Version2.1 2020-12-17T13:53:53Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 29-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCCn1c2c(c(n1)C(=O)N3CCSCC3)C[C@H](CC2)[NH+]4CCc5c6ccccc6[nH]c5C4 C14732746 RHF 6-31G(d) (6D,7F) CCCn1c2c(c(n1)C(=O)N3CCSCC3)C[C@H](CC2)[NH+]4CCc5c6ccccc6[nH]c5C4 C01[X(C26H34N5O1S1)] 195 C1 567 CCCn1nc(c2c1CC[C@@H](C2)[NH+]1CCc2c(C1)[nH]c1c2cccc1)C(=O)N1CCSCC1 CCCn1nc(c2c1CC[C@@H](C2)[NH+]1CCc2c(C1)[nH]c1c2cccc1)C(=O)N1CCSCC1 CCCn1nc(C(=O)N2CCSCC2)c3C[C@H](CCc13)[NH+]4CCc5c(C4)[nH]c6ccccc56 InChIKey=LGLMXUCADSEBIS-SFHVURJKSA-O InChI=1S/C26H33N5OS/c1-2-10-31-24-8-7-18(16-21(24)25(28-31)26(32)29-12-14-33-15-13-29)30-11-9-20-19-5-3-4-6-22(19)27-23(20)17-30/h3-6,18,27H,2,7-17H2,1H3/p+1/t18-/m0/s1 InChI=1/C26H33N5OS/c1-2-10-31-24-8-7-18(16-21(24)25(28-31)26(32)29-12-14-33-15-13-29)30-11-9-20-19-5-3-4-6-22(19)27-23(20)17-30/h3-6,18,27H,2,7-17H2,1H3/p+1/t18-/m0/s1/fC26H34N5OS/h30H/q+1 CCCn1c2c(c(n1)C(=O)N3CCSCC3)C[C@H](CC2)[NH+]4CCc5c6ccccc6[nH]c5C4 C01[X(C26H34N5O1S1)] 195 C01 567 CCCn1nc(c2c1CC[C@@H](C2)[NH+]1CCc2c(C1)[nH]c1c2cccc1)C(=O)N1CCSCC1 CCC[N]1[N][C]([C]2[C]1CC[C@@H](C2)[N@@H]1CC[C]2=C(C1)N[C]1[C]2[CH][CH][CH][CH]1)[C]([N]1CCSCC1)=O CCCN1[N][C]([C]2C[C@H](CC[C]12)[NH]3CCC4=C(C3)N[C]5[CH][CH][CH][CH][C]45)C(=O)N6CCSCC6 InChIKey=VEGQIXDGOZLFCF-SFHVURJKSA-N InChI=1S/C26H34N5OS/c1-2-10-31-24-8-7-18(16-21(24)25(28-31)26(32)29-12-14-33-15-13-29)30-11-9-20-19-5-3-4-6-22(19)27-23(20)17-30/h3-6,18,27,30H,2,7-17H2,1H3/t18-/m0/s1 InChI=1/C26H34N5OS/c1-2-10-31-24-8-7-18(16-21(24)25(28-31)26(32)29-12-14-33-15-13-29)30-11-9-20-19-5-3-4-6-22(19)27-23(20)17-30/h3-6,18,27,30H,2,7-17H2,1H3/t18-/m0/s1 3444.1311415609 -1748.8099667 1-A 26597.7137 124 443 567 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764.60 802.02 817.59 846.02 881.64 902.17 934.56 948.60 1018.86 1020.06 1021.15 1037.25 1072.38 1088.96 1098.12 1117.85 1136.85 1148.98 1169.54 1216.99 1218.89 1250.64 1275.98 1297.68 1307.62 1318.07 1346.39 1365.32 1383.82 1390.80 1398.79 1406.50 1445.13 1456.64 1506.27 1522.83 1529.06 1541.38 1547.00 1556.97 1565.71 1575.39 1582.68 1599.36 1599.77 1612.59 1613.40 1643.60 1663.45 1690.72 1704.16 1746.35 1755.81 1761.25 1772.65 1782.60 1802.92 1822.02 1852.99 1865.85 1869.13 1872.03 1879.97 1921.77 1924.38 1940.13 1953.12 1964.16 1988.33 1993.31 2001.92 2012.92 2027.78 2030.33 2056.89 2071.51 2084.22 2096.42 2100.46 2103.66 2124.32 2133.30 2136.57 2168.07 2182.89 2184.97 2191.59 2212.61 2225.45 2230.85 2237.78 2244.68 2255.73 2260.22 2270.22 2290.98 2313.17 2316.66 2328.18 2330.78 2337.27 2340.56 2350.97 2352.90 2357.32 2359.36 2361.64 2364.81 2369.06 2375.15 2378.24 2382.16 2390.36 2404.57 2406.44 2437.92 2539.21 2559.63 2605.89 2633.60 2688.11 4609.05 4611.64 4615.13 4616.04 4618.70 4630.06 4655.81 4661.46 4667.36 4669.42 4675.23 4676.82 4684.70 4685.60 4698.47 4701.48 4708.43 4727.50 4733.39 4741.77 4742.26 4744.46 4767.44 4772.74 4785.07 4834.28 4843.73 4852.50 4871.02 4871.58 4875.78 4889.97 5301.84 5617.64 0.623684 0.651681 0.652625 0.561250 -1748.186283 -1748.158286 -1748.157341 -1748.248717 3.064766D-04 MUNgauss RevisionA2.0 retrievium 17-Dec-2020 DUDE CCCn1c2c(c(n1)C(=O)N3CCSCC3)C[C@H](CC2)[NH+]4CCc5c6ccccc6[nH]c5C4 C14732746 RHF 6-31G(d) (6D,10F) C1 464.248408 |X|Y|Z| 67.454609 146.548554 23.895598 61.816397 29 6 7 16 23 5 1 |36.858105| |12.467238|36.858105| |7.531798|12.472875|36.858105| |4.970644|7.666486|13.079845|53.358707| |3.976365|5.551833|7.525227|19.275514|36.858105| |3.242706|4.312371|5.281045|11.904168|14.011277|36.858105| |3.354503|4.500640|5.460114|12.284138|8.692169|13.459526|36.858105| |4.213534|6.019403|7.937401|19.593156|8.643361|8.535096|14.597877|53.358707| |2.753960|3.472314|3.904799|7.253587|5.242197|7.446953|12.700804|10.325234|36.858105| |2.448089|3.027709|3.314389|5.948566|4.669969|6.814365|8.306520|7.405671|15.707283|73.516695| |2.619282|3.191532|3.529395|6.032333|4.075034|5.052835|7.642574|8.555583|14.165475|15.083574|53.358707| |2.820530|3.370274|3.781077|6.097141|3.822144|4.313853|6.277456|8.732340|7.578314|9.367550|17.760736|36.858105| |2.897173|3.385428|3.535408|5.321866|3.289252|3.545220|4.806898|7.157621|5.437882|7.475490|10.517093|12.492014|36.858105| |2.318317|2.626316|2.672368|3.986961|2.618716|2.870026|3.624978|4.975311|4.376561|6.682019|8.219294|6.856158|10.486850|388.023441| |2.203683|2.559609|2.621152|4.091333|2.803004|3.231555|4.084948|5.131408|5.564334|9.003765|10.531966|6.338362|6.923728|74.556067|36.858105| |2.219882|2.615327|2.792169|4.534758|3.171977|3.832679|4.989105|5.817809|7.890498|12.463840|17.737316|7.771855|6.311621|48.574188|12.482371|36.858105| |2.642210|3.309406|3.809053|7.156699|7.543718|12.724333|7.173085|7.012624|5.914605|11.808266|5.717529|3.484316|2.925228|17.948002|2.927109|3.489670|36.858105| |2.559799|3.111754|3.597120|6.266731|6.759018|7.678332|4.935149|5.596892|4.071238|7.693657|4.350006|2.823734|2.437291|15.083135|2.374247|2.738787|12.377769|36.858105| |2.482197|2.959733|3.530635|6.022137|6.185451|6.653673|4.606478|5.371420|3.822745|7.003799|4.207284|2.794047|2.378215|14.653973|2.271015|2.642959|8.772161|17.584370|0.500000| |2.950446|3.625540|4.115360|6.876410|7.697415|6.741924|4.534157|5.616862|3.580437|6.472508|3.938162|2.644558|2.357929|14.426302|2.217015|2.470818|7.500796|12.399192|0.245652|36.858105| |3.735529|4.797989|5.984731|10.163667|12.739895|7.521488|5.217730|7.095674|3.785224|6.390254|4.224630|2.947672|2.621671|15.458418|2.309488|2.562119|6.229962|7.500279|0.191745|12.373967|36.858105| |2.156495|2.538048|2.808075|4.616420|4.432866|5.009677|3.728589|4.304327|3.371587|6.668973|3.729933|2.406730|2.118057|13.568116|2.159132|2.462186|7.675286|12.451537|0.253260|7.473160|4.872996|53.358707| |2.135845|2.527256|2.727690|4.489844|4.233654|4.914005|3.735795|4.266278|3.462765|7.065696|3.799884|2.412184|2.147076|13.900235|2.245877|2.539793|7.600253|9.247775|0.183133|6.632337|4.468877|25.687865|0.500000| |1.918218|2.221588|2.474538|4.026056|3.661682|4.255559|3.400381|3.898661|3.247416|6.520922|3.672920|2.357916|2.048056|13.331959|2.134969|2.478838|6.193338|7.563638|0.