Version2.2 2021-02-09T09:23:49Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 04-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc2c(c1)OC[C@@H](O2)CC[NH2+]Cc3c(nc4n3ccs4)C(=O)N5CCCC5 C11819892 RHF 6-31G(d) (6D,7F) c1ccc2c(c1)OC[C@@H](O2)CC[NH2+]Cc3c(nc4n3ccs4)C(=O)N5CCCC5 C01[X(C21H25N4O3S1)] 156 C1 489 O=C(c1nc2n(c1C[NH2+]CC[C@H]1COc3c(O1)cccc3)ccs2)N1CCCC1 O=C(c1nc2n(c1C[NH2+]CC[C@H]1COc3c(O1)cccc3)ccs2)N1CCCC1 O=C(N1CCCC1)c2nc3sccn3c2C[NH2+]CC[C@H]4COc5ccccc5O4 InChIKey=BBDNZSBVLNVRAD-HNNXBMFYSA-O InChI=1S/C21H24N4O3S/c26-20(24-9-3-4-10-24)19-16(25-11-12-29-21(25)23-19)13-22-8-7-15-14-27-17-5-1-2-6-18(17)28-15/h1-2,5-6,11-12,15,22H,3-4,7-10,13-14H2/p+1/t15-/m0/s1 InChI=1/C21H24N4O3S/c26-20(24-9-3-4-10-24)19-16(25-11-12-29-21(25)23-19)13-22-8-7-15-14-27-17-5-1-2-6-18(17)28-15/h1-2,5-6,11-12,15,22H,3-4,7-10,13-14H2/p+1/t15-/m0/s1/fC21H25N4O3S/h22H/q+1 c1ccc2c(c1)OC[C@@H](O2)CC[NH2+]Cc3c(nc4n3ccs4)C(=O)N5CCCC5 C01[X(C21H25N4O3S1)] 156 C01 489 O=C(c1nc2n(c1C[NH2+]CC[C@H]1COc3c(O1)cccc3)ccs2)N1CCCC1 [O][C]([N]1CCCC1)[C]1[N][C]2[N]([C]1C[NH2]CC[C@H]1CO[C]3[C]([CH][CH][CH][CH]3)O1)C=CS2 [O][C]([C]1[N][C]2SC=CN2[C]1C[NH2]CC[C@H]3CO[C]4[CH][CH][CH][CH][C]4O3)N5CCCC5 InChIKey=WJNZKQITTMDBPS-HNNXBMFYSA-N InChI=1S/C21H25N4O3S/c26-20(24-9-3-4-10-24)19-16(25-11-12-29-21(25)23-19)13-22-8-7-15-14-27-17-5-1-2-6-18(17)28-15/h1-2,5-6,11-12,15H,3-4,7-10,13-14,22H2/t15-/m0/s1 InChI=1/C21H25N4O3S/c26-20(24-9-3-4-10-24)19-16(25-11-12-29-21(25)23-19)13-22-8-7-15-14-27-17-5-1-2-6-18(17)28-15/h1-2,5-6,11-12,15H,3-4,7-10,13-14,22H2/t15-/m0/s1 2805.4493373625 -1649.4871412 1-A 20272.4383 109 380 489 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.09832 -20.68545 -20.67155 -20.64611 -15.82114 -15.77897 -15.69964 -15.67795 -11.47309 -11.45294 -11.45102 -11.42572 -11.41697 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0.8482 0.8567 0.8466 0.8277 0.8235 0.8524 0.6897 0.6128 0.7957 0.4437 0.7482 0.8555 0.4477 0.7891 0.8442 0.8456 0.2433 0.1967 0.4744 0.8565 0.2732 0.4026 0.8405 0.8566 0.6925 0.7021 0.7677 0.7430 0.3795 0.8555 0.6088 0.8567 0.8002 0.6476 0.4377 0.7269 0.6900 0.7368 0.8522 0.2401 0.4487 0.1875 0.8535 0.8338 0.7740 0.1691 0.8224 0.6528 0.7338 0.1428 0.7335 0.7899 0.4952 0.8462 0.1896 0.3026 0.7914 0.8568 0.6419 0.8448 0.8491 0.8516 0.2971 0.3604 0.8525 0.1569 0.8252 0.2076 0.3372 0.8324 0.3830 0.8103 0.7991 0.1974 0.4733 0.7145 0.6421 0.4961 0.8287 0.6025 0.7102 0.8571 0.4304 0.7774 0.8517 0.8553 0.8431 0.8457 0.3220 0.6310 0.8275 0.4847 0.5475 0.7811 0.8562 0.6092 0.4311 0.7455 0.3826 0.7949 0.8036 0.7900 0.8051 0.8166 0.8569 0.8525 0.8457 0.6355 0.8288 0.7388 0.7135 0.8399 0.7437 0.8527 0.7973 0.8429 0.5984 0.6214 0.7871 0.1697 0.2556 0.2701 