|2.819768|0.052195|3.021426|2.872002|0.071648|2.990182|4.655950|3.557215|5.676481|4.018693|0.111443|3.231631|4.692995|4.586660|5.454129|8.753707|17.624600|12.364983|0.222740|0.224791|5.562565|4.898350|3.023921|5.602622|2.469078|2.191837|2.635234|3.461578|2.215445|2.181795|2.187078|0.051409|0.050617|0.056672|0.100114|0.078283|0.082731|0.086278|0.092175|0.071873|0.096176|0.081181|0.080172|0.129266|0.125874|0.212253|0.215364|0.301398|0.500000| |1.889343|1.988498|2.250890|2.130267|2.555051|2.476050|0.046402|2.241683|2.632114|0.070542|2.667045|4.253434|3.742952|6.612777|4.446171|0.106996|4.197697|7.107539|6.659865|6.686883|5.683172|6.864375|12.346301|0.223377|0.180724|17.655283|8.733297|5.309430|11.853522|3.852908|3.432475|3.808796|4.760042|3.097369|2.791571|3.629714|0.049794|0.048806|0.056547|0.070507|0.057282|0.061246|0.082058|0.075013|0.065049|0.082716|0.110673|0.095943|0.239404|0.141981|0.127505|0.131233|0.205352|0.141784|0.500000| |1.939542|2.035547|2.322167|2.173145|2.584410|2.510642|0.046874|2.285397|2.781547|0.074947|2.959253|4.325532|3.787990|7.120085|4.016409|0.095012|3.673364|5.517745|4.623277|5.452652|4.883993|5.571626|12.364570|0.222232|0.225743|17.628882|8.790655|4.138550|8.480561|3.317420|3.133025|3.540444|4.333205|2.720878|2.432560|3.459729|0.051873|0.049469|0.058007|0.070995|0.057610|0.063946|0.094710|0.082669|0.072344|0.081171|0.102875|0.084630|0.140233|0.104678|0.107499|0.127749|0.142475|0.126481|0.301539|0.500000| |2.578217|2.753517|3.287972|2.946389|3.362841|3.274750|0.059655|3.050367|4.307478|0.113964|4.548284|7.217309|7.144196|13.777127|6.745383|0.142556|5.216775|6.707231|5.474385|8.778619|6.862704|5.724632|9.456457|0.144727|0.207491|8.909813|17.585656|4.409712|7.748264|3.588728|3.218369|3.709278|4.711091|3.026215|2.769104|3.276188|0.067873|0.063995|0.078694|0.097329|0.073750|0.084353|0.154741|0.123297|0.103018|0.125246|0.147568|0.113695|0.138508|0.123052|0.139785|0.201533|0.132399|0.128981|0.173125|0.216308|0.500000| |2.374880|2.451853|2.795245|2.501918|2.954183|2.934776|0.054388|2.521293|3.486131|0.096916|3.423508|5.806448|5.924113|11.676456|6.734215|0.137691|6.634213|9.614179|6.915279|8.710835|5.511439|4.865451|7.641064|0.127177|0.144533|9.023512|17.651310|6.939961|12.222738|5.143042|4.468802|4.803383|5.965036|3.950204|3.397912|4.555871|0.062171|0.060195|0.073548|0.078920|0.062646|0.068384|0.110192|0.090928|0.081505|0.105737|0.197538|0.133916|0.179627|0.139463|0.122687|0.139842|0.127270|0.107588|0.212777|0.213882|0.307052|0.500000| |2.007378|1.956019|1.995035|1.839047|2.372851|2.454415|0.047926|1.756420|2.137423|0.061442|1.901524|3.324937|2.757237|4.751961|3.217238|0.087790|4.249886|6.076386|3.474817|2.916471|2.444058|2.205861|2.860738|0.054399|0.054799|2.365027|2.654830|4.585700|6.632838|5.727029|4.565558|6.716712|13.142090|9.028629|17.591203|3.380646|0.051190|0.055410|0.061628|0.052342|0.046406|0.045667|0.054279|0.050619|0.048777|0.068660|0.113457|0.135187|0.090025|0.096525|0.068878|0.062319|0.064121|0.055159|0.069390|0.060687|0.066916|0.080469