205991|4.917528|3.785595|17.096374|0.258147|36.858105| |1.697533|1.936858|2.100583|3.330590|2.911239|3.319402|2.800972|3.271587|2.774617|5.643815|3.226095|2.073103|1.838266|12.267897|1.975883|2.252859|4.473486|4.948868|0.130286|3.767602|2.994484|10.337217|0.205567|12.495829|36.858105| |1.646348|1.857558|1.987705|3.081826|2.683148|2.926469|2.469381|2.966427|2.392927|4.747611|2.816977|1.845234|1.665617|11.104535|1.760867|1.962567|3.758842|4.410397|0.114890|3.681018|2.874333|9.246928|0.185367|7.724801|12.725431|36.858105| |1.480659|1.646784|1.738697|2.643549|2.244007|2.407279|2.091417|2.556227|2.048002|4.025690|2.461257|1.628503|1.489760|10.051411|1.583638|1.739246|2.945393|3.325842|0.087873|2.945678|2.394440|6.165103|0.127468|4.918247|7.118848|13.207042|36.858105| |1.349844|1.491291|1.567098|2.368365|1.973187|2.125812|1.892185|2.320271|1.887521|3.714188|2.302181|1.525034|1.401627|9.581227|1.511488|1.652638|2.547294|2.759644|0.073758|2.456281|2.064004|4.814743|0.100647|3.954992|5.598906|7.278728|13.605216|36.858105| |1.254345|1.372206|1.430419|2.133505|1.756758|1.865277|1.678334|2.085514|1.670196|3.248778|2.059465|1.377942|1.278678|8.774450|1.371948|1.482917|2.178654|2.352480|0.063119|2.159024|1.844856|3.945972|0.082336|3.113413|4.012215|5.021756|7.989403|13.883965|36.858105| |1.257642|1.368485|1.419692|2.098754|1.728200|1.806223|1.618321|2.030848|1.589787|3.061707|1.960406|1.321720|1.232911|8.413302|1.304588|1.401121|2.085823|2.290421|0.061338|2.159574|1.842925|3.803414|0.078908|2.876553|3.514294|4.562242|6.888738|7.882449|13.548044|36.858105| |1.357330|1.480745|1.538055|2.274248|1.892958|1.960431|1.730904|2.175501|1.676036|3.216831|2.049292|1.383250|1.288101|8.704871|1.346587|1.448518|2.275652|2.567648|0.068340|2.454775|2.056453|4.336009|0.089270|3.164759|3.777318|5.271620|7.797161|6.731891|7.852049|13.870968|36.858105| |1.483684|1.637557|1.716407|2.573450|2.180589|2.279603|1.975421|2.453548|1.902480|3.680883|2.294744|1.536211|1.417318|9.511352|1.481419|1.609912|2.721298|3.147315|0.083001|2.937431|2.383836|5.638453|0.115363|4.104444|5.081898|8.377494|13.630234|7.879454|6.933053|8.063137|13.661420|36.858105| |1.643014|1.824569|1.921630|2.889945|2.495982|2.573127|2.177115|2.708309|2.051041|3.941999|2.445286|1.640102|1.508115|9.987266|1.550055|1.689106|3.096583|3.776326|0.098329|3.604720|2.813968|6.970684|0.138472|4.633851|5.206081|8.531479|8.482660|5.342672|4.640244|5.160437|7.590044|13.835461|53.358707| |1.665672|1.836212|1.923415|2.854442|2.454205|2.473451|2.097118|2.645574|1.953771|3.707959|2.340043|1.584406|1.465643|9.665633|1.486762|1.608978|2.899207|3.558816|0.093094|3.579605|2.822864|6.165958|0.121600|3.958565|4.179027|5.975719|5.947682|4.264743|3.937751|4.554270|6.674018|9.021369|26.095070|0.500000| |1.766337|1.993746|2.132562|3.285070|2.908316|3.071713|2.532174|3.084105|2.377754|4.627580|2.784515|1.844359|1.672152|11.000886|1.724238|1.907885|3.894939|4.960109|0.126938|4.376856|3.262191|10.672078|0.201384|6.921241|7.652586|14.150428|8.508199|5.256717|4.180864|4.196756|5.302114|8.560