Version2.0 2020-03-03T18:57:53Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 14-Jan-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOc1ccc(cc1OC)[C@H]2C3=C(c4ccccc4O[C@@H]3c5ccccc5)[NH+]=C6N2NC(=N6)SC C09346232 RHF 6-31G(d) (6D,7F) CCOc1ccc(cc1OC)[C@H]2C3=C(c4ccccc4O[C@@H]3c5ccccc5)[NH+]=C6N2NC(=N6)SC C01[X(C28H27N4O3S1)] 183 C1 598 CCOc1ccc(cc1OC)[C@H]1C2=C([NH+]=c3n1[nH]c(n3)SC)c1c(O[C@@H]2c2ccccc2)cccc1 CCOc1ccc(cc1OC)[C@H]1C2=C([NH+]=c3n1[nH]c(n3)SC)c1c(O[C@@H]2c2ccccc2)cccc1 CCOc1ccc(cc1OC)[C@@H]2N3NC(=NC3=[NH+]C4=C2[C@H](Oc5ccccc45)c6ccccc6)SC InChIKey=XLKODRAUQKFWAG-IZZNHLLZSA-O InChI=1S/C28H26N4O3S/c1-4-34-21-15-14-18(16-22(21)33-2)25-23-24(29-27-30-28(36-3)31-32(25)27)19-12-8-9-13-20(19)35-26(23)17-10-6-5-7-11-17/h5-16,25-26H,4H2,1-3H3,(H,29,30,31)/p+1/t25-,26+/m0/s1 InChI=1/C28H26N4O3S/c1-4-34-21-15-14-18(16-22(21)33-2)25-23-24(29-27-30-28(36-3)31-32(25)27)19-12-8-9-13-20(19)35-26(23)17-10-6-5-7-11-17/h5-16,25-26H,4H2,1-3H3,(H,29,30,31)/p+1/t25-,26+/m0/s1/fC28H27N4O3S/h29,31H/q+1 CCOc1ccc(cc1OC)[C@H]2C3=C(c4ccccc4O[C@@H]3c5ccccc5)[NH+]=C6N2NC(=N6)SC C01[X(C28H27N4O3S1)] 183 C01 598 CCOc1ccc(cc1OC)[C@H]1C2=C([NH+]=c3n1[nH]c(n3)SC)c1c(O[C@@H]2c2ccccc2)cccc1 CCOc1ccc(cc1OC)[C@@H]1N2N[C@H](N[C@H]2NC2=C1[C@H](Oc1c2cccc1)c1ccccc1)SC CCOc1ccc(cc1OC)[C@@H]2N3N[C@H](N[C@H]3NC4=C2[C@H](Oc5ccccc45)c6ccccc6)SC InChIKey=YBHZPEDBYITSHQ-HFLBTKGNSA-N InChI=1S/C28H30N4O3S/c1-4-34-21-15-14-18(16-22(21)33-2)25-23-24(29-27-30-28(36-3)31-32(25)27)19-12-8-9-13-20(19)35-26(23)17-10-6-5-7-11-17/h5-16,25-31H,4H2,1-3H3/t25-,26+,27+,28-/m0/s1 InChI=1/C28H30N4O3S/c1-4-34-21-15-14-18(16-22(21)33-2)25-23-24(29-27-30-28(36-3)31-32(25)27)19-12-8-9-13-20(19)35-26(23)17-10-6-5-7-11-17/h5-16,25-31H,4H2,1-3H3/t25-,26+,27+,28-/m0/s1 4055.0485349964 -1915.6952741 1-A 18912.4262 131 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0.00274 0.10898 0.08997 0.05708 21.33 25.26 30.37 40.01 54.33 80.67 82.60 92.32 116.79 121.24 129.53 140.95 167.05 177.05 194.06 222.02 238.21 241.64 254.59 264.15 286.32 323.24 342.54 373.14 396.86 399.32 418.26 440.06 448.00 481.67 506.82 526.81 548.96 568.85 592.37 606.44 653.32 655.52 683.04 721.45 736.98 740.25 752.49 784.81 810.24 829.08 868.86 875.21 910.07 925.41 944.63 957.97 977.24 986.95 1024.43 1050.09 1061.27 1085.49 1118.04 1141.82 1166.10 1182.45 1196.26 1215.66 1225.85 1232.76 1244.70 1258.61 1282.11 1296.34 1314.82 1340.97 1348.43 1375.33 1378.09 1412.30 1418.84 1454.76 1472.03 1509.02 1524.31 1545.92 