0.8489 0.4842 0.8477 0.8202 0.4815 0.1531 0.1664 0.2670 0.6446 0.3152 0.6154 0.6153 0.2994 0.1043 0.2217 0.8516 0.6420 0.5830 0.7425 0.7589 0.8114 0.7161 0.8482 0.8498 0.6401 0.2105 0.8559 0.3021 0.5169 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 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 6 6 6 6 6 6 8 6 6 1 8 6 6 7 1 1 6 6 6 7 6 7 6 6 16 6 8 7 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 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 1.00783 15.99491 12.00000 12.00000 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 14.00307 12.00000 14.00307 12.00000 12.00000 31.97207 12.00000 15.99491 14.00307 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 7586.4604 30955.4200 36228.1314 0.99993 0.01212 -0.00009 -0.01212 0.99993 0.00025 0.00009 -0.00025 1.00000 1 0.01142 0.00280 0.00239 0.23789 0.05830 0.04982 15.07 25.52 43.19 62.87 79.99 89.55 101.44 133.14 156.99 168.16 183.60 211.25 233.35 267.60 292.09 298.60 352.99 377.20 383.64 404.38 413.58 430.72 468.58 482.81 489.90 555.22 595.73 632.18 677.57 741.63 745.62 773.88 783.37 790.13 825.25 875.52 886.29 895.37 915.39 962.73 1004.83 1041.76 1066.80 1103.53 1129.69 1145.39 1173.45 1185.28 1190.17 1214.47 1228.90 1233.06 1271.05 1309.84 1338.43 1350.33 1357.53 1375.61 1398.36 1412.78 1429.70 1449.69 1460.08 1476.34 1498.48 1536.74 1539.80 1553.23 1569.68 1595.20 1597.04 1621.57 1626.16 1638.09 1696.35 1730.26 1733.39 1746.34 1784.40 1792.89 1796.72 1807.98 1825.25 1862.13 1871.57 1893.64 1903.70 1912.23 1917.45 1922.25 1980.62 2008.72 2016.30 2028.82 2047.32 2055.12 2063.02 2080.65 2099.15 2109.48 2129.74 2142.14 2155.79 2171.29 2182.27 2190.36 2197.08 2208.12 2219.23 2247.98 2264.19 2289.96 2331.32 2345.21 2349.38 2350.52 2356.43 2359.46 2366.99 2377.29 2379.68 2386.47 2407.04 2415.70 2427.45 2488.14 2575.46 2591.71 2599.45 2611.71 2651.51 4604.74 4618.08 4633.40 4645.56 4652.08 4670.82 4686.59 4706.97 4708.07 4718.77 4735.47 4742.10 4754.06 4758.85 4768.08 4803.67 4806.40 4828.34 4855.33 4871.05 4885.75 4897.95 4964.02 4993.10 5346.69 0.484611 0.508254 0.509198 0.427282 -1649.002531 -1648.978888 -1648.977943 -1649.059859 2.747476D-04 MUNgauss RevisionA2.1 retrievium 09-Feb-2021 DUDE c1ccc2c(c1)OC[C@@H](O2)CC[NH2+]Cc3c(nc4n3ccs4)C(=O)N5CCCC5 C11819892 RHF 6-31G(d) (6D,10F) C1 413.164738 |X|Y|Z| 125.728786 60.552209 28.250616 59.914354 28 6 7 8 16 21 4 2 1 |36.858105| |13.719813|36.858105| |7.941200|13.785979|36.858105| |6.895078|7.962953|13.768448|36.858105| |7.955367|6.878731|7.932350|13.756008|36.858105| |13.787781|7.934742|6.870151|7.948427|13.757154|36.858105| |5.249268|4.612502|5.216469|7.964190|13.998957|8.054544|73.516695| |4.051858|3.890884|4.681533|7.065281|8.199111|5.315131|24.237172|36.858105| |3.875905|4.030635|5.281012|8.121830|7.037254|4.664502|14.220190|12.529900|36.858105| |3.772699|3.868852|4.887248|7.002823|6.461260|4.521140|13.041362|8.944606|17.509668|0.500000| |4.609031|5.241548|8.040624|13.899986|7.944584|5.209721|12.116922|7.983286|13.562150|0.259530|73.516695| |3.016314|3.189139|4.034608|5.262036|4.580491|3.436818|9.035286|7.506427|12.505545|0.245519|14.387472|36.858105| |2.772272|3.042077|3.877887|4.613392|3.806199|3.005917|6.925213|4.912599|7.588400|0.189970|12.170461|12.497530|36.858105| |2.296947|2.491395|3.034987|3.441347|2.977538|2.458397|5.478850|3.797602|4.971777|0.127391|8.124751|7.680422|12.753509|53.358707| |2.257795|2.449225|2.970355|3.344455|2.902460|2.409571|5.325953|3.717180|4.629640|0.113490|7.795834|7.052368|9.106345|25.164545|0.500000| |2.158927|2.296404|2.739910|3.135581|2.810776|2.336856|5.316482|3.699670|4.650876|0.122838|7.173044|7.100240|9.190476|25.719382|0.322279|0.500000| |2.086990|2.291330|2.744705|2.960064|2.554946|2.176857|4.571493|3.001686|3.787349|0.101261|6.613562|4.949535|7.555467|17.343162|0.264410|0.256071|36.858105| |1.813608|1.964849|2.290855|2.446624|2.172229|1.887949|3.923387|2.551762|3.036569|0.080970|5.253590|3.861514|4.982056|10.539955|0.207359|0.199409|12.744987|36.858105| |1.718572|1.854425|2.140438|2.273368|2.036860|1.785245|3.681065|2.392218|2.752230|0.071944|4.804772|3.457603|4.119097|8.065440|0.186031|0.154843|7.277082|13.896711|36.858105| |1.532776|1.638722|1.858544|1.961765|1.787929|1.589240|3.243800|2.076530|2.333762|0.061922|4.046944|2.836850|3.252096|5.894177|0.128800|0.120274|5.112782|8.437561|13.995705|53.358707| |1.502787|1.603463|1.814193|1.915387|1.750731|1.558795|3.181561|2.022592|2.291806|0.062002|3.940649|2.759562|3.218602|5.773930|0.117720|0.121269|5.252083|8.716991|9.085209|20.087304|36.858105| |1.637166|1.756748|2.011295|2.134687|1.930134|1.701558|3.501921|2.237444|2.606589|0.071222|4.463553|3.184040|3.915289|7.317351|0.139065|0.153196|7.523442|13.848690|8.785458|11.736371|14.080325|53.358707| |1.571373|1.677885|1.903006|2.012514|1.835844|1.631127|3.332784|2.096696|2.435537|0.068267|4.145731|2.880595|3.502901|6.007686|0.109657|0.128966|5.802408|7.323675|5.342214|7.483913|8.241475|18.535716|36.858105| |1.417077|1.502486|1.680850|1.767786|1.632966|1.467842|2.969891|1.850211|2.098346|0.058753|3.576324|2.433304|2.835196|4.688617|0.088923|0.101112|4.193746|5.254617|4.457850|6.936132|7.783074|11.486123|14.356225|36.858105| |1.342788|1.421106|1.583433|1.662073|1.540636|1.389697|2.804248|1.753197|1.953900|0.053696|3.348717|2.277175|2.584379|4.327329|0.086397|0.092468|3.741664|5.040340|4.973727|9.242446|10.958638|10.111820|7.362502|10.856