015|18.922852|0.249866|36.858105| |2.037057|2.336702|2.542374|3.980327|3.684864|3.819739|2.991434|3.633976|2.699354|5.181301|3.098229|2.056393|1.847929|11.907757|1.857343|2.069128|4.958988|7.431316|0.181431|6.551096|4.361754|17.279182|0.260921|7.721705|6.305960|7.525662|5.151202|3.770082|3.151742|3.170501|3.826955|5.202450|10.278220|0.187558|12.752278|36.858105| |17.578571|8.807954|5.487855|5.591276|3.439639|2.905477|3.005042|4.956232|2.542745|4.077966|3.311297|2.589087|2.722285|15.898080|2.125779|2.103458|2.427888|2.346287|0.062578|2.695113|3.269961|2.746118|0.056082|1.795915|1.610402|1.570880|1.423906|1.303048|1.216652|1.222507|1.316903|1.431117|2.147280|0.044507|1.682198|1.918542|0.500000| |17.549966|8.772099|6.821838|6.260839|3.614723|3.031308|3.228914|5.585189|2.698436|4.213971|3.585560|2.927253|3.043723|17.088012|2.224306|2.232963|2.473770|2.375440|0.064873|2.658184|3.320599|2.738280|0.055144|1.820767|1.614197|1.555446|1.402652|1.286576|1.196310|1.195046|1.282682|1.398495|2.092808|0.043125|1.654129|1.891760|0.302165|0.500000| |17.538510|8.757075|6.810335|6.232646|3.859361|3.092661|3.085347|5.108774|2.532973|4.060945|3.249180|2.540924|2.550839|14.792665|2.000437|2.039218|2.570286|2.567245|0.069786|3.014274|3.855105|2.948137|0.059023|1.918568|1.694133|1.657586|1.492461|1.355196|1.262269|1.272229|1.379523|1.506404|2.283626|0.047582|1.794423|2.079796|0.302031|0.301458|0.500000| |8.829390|17.565350|8.914291|9.604778|5.067336|4.268647|4.782229|8.914161|3.790280|5.765872|4.838010|3.794059|3.980408|21.397223|2.895227|2.893212|3.263473|2.950474|0.077387|3.308598|4.146446|3.321194|0.068370|2.162588|1.902119|1.807978|1.607188|1.465886|1.347837|1.336719|1.436681|1.585970|2.382201|0.048579|1.915789|2.215475|0.212158|0.210451|0.172526|0.500000| |8.831659|17.524335|8.870205|9.495921|5.807893|4.443472|4.351818|7.291201|3.371245|5.395077|4.098175|3.050967|3.035549|17.355314|2.449815|2.507353|3.493533|3.340881|0.086046|4.078568|5.347838|3.714439|0.076174|2.330532|2.035808|1.973023|1.745609|1.569229|1.443753|1.446779|1.575962|1.747751|2.673695|0.055186|2.142178|2.533147|0.212546|0.172665|0.209893|0.303478|0.500000| |6.831304|8.798746|17.592379|12.572628|7.109097|4.820871|4.583414|7.996483|3.389188|5.291004|4.150887|3.209814|2.974097|16.610771|2.311488|2.477062|3.671252|3.688093|0.102611|4.383556|6.766734|3.904100|0.076063|2.506959|2.115519|2.025834|1.771188|1.586264|1.450806|1.448785|1.579771|1.764017|2.712874|0.055876|2.203068|2.657719|0.139971|0.167976|0.202045|0.173830|0.211567|0.500000| |6.871038|8.815199|17.624018|12.647406|5.816951|4.569137|5.056830|10.193059|3.796004|5.615036|4.903421|4.095155|3.834319|20.008305|2.667618|2.837624|3.390568|3.168143|0.088386|3.452248|4.688631|3.443453|0.068081|2.293957|1.961369|1.844033|1.623829|1.476965|1.351327|1.336257|1.437319|1.595216|2.405198|0.048963|1.954483|2.291310|0.140494|0.203739|0.168948|0.212150|0.173532|0.303067|0.500000| |2.497055|2.887656|3.248697|5.081457|3.294755|3.687081|4.930155|6.682696|5.917653|8.068184|12.565343|17.566620|8.875257|45.955