1556.79 1570.50 1579.16 1587.56 1587.94 1608.40 1622.14 1625.17 1631.86 1635.18 1662.96 1667.25 1693.27 1708.75 1719.23 1753.27 1760.30 1789.13 1798.69 1812.11 1827.69 1843.28 1859.94 1868.89 1882.87 1887.24 1899.12 1913.83 1917.56 1926.05 1932.99 1934.68 1970.22 1989.21 2022.67 2025.54 2062.69 2065.84 2080.89 2082.95 2095.26 2108.99 2158.13 2180.21 2181.94 2194.17 2225.90 2240.23 2254.82 2281.54 2299.03 2309.46 2321.16 2337.36 2341.19 2341.92 2358.98 2364.50 2376.46 2380.50 2383.47 2393.93 2405.95 2409.97 2460.50 2537.56 2549.62 2569.85 2571.52 2583.03 2583.71 2604.00 2606.13 2729.86 4610.82 4615.28 4616.81 4637.45 4677.74 4690.15 4706.41 4712.92 4736.28 4755.38 4816.86 4830.38 4831.74 4832.32 4843.13 4855.73 4857.92 4861.42 4867.66 4877.36 4879.43 4887.37 4891.36 4906.28 4919.41 5512.09 5580.27 0.545576 0.575602 0.576546 0.480903 -1915.149698 -1915.119672 -1915.118728 -1915.214372 3.207915D-04 MUNgauss RevisionA2.0 retrievium 03-Mar-2020 DUDE CCOc1ccc(cc1OC)[C@H]2C3=C(c4ccccc4O[C@@H]3c5ccccc5)[NH+]=C6N2NC(=N6)SC C09346232 RHF 6-31G(d) (6D,10F) C1 499.180388 |X|Y|Z| 87.271295 98.470947 39.994890 70.047829 29 6 7 8 24 4 1 |36.858105| |12.582605|36.858105| |8.073106|13.484873|73.516695| |5.246252|7.986649|25.432112|36.858105| |4.400047|6.685339|14.068680|13.806143|36.858105| |3.334845|4.491603|9.249993|7.899921|13.676582|36.858105| |2.975335|3.776751|8.216199|6.820757|7.938018|13.857679|36.858105| |3.203763|3.975486|9.441386|7.905969|6.895519|7.950791|13.591725|36.858105| |4.089109|5.224577|14.572356|13.471326|7.905013|6.842264|7.876665|13.834395|36.858105| |4.154899|4.791341|13.191148|8.181512|5.301449|4.625181|5.186440|7.910964|14.245496|73.516695| |3.237966|3.547479|8.540274|5.239114|3.983799|3.791053|4.497576|6.719446|8.021961|24.165275|36.858105| |2.406084|2.912000|6.006903|4.419859|5.004521|7.533329|12.553501|7.578573|5.023695|6.881092|3.683345|36.858105| |2.275908|2.687941|5.619627|4.016003|4.215017|5.623371|8.975868|7.497417|4.864411|7.006324|3.979455|17.526038|0.500000| |2.194589|2.618195|5.214029|3.667767|4.201443|5.887284|7.343522|5.254889|3.958459|5.697292|3.076731|12.521980|0.247814|36.858105| |1.949972|2.290015|4.429412|3.003905|3.452143|4.573635|5.104352|3.910724|3.142429|4.685095|2.547812|7.592815|0.172253|14.339331|36.858105| |1.775884|2.049607|3.898840|2.564787|2.890209|3.582949|3.829512|3.150536|2.651637|4.073954|2.233325|4.935390|0.122295|7.822037|12.978392|36.858105| |1.616391|1.845156|3.446515|2.220508|2.499033|2.998