799|388.023441| |1.819811|1.971645|2.288190|2.429850|2.162932|1.888972|3.888553|2.549833|2.896083|0.073414|5.153841|3.652447|4.168986|7.718026|0.204732|0.140501|5.959067|7.553701|12.774809|10.247402|5.377399|7.176626|3.813748|3.305839|25.810775|36.858105| |2.055186|2.240395|2.655635|2.865290|2.507591|2.148215|4.504549|3.022955|3.502622|0.086182|6.276662|4.606045|5.262076|9.782560|0.309316|0.164349|6.550016|6.729142|8.179157|7.252971|4.334071|6.273199|3.515046|2.988124|22.104787|15.440432|73.516695| |1.685398|1.818108|2.073690|2.172017|1.957236|1.737302|3.503893|2.259285|2.489480|0.063277|4.475167|3.009277|3.286969|5.574717|0.138900|0.104994|4.256294|5.162025|7.781169|8.698475|4.531183|5.638168|3.178277|2.892227|23.460260|14.470214|15.209922|53.358707| |1.738188|1.873087|2.125156|2.216110|2.003807|1.787445|3.569116|2.293710|2.469378|0.061810|4.504357|2.918620|3.054570|4.858819|0.121152|0.091171|3.511208|3.871219|5.012609|5.841884|3.367072|4.346359|2.588528|2.374706|18.717796|7.913521|12.577900|17.604349|36.858105| |1.539841|1.645294|1.830350|1.890788|1.737092|1.575790|3.096427|1.954052|2.066554|0.052531|3.751722|2.375859|2.461491|3.832031|0.090984|0.073873|2.820303|3.151068|3.984538|5.130069|3.006287|3.754968|2.296965|2.171858|17.523916|5.281045|8.159391|11.009467|12.477930|36.858105| |1.448505|1.553643|1.725261|1.768342|1.619023|1.474099|2.874761|1.799707|1.929843|0.049787|3.505763|2.212232|2.357362|3.717044|0.086122|0.071770|2.868068|3.323933|4.294197|5.856765|3.366589|4.063503|2.470999|2.368927|19.661244|5.250234|7.517286|11.039184|7.953823|12.459919|36.858105| |1.496571|1.606003|1.802447|1.868116|1.702961|1.533833|3.045735|1.928912|2.102295|0.054427|3.769358|2.471341|2.691428|4.445062|0.103815|0.086215|3.516328|4.380385|6.311577|8.935084|4.594388|5.288802|3.057333|2.906971|24.940204|7.563098|9.331855|17.558021|7.789522|7.939941|12.469117|36.858105| |17.733864|8.899603|5.647731|4.964750|5.659017|8.948608|7.540344|3.368616|3.196236|0.087420|6.503565|2.582464|2.398756|2.768208|0.055661|0.053482|1.870342|1.646961|1.568652|1.922015|1.386264|2.042223|1.446678|1.314719|8.882850|1.655390|3.285140|2.105420|1.597298|1.430868|1.349566|1.386596|0.500000| |8.895981|17.733492|8.943675|5.661206|4.956241|5.644564|6.507424|3.206473|3.352865|0.090211|7.531271|2.780922|2.726374|3.113124|0.062646|0.058508|2.150479|1.861527|1.764069|2.134245|1.534807|2.278402|1.602912|1.442409|9.721435|1.872040|3.739013|2.370050|1.795574|1.590495|1.510738|1.551316|0.214223|0.500000| |5.632491|8.871443|17.730005|8.978437|5.659586|4.951794|7.508110|4.066205|4.832027|0.124199|13.164185|3.979361|4.078619|4.368395|0.087371|0.078785|2.975100|2.453850|2.284479|2.677370|1.916588|2.905717|2.009