055|5.755777|7.265004|3.121380|2.590706|0.072418|2.397905|2.636602|3.058608|0.062117|2.249297|1.991755|1.766881|1.567899|1.478942|1.338284|1.279276|1.331763|1.473816|2.126876|0.041853|1.752398|1.933598|0.063917|0.072537|0.063483|0.088014|0.073150|0.079062|0.098545|0.500000| |3.196177|3.891120|4.628485|7.588035|4.474917|4.865956|7.294120|11.560166|7.179158|8.792905|12.408849|17.739856|8.883769|36.352088|4.761054|5.656260|3.716205|3.049318|0.084792|2.891999|3.345532|3.439553|0.069438|2.444791|2.111982|1.890127|1.658334|1.539945|1.390931|1.341032|1.412622|1.573677|2.308048|0.045706|1.911139|2.163428|0.079406|0.092832|0.079860|0.120079|0.095379|0.106610|0.144327|0.302624|0.500000| |2.935927|3.309106|3.457733|4.945386|3.020338|3.141820|4.071967|6.315990|4.310922|6.144477|7.633198|8.857632|17.588383|57.370748|5.148636|4.788684|2.610306|2.238294|0.061368|2.190282|2.461580|2.654107|0.054462|1.888259|1.697713|1.550878|1.394757|1.314028|1.204907|1.165937|1.218055|1.333955|1.931593|0.038479|1.563102|1.725191|0.076391|0.088159|0.071680|0.106901|0.080837|0.081352|0.107889|0.213755|0.214056|0.500000| |3.269404|3.933059|3.937767|5.914189|3.572485|3.793745|5.184646|8.062831|5.548038|7.650966|9.472576|8.858834|17.586310|56.079190|6.269524|5.538296|3.064167|2.542937|0.067855|2.510212|2.813677|2.987476|0.062277|2.081697|1.867031|1.704480|1.522522|1.424933|1.301052|1.259862|1.322090|1.456087|2.120038|0.042183|1.724585|1.917717|0.085996|0.094176|0.078207|0.135049|0.097526|0.089690|0.115949|0.173946|0.213615|0.301719|0.500000| |1.963289|2.239552|2.282086|3.507261|2.445080|2.793751|3.373470|4.241040|4.413617|7.601316|7.637565|4.802812|5.148342|57.367633|17.590174|8.854197|2.612044|2.158432|0.057518|2.010130|2.065066|2.726700|0.058006|2.003457|1.885503|1.682805|1.527759|1.472234|1.340998|1.270546|1.302544|1.425131|2.011653|0.039305|1.634785|1.737713|0.052980|0.055014|0.049956|0.069368|0.060036|0.056804|0.064376|0.129683|0.105838|0.116310|0.130699|0.500000| |2.319929|2.730131|2.729599|4.279700|2.942471|3.394269|4.265297|5.343033|5.686229|9.450624|9.477521|5.555585|6.278030|56.181796|17.579080|8.854186|3.064528|2.465999|0.064419|2.331680|2.417674|3.052350|0.065603|2.178180|2.021018|1.813288|1.629560|1.548545|1.406219|1.341547|1.389434|1.530059|2.186477|0.042865|1.784971|1.928091|0.062727|0.064219|0.058118|0.086967|0.073479|0.066445|0.075740|0.132263|0.123781|0.130814|0.180950|0.301993|0.500000| |2.098286|2.475763|2.632501|4.318216|3.142489|3.902932|4.812759|5.353273|7.745605|15.099513|12.510122|5.673439|4.762210|36.234097|8.861798|17.696712|3.750096|2.888347|0.076479|2.552847|2.572503|3.606120|0.076942|2.696690|2.476979|2.126803|1.877630|1.788953|1.593578|1.494531|1.540416|1.719926|2.444048|0.047149|2.042031|2.195961|0.055470|0.057898|0.054035|0.075076|0.067237|0.065790|0.072843|0.148204|0.127748|0.105800|0.124161|0.212289|0.214633|0.500000| |2.063807|2.383926|2.574799|4.095870|2.865999|3.385717|4.249570|5.115105|6.050251|9.712772|12.477655|7.187218|5.678810|45.392419|8.847056|17.568373|3.128166|2.529735|0.069179