|0.500000| |2.456161|2.360572|2.393054|2.152487|2.762842|2.902056|0.056286|2.011149|2.584130|0.075528|2.225913|4.066593|3.415766|5.843735|3.942481|0.106971|5.544147|6.820634|3.744882|3.295755|2.699556|2.343483|3.032704|0.056648|0.058875|2.511014|2.952714|4.721957|6.521613|5.826054|4.510915|6.482334|12.326712|8.964863|17.563436|3.356320|0.061564|0.067660|0.077285|0.059946|0.052542|0.051845|0.063294|0.058355|0.056744|0.083684|0.150591|0.197049|0.092034|0.103089|0.075824|0.069854|0.066497|0.058407|0.071633|0.064172|0.075605|0.089862|0.302307|0.500000| |2.224472|2.218208|2.315169|2.131746|2.703190|2.763642|0.053175|2.051369|2.514885|0.071211|2.206616|4.092188|3.478583|5.770440|4.405702|0.121487|6.320182|9.423059|4.952213|3.891200|3.133276|2.734671|3.454180|0.064468|0.065412|2.870694|3.326706|6.180710|8.218408|6.701170|4.602502|5.988856|10.336732|8.928706|17.644943|3.476791|0.055996|0.060585|0.068637|0.062324|0.053807|0.052806|0.063007|0.059056|0.055499|0.085553|0.151094|0.214736|0.120931|0.140603|0.089310|0.077867|0.079913|0.067043|0.084478|0.071403|0.081726|0.099883|0.300172|0.299370|0.500000| |1.936479|1.895459|2.026584|1.821549|2.253703|2.302154|0.043941|1.783713|2.370616|0.069357|2.307672|3.571008|3.214138|6.482080|3.387939|0.080064|4.027774|5.952338|3.653839|3.532519|2.801868|2.686499|4.055235|0.077137|0.078376|3.898306|4.245636|5.838533|10.778495|6.416421|8.923265|8.283444|8.129455|4.646132|3.452812|17.564040|0.051756|0.050451|0.059960|0.053344|0.045581|0.048639|0.071612|0.060248|0.058923|0.067327|0.131142|0.096288|0.103606|0.085155|0.070245|0.073372|0.075192|0.065071|0.111464|0.112030|0.106697|0.154034|0.085657|0.089039|0.091637|0.500000| |1.734363|1.678120|1.758746|1.594940|2.006673|2.061731|0.039811|1.553539|2.000258|0.058662|1.934028|2.957400|2.559623|5.014649|2.691842|0.066203|3.199619|4.693437|2.909714|2.738234|2.266927|2.192519|3.221941|0.062610|0.062502|2.913366|3.077623|4.451035|8.062875|5.450794|8.994251|10.336899|8.802664|4.453972|3.303376|17.622561|0.046543|0.045866|0.053296|0.045948|0.040160|0.042289|0.058732|0.050698|0.050245|0.056752|0.100627|0.081158|0.082785|0.070968|0.058439|0.059580|0.062109|0.054293|0.084605|0.082964|0.078918|0.103005|0.085847|0.084712|0.084611|0.300324|0.500000| |1.700452|1.679056|1.786130|1.638619|2.046946|2.075306|0.039874|1.621250|2.035652|0.058501|1.976264|3.085621|2.696493|5.154797|2.965920|0.072630|3.520854|5.636511|3.537199|3.181531|2.595902|2.567473|3.797950|0.074217|0.071559|3.555312|3.607148|5.859648|12.184086|6.378937|8.949040|8.327423|8.165998|4.653116|3.471643|17.608639|0.045284|0.044884|0.051920|0.048550|0.041968|0.044028|0.060038|0.052593|0.050646|0.059694|0.106226|0.086976|0.105562|0.084094|0.066438|0.066489|0.074412|0.062463|0.108804|0.099850|0.088154|0.121870|0.089440|0.085606|0.092976|0.302144|0.299331|0.500000| 1401.731912 -9748.236406 3887.351879 -190.582271 -4649.734886 3246.366116 -1403.368770 2.001168 40C5E3FFFFFFFFF4 445B5C5592681BDD 43DE52610CA42350 4223766B811FFFFE C0B5000000000002 43DAD8EE957E6ECD