180|1.764112|11.807494|2.448128|5.062193|3.008448|2.256159|1.929757|1.831247|1.915030|0.123795|0.213819|0.500000| |8.865177|5.628796|4.952452|5.669476|8.990411|17.737745|13.189011|4.863691|4.058398|0.111105|7.503376|3.096313|2.687534|3.059068|0.061276|0.060216|1.992710|1.752205|1.664437|2.035396|1.469201|2.169617|1.534636|1.391090|9.388593|1.753754|3.512697|2.208474|1.669410|1.485219|1.388737|1.442475|0.213708|0.123722|0.107541|0.500000| |3.897040|3.789970|4.530215|6.453991|7.048320|4.928976|16.554333|17.532522|8.876892|0.174531|12.841297|6.862808|4.588401|5.050586|0.105358|0.099073|2.935746|2.538347|2.435022|2.866080|2.018452|2.999372|2.034153|1.804301|12.354336|2.666472|5.691328|3.249597|2.478499|2.097390|1.899668|2.017292|0.090868|0.087776|0.111065|0.125410|0.500000| |3.413298|3.234107|3.732583|5.118699|5.933967|4.371596|16.945089|17.625034|8.801541|0.213214|10.164562|6.756445|4.486184|4.963685|0.098355|0.102839|2.875800|2.491971|2.336950|2.795340|2.012566|3.018402|2.093035|1.858287|12.513425|2.455532|5.089505|2.966419|2.192537|1.886299|1.741855|1.876789|0.081676|0.076157|0.092552|0.117909|0.299589|0.500000| |2.936517|3.109743|3.896984|4.950587|4.334433|3.316045|8.419688|6.978611|8.891845|0.173802|12.808182|17.547338|8.882422|9.558054|0.211375|0.175622|4.645888|3.807930|3.586235|3.964126|2.749236|4.201463|2.723354|2.331951|15.956318|4.013648|9.428346|4.529388|3.323899|2.644654|2.401690|2.662036|0.070207|0.075832|0.107444|0.083267|0.209768|0.171093|0.500000| |2.707140|2.786400|3.373496|4.279741|4.008653|3.111833|8.338644|6.804709|8.905016|0.215303|10.285037|17.522522|8.826947|9.524405|0.174214|0.211392|4.589734|3.759397|3.362518|3.846385|2.784738|4.355725|2.934923|2.496541|16.550388|3.444500|7.405494|3.890383|2.736299|2.268143|2.121202|2.386904|0.065546|0.068186|0.091337|0.080273|0.167407|0.199845|0.301076|0.500000| |2.724861|2.971683|3.723440|4.365045|3.675987|2.946853|6.685283|4.512440|6.863890|0.202615|10.758826|8.767587|17.600839|12.389211|0.178878|0.219645|6.918242|4.610715|3.691463|4.118018|3.103355|5.242912|3.636671|2.915786|18.239222|3.555353|7.468991|3.909536|2.646833|2.194328|2.136795|2.433527|0.065843|0.074288|0.107966|0.073585|0.111903|0.117572|0.173103|0.209784|0.500000| |2.955373|3.364170|4.447363|5.072562|3.923657|3.118245|6.742171|4.582478|6.874585|0.166803|13.710864|8.838303|17.666862|12.442555|0.220639|0.180669|7.053331|4.689616|3.993251|4.264060|3.052323|4.969871|3.246903|2.657835|17.440721|4.197591|9.583822|4.566455|3.174095|2.534309|2.426596|2.729513|0.070494|0.084228|0.136922|0.075914|0.122939|0.111330|0.213800|0.173312|0.300932|0.500000| |2.064179|2.259130|2.686112|2.886361|2.509273|2.150538|4.488463|2.893789|3.673651|0.102651|