|2.272568|2.360757|3.120703|0.064856|2.352267|2.145277|1.866708|1.663404|1.590902|1.430915|1.348903|1.388410|1.537173|2.183892|0.042450|1.806163|1.945654|0.054169|0.058243|0.053084|0.072235|0.063080|0.064279|0.073823|0.224608|0.147295|0.128217|0.131029|0.213931|0.173674|0.301468|0.500000| |2.384930|2.915010|3.363052|6.112463|5.769603|8.992231|6.585122|6.361505|6.240601|13.239403|6.080240|3.605377|2.942066|18.365104|3.045193|3.780030|17.657839|8.726277|0.216067|5.477772|4.823460|9.242451|0.182450|6.737486|4.789640|3.769547|2.953410|2.600575|2.202284|2.073262|2.227648|2.657198|4.008069|0.075516|3.711578|4.458263|0.061048|0.063164|0.064324|0.080896|0.083350|0.089756|0.086311|0.091899|0.104713|0.072684|0.083353|0.076049|0.086541|0.115365|0.095576|0.500000| |2.539447|3.169330|3.457918|6.236722|6.082268|8.953704|6.196091|6.254942|5.610904|12.187403|5.479139|3.274038|2.842886|17.889131|2.987143|3.475912|17.515167|8.799618|0.173499|6.566401|5.249155|9.890454|0.239514|5.691519|4.526590|3.856716|3.049116|2.642601|2.257941|2.157573|2.349469|2.808809|4.314403|0.081961|3.953003|4.831748|0.066062|0.065578|0.068101|0.088326|0.094790|0.091516|0.085315|0.081063|0.094198|0.069857|0.083903|0.074543|0.089036|0.106405|0.084861|0.305430|0.500000| |2.734270|3.219511|3.599253|5.608221|5.624747|4.934149|3.638642|4.646910|2.989983|5.404676|3.400259|2.321667|2.093052|12.964594|1.970444|2.175042|5.463417|8.744113|0.210429|17.616882|8.936567|9.339507|0.162528|4.655076|3.666758|3.772600|3.050966|2.507114|2.222481|2.260247|2.617078|3.138971|5.430485|0.113581|4.733735|7.446627|0.069839|0.068619|0.079300|0.080868|0.100018|0.109866|0.085556|0.059354|0.070171|0.054669|0.061424|0.050163|0.057200|0.062272|0.056292|0.122360|0.137624|0.500000| |2.954696|3.662086|3.906958|6.439031|6.728933|6.223648|4.386800|5.421655|3.551856|6.544964|3.896618|2.585417|2.352877|14.547198|2.257711|2.475051|6.936198|8.835960|0.173682|17.527855|8.829052|9.198232|0.191841|4.461740|3.641210|3.617947|2.943671|2.462503|2.175573|2.183682|2.483266|2.954582|4.906205|0.099671|4.279153|6.020376|0.076565|0.073013|0.082725|0.094332|0.118571|0.111809|0.090528|0.064570|0.077306|0.060273|0.070555|0.056927|0.067043|0.071556|0.062436|0.139925|0.196726|0.302121|0.500000| |4.266628|5.464075|6.263426|9.151365|8.868993|5.733458|4.450952|6.395356|3.343794|5.633140|3.838948|2.723317|2.502053|14.811802|2.183491|2.362260|4.831971|5.511176|0.139940|8.877146|17.576306|5.534612|0.107340|3.207650|2.651531|2.607297|2.224532|1.929491|1.747880|1.763703|1.971266|2.251571|3.608115|0.075168|2.974460|3.850257|0.103867|0.101004|0.125608|0.124627|0.182565|0.205570|0.130803|0.067554|0.085213|0.065861|0.075598|0.054417|0.064016|0.065497|0.060395|0.107820|0.122359|0.211402|0.221601|0.500000| |3.534578|4.283508|5.593386|8.710128|8.923998|6.049955|4.548235|6.312968|3.415861|5.721851|3.929866|2.805419|2.474649|14.617979|2.152732|2.399680|5.236944|6.550451|0.195111|8.794925|17.526267|6.085494|0.109778|3.659461|2.877108|2.766717|2.318316|2.005190|1.798202|1.798749|2.004675|2.313282|3.705738|0.076193|3.134106|4.147777|0.084935|0.089475|0.104028|0.102345|0.125651|0.189843|0.128598|0.071089|0.089209|0.065545|0.072408|0.053813|0.061634|0.066469|0.062554|0.121631|0.120365|0.222316|0.173955|0.303680|0.500000| |1.879609|2.150252|2.423217|3.873193|3.484988|3.875411|3.139331|3.697632|2.949136|5.714276|3.409202|2.241811|1.945976|12.600938|1.980364|2.289999|5.177986|6.724948|0.212988|4.654892|3.706721|12.422384|0.182644|17.620560|8.791118|6.774932|4.617137|3.739210|3.007042|2.815725|3.114059|3.989558|6.187151|0.110012|6.504112|7.375498|0.048640|0.049768|0.052706|0.057578|0.062216|0.069270|0.062835|0.059958|0.065201|0.050394|0.054635|0.051676|0.055658|0.068033|0.061183|0.154290|0.126996|0.128705|0.112588|0.087143|0.103998|0.500000| |1.968345|2.301446|2.590120|4.310677|3.895494|4.804431|3.879347|4.294488|3.806642|7.834954|4.228216|2.654044|2.257459|14.669826|2.383447|2.841679|7.292087|7.388055|0.204785|4.656475|3.789419|12.280401|0.214822|17.711850|8.804520|5.596322|3.997160|3.425104|2.757416|2.529901|2.718392|3.377601|5.030864|0.090400|5.026280|5.636490|0.050998|0.052245|0.054154|0.062915|0.066297|0.071731|0.067263|0.070449|0.076032|0.057289|0.063255|0.061831|0.067060|0.086908|0.074871|0.260005|0.177657|0.116575|0.117814|0.088143|0.101216|0.301335|0.500000| |1.584464|1.790438|1.948291|3.058472|2.617953|2.963291|2.571758|3.031116|2.584581|5.201408|3.067990|1.986919|1.757857|11.822440|1.894924|2.167211|3.820312|4.117219|0.114070|3.213780|2.665564|7.587464|0.146673|8.989294|17.559065|8.876747|6.418683|5.681953|4.054297|3.436119|3.552718|4.554863|6.016712|0.101121|5.830117|4.904163|0.041738|0.042180|0.043939|0.048951|0.051735|0.054507|0.051146|0.053715|0.056001|0.045315|0.049113|0.050605|0.053243|0.066024|0.058172|0.117116|0.104794|0.087586|0.085266|0.065894|0.072504|0.219909|0.208344|0.500000| |1.692118|1.940552|2.080772|3.318055|2.872767|3.348902|2.873760|3.315430|2.924559|6.130421|3.384345|2.137067|1.903379|12.846196|2.106174|2.399419|4.536638|4.601954|0.116445|3.570200|2.875391|8.970411|0.204989|8.829360|17.519482|8.854609|6.149325|5.282702|3.855635|3.332073|3.493041|4.502517|6.114157|0.102828|6.053423|5.236986|0.044830|0.044688|0.046517|0.053518|0.056728|0.057452|0.053982|0.056814|0.059744|0.048428|0.053823|0.056070|0.060218|0.074585|0.062888|0.136052|0.135128|0.093844|0.099248|0.071366|0.075270|0.173366|0.218969|0.304092|0.500000| |1.332147|1.475195|1.554950|2.362612|1.959161|2.138873|1.921852|2.339960|1.945571|3.859763|2.380568|1.567466|1.434846|9.872146|1.568144|1.724399|2.570856|2.716155|0.072962|2.372292|2.015413|4.675982|0.098088|4.011765|5.856791|6.441665|8.822100|17.713802|8.944825|5.613123|4.878101|5.604704|5.886242|0.098779|4.555274|3.471030|0.035682|0.035416|0.036984|0.040500|0.042879|0.043464|0.040911|0.042414|0.043715|0.037271|0.040323|0.042616|0.044434|0.052204|0.046279|0.074382|0.074042|0.066200|0.065847|0.052030|0.054395|0.103976|0.099401|0.177924|0.160206|0.500000| |1.179526|1.285401|1.336931|1.987192|1.620676|1.722925|1.569135|1.955006|1.574696|3.058336|1.958709|1