6.342758|4.571354|6.912745|12.337995|0.182534|0.218688|17.632780|8.884881|5.501235|5.935209|4.811308|9.736115|6.519256|4.484626|26.267428|4.495413|8.501842|4.710401|2.931452|2.440262|2.500040|2.999402|0.051525|0.058999|0.080492|0.054816|0.076785|0.077655|0.113582|0.120966|0.207847|0.174086|0.500000| |2.183663|2.445243|2.962537|3.114836|2.622068|2.242426|4.573466|2.961452|3.748604|0.098650|6.948731|4.684215|7.094921|12.526982|0.229825|0.181598|17.644241|8.908073|6.448026|6.235033|4.499648|7.948224|4.701529|3.607052|23.559963|5.952120|12.048861|5.936416|3.683448|2.919333|2.971137|3.559232|0.054209|0.064235|0.091713|0.056422|0.081424|0.076966|0.125708|0.114680|0.174225|0.219158|0.301569|0.500000| |1.650926|1.766389|2.010544|2.128460|1.934447|1.714012|3.503349|2.193504|2.587732|0.073831|4.394716|3.026929|3.766252|6.208890|0.108553|0.132552|6.015290|6.371550|4.545583|5.959267|5.771576|12.044742|17.815180|8.856931|37.281648|3.459620|5.917659|3.919209|2.410590|2.126592|2.252800|2.717051|0.042113|0.046786|0.058999|0.044673|0.058347|0.060716|0.077584|0.085520|0.113388|0.096217|0.213588|0.134954|0.500000| |1.348952|1.424305|1.580589|1.656767|1.541188|1.395185|2.802628|1.728279|1.945251|0.054979|3.313636|2.213094|2.541825|4.052451|0.076679|0.087389|3.513045|4.108310|3.566621|5.421006|5.452175|7.884131|8.900230|17.805446|54.756049|2.789440|4.567159|3.388371|2.095538|1.939580|2.103906|2.514226|0.034916|0.038078|0.045895|0.036871|0.046597|0.048379|0.058607|0.063299|0.073598|0.066375|0.106265|0.085899|0.202957|0.500000| |1.839225|2.007255|2.288927|2.351804|2.095590|1.871999|3.672541|2.341976|2.543041|0.063352|4.767018|2.957109|3.133275|4.830067|0.119324|0.088245|3.531818|3.722042|4.568277|5.203986|3.111767|4.139267|2.499023|2.270973|17.474225|6.903354|12.185804|12.351823|17.580453|8.746714|6.615475|6.173585|0.046838|0.053724|0.068400|0.048174|0.070501|0.061226|0.093587|0.075262|0.075106|0.093415|0.082018|0.107238|0.065609|0.055998|0.500000| |1.815078|1.939931|2.207222|2.341045|2.133154|1.887925|3.844690|2.508399|2.662114|0.065730|4.787724|3.188039|3.215693|5.081461|0.129631|0.096444|3.472013|3.730611|4.666995|5.391381|3.182429|4.177873|2.511276|2.294389|17.844739|7.173354|13.038369|12.319916|17.638929|8.671806|5.722581|5.870114|0.046166|0.051165|0.064308|0.049100|0.076455|0.066817|0.103878|0.083355|0.076300|0.091405|0.080633|0.099099|0.065511|0.056478|0.302348|0.500000| |1.530319|1.636028|1.805930|1.848023|1.701277|1.556217|3.010963|1.880964|1.971004|0.050056|3.617910|2.222166|2.281510|3.453689|0.080951|0.066332|2.530489|2.744547|3.324638|4.265828|2.591918|3.297100|2.059214|1.950101|15.469034|4.253921|6.970723|7.893884|8.748698|17.601547|8.679750|5.660525|0.039656|0.044