.313174|1.222452|8.449574|1.320012|1.421801|1.990224|2.113398|0.056978|1.942626|1.685703|3.461679|0.072321|2.749509|3.467687|4.040735|5.662671|8.973176|17.733595|8.877942|5.627016|4.984732|5.006720|0.089586|3.413911|2.699287|0.031841|0.031362|0.032899|0.035202|0.037405|0.037542|0.035261|0.035572|0.036665|0.032042|0.034447|0.036037|0.037478|0.042437|0.038264|0.056265|0.057249|0.055151|0.054379|0.044473|0.045719|0.073915|0.069266|0.099635|0.094594|0.215695|0.500000| |1.184242|1.279989|1.321650|1.938673|1.581892|1.643434|1.485790|1.877922|1.461463|2.797909|1.815790|1.231109|1.154760|7.906970|1.219743|1.301828|1.870059|2.035950|0.054727|1.943132|1.682988|3.296454|0.068345|2.475643|2.935308|3.629757|4.961278|5.639107|8.880896|17.728116|8.993988|5.698180|5.631461|0.106703|3.428518|2.719550|0.032077|0.031309|0.033298|0.034755|0.037521|0.037461|0.034659|0.033159|0.034657|0.030430|0.032763|0.033088|0.034817|0.038426|0.034891|0.051588|0.053653|0.056463|0.054660|0.045062|0.045735|0.067697|0.061505|0.080402|0.078248|0.124043|0.215768|0.500000| |1.345591|1.458183|1.506876|2.206437|1.828021|1.867630|1.652492|2.097307|1.588469|3.021809|1.949072|1.324997|1.240288|8.360990|1.284124|1.373234|2.133915|2.417501|0.064445|2.372051|2.004635|3.974609|0.081445|2.826891|3.223865|4.299501|5.569982|4.878647|5.594063|8.907458|17.721587|8.817345|9.123909|0.188530|4.614507|3.554622|0.036357|0.035249|0.038154|0.039146|0.043219|0.043187|0.039066|0.035389|0.037694|0.032695|0.035446|0.034460|0.036855|0.040324|0.036554|0.057475|0.061015|0.071079|0.066820|0.053981|0.054412|0.078014|0.068176|0.084069|0.083338|0.106255|0.123744|0.215329|0.500000| |2.153897|2.475105|2.642976|4.088808|3.791285|3.796441|2.972123|3.671092|2.642917|5.024597|3.035550|2.026142|1.845011|11.847630|1.838914|2.020118|4.709455|6.771744|0.156526|7.327513|4.660456|12.330641|0.229486|5.622326|4.882349|5.770097|4.430657|3.357855|2.908395|2.998081|3.651670|4.741333|9.423246|0.191733|8.930876|17.649884|0.056659|0.054880|0.061330|0.064714|0.076022|0.077075|0.065203|0.052466|0.059341|0.047890|0.053750|0.047659|0.053522|0.059224|0.052380|0.112613|0.132125|0.246371|0.203960|0.118842|0.118732|0.146605|0.126360|0.109150|0.121994|0.085410|0.069743|0.072569|0.097334|0.500000| |2.046731|2.324221|2.574252|3.977978|3.662365|3.676743|2.899349|3.583279|2.583184|4.848250|2.999752|2.023396|1.809835|11.578462|1.781826|1.989653|4.545249|6.981329|0.196607|6.331449|4.472379|12.368612|0.182348|6.856942|5.333707|6.027171|4.453964|3.393348|2.898211|2.935151|3.509515|4.566213|8.618490|0.168213|8.804912|17.580141|0.053105|0.053031|0.058653|0.060564|0.069290|0.076127|0.064798|0.053177|0.059697|0.047321|0.051882|0.046254|0.050955|0.058004|0.052465|0.115742|0.116546|0.217779|0.148166|0.108444|0.125255|0.215124|0.144624|0.124917|0.121260|0.087460|0.069768|0.070932|0.092233|0.301195|0.500000| 1747.344817 -10960.792908 4234.258414 -213.751756 -5192.941433 3444.131389 -1748.810043 2.000839 40FB36000000000E 44B2A3F71FBFFE25 44332A1DF1597036 42A8381E3CDD6800 C0A5300000000000 44B21A159A79FCC1