161|0.052879|0.040761|0.056363|0.050170|0.068721|0.058573|0.056739|0.065919|0.061614|0.073614|0.053589|0.048905|0.219161|0.193018|0.500000| |1.481257|1.567136|1.734934|1.808722|1.681726|1.526835|3.030302|1.917260|2.003023|0.051027|3.579826|2.307044|2.348978|3.663816|0.086511|0.072112|2.648744|2.978034|3.741389|4.965296|2.926667|3.613895|2.226877|2.127528|17.331403|4.756169|7.421455|9.179848|8.835139|17.555160|8.823250|6.848500|0.038316|0.041919|0.050294|0.040240|0.057190|0.051961|0.071322|0.062134|0.058433|0.066031|0.064238|0.074467|0.057092|0.052955|0.174263|0.220375|0.301921|0.500000| |1.464750|1.583089|1.756430|1.778441|1.616606|1.477836|2.840758|1.764501|1.903237|0.049194|3.508085|2.156481|2.324188|3.606818|0.082707|0.068666|2.832418|3.209987|4.005518|5.327936|3.165599|3.912570|2.406025|2.293601|18.645193|4.816864|7.136968|9.254839|6.858964|8.823105|17.551355|8.834469|0.037946|0.043041|0.052232|0.038521|0.051627|0.047077|0.064670|0.056829|0.058740|0.067543|0.068938|0.083517|0.061518|0.056874|0.185523|0.138236|0.216399|0.173886|0.500000| |1.339959|1.428281|1.571815|1.609788|1.487475|1.363588|2.649140|1.647229|1.751139|0.045504|3.161694|1.987453|2.100250|3.279543|0.074616|0.064279|2.524502|2.922197|3.667895|5.251453|3.106624|3.696427|2.296038|2.247312|18.916235|4.189327|6.165288|7.893001|5.665841|8.674762|17.599603|8.756339|0.034860|0.038664|0.046075|0.035878|0.048112|0.044569|0.059421|0.053471|0.053531|0.059559|0.062305|0.071726|0.058028|0.055996|0.135164|0.126320|0.196335|0.216292|0.301821|0.500000| |1.428869|1.519714|1.697267|1.773389|1.634580|1.473666|2.953067|1.873314|2.023370|0.052652|3.569258|2.384074|2.558497|4.246201|0.098000|0.084817|3.296113|4.172786|5.933797|9.432658|4.788552|5.263112|3.066666|2.984951|26.627597|6.432169|8.265469|12.308136|6.215755|6.647984|8.761462|17.622675|0.036856|0.040651|0.049621|0.038732|0.054248|0.051206|0.070977|0.065150|0.064798|0.070620|0.079330|0.089651|0.074764|0.071710|0.135430|0.146193|0.135623|0.186586|0.174272|0.219181|0.500000| |1.473055|1.588142|1.782447|1.834073|1.663885|1.502049|2.959435|1.861371|2.051446|0.053650|3.696664|2.396027|2.672053|4.417506|0.100342|0.085194|3.673109|4.698458|6.660977|9.996506|5.181698|5.831284|3.347850|3.198363|27.831564|6.852786|8.585354|12.252049|5.839691|5.713600|8.700931|17.668793|0.037945|0.042793|0.052942|0.039160|0.053514|0.050224|0.070396|0.064152|0.068066|0.075659|0.087868|0.104107|0.081614|0.076165|0.144348|0.128420|0.126199|0.138227|0.220629|0.194680|0.302608|0.500000| 1647.866907 -9459.426470 3551.004175 -194.381332 -4454.936720 2805.449539 -1649.487181 2.000983 40D3AFFFFFFFFFEA 444A0CF9DF3102C0 43CE73B2B312B73C 4265EE12B03D6001 C037000000000007 449400A5BFEC1B67