964|3.090093|2.600941|2.256400|3.522031|1.928030|3.777408|0.095272|5.127003|7.504817|13.677525|36.858105| |1.492381|1.680664|3.117669|1.973550|2.183144|2.535246|2.598527|2.261250|2.002654|3.182288|1.752781|3.046151|0.078942|3.940771|5.032953|7.917547|13.803705|36.858105| |1.491174|1.669454|3.112673|1.961208|2.135818|2.448541|2.539918|2.257010|2.007450|3.218570|1.786057|2.929835|0.077262|3.805838|4.499623|6.876850|7.959659|13.708296|36.858105| |1.612781|1.815136|3.430446|2.183566|2.361922|2.731959|2.897961|2.582625|2.266733|3.617719|2.016893|3.368976|0.089374|4.574733|5.131296|7.898690|6.855901|7.903335|13.781059|36.858105| |1.773776|2.029230|3.886621|2.535263|2.781157|3.345346|3.637669|3.129516|2.657620|4.143199|2.297864|4.457156|0.115554|6.843145|7.866698|13.683093|7.928947|6.874307|7.981903|13.771356|36.858105| |1.922916|2.208249|4.325234|2.858860|3.069559|3.700818|4.226369|3.719172|3.086570|4.791953|2.684392|5.134631|0.137061|7.930729|7.026269|8.019254|5.237193|4.625142|5.273433|8.092190|14.134484|73.516695| |2.225900|2.626242|5.250976|3.621904|3.969818|5.061279|6.055164|4.995268|3.946348|5.828930|3.176765|7.310655|0.179486|12.544911|7.788113|6.787702|4.569387|3.842581|4.040019|5.317002|8.031107|23.859831|36.858105| |2.292196|2.682928|5.520238|3.819469|3.959102|4.869099|6.301624|5.791693|4.423317|6.614087|3.714533|7.174605|0.199230|8.997288|5.883527|5.098848|3.718003|3.234312|3.432738|4.411749|5.961076|17.164967|17.623309|0.500000| |2.452897|2.935632|5.740578|3.921316|4.419454|5.335322|5.516598|4.619247|3.991470|5.860936|3.054117|5.455962|0.129738|7.373578|5.601415|5.325905|4.013253|3.523672|3.725783|4.697781|6.114692|13.967225|12.516298|0.249839|36.858105| |2.419378|2.917035|5.449416|3.648574|4.368595|5.221246|4.785149|3.870735|3.483520|5.134329|2.626614|4.708018|0.108693|6.188571|5.424992|5.353162|4.301380|3.749804|3.808340|4.481809|5.546727|10.354844|7.445537|0.156158|13.704418|36.858105| |2.527088|3.023873|5.428609|3.477124|4.107296|4.425746|3.882814|3.328789|3.186100|4.817790|2.431471|3.624731|0.086783|4.297818|3.916401|3.952107|3.451744|3.173323|3.250219|3.662064|4.119883|7.568429|4.981239|0.117147|7.907151|13.757020|36.858105| |2.699484|3.172480|5.699021|3.533358|3.926993|3.956322|3.573492|3.261591|3.244708|5.037444|2.534112|3.229823|0.080027|3.658078|3.250391|3.263875|2.860130|2.698511|2.841314|3.240152|3.537286|6.821396|4.421887|0.111755|6.833207|7.931347|13.748052|36.858105| |2.750216|3.201520|6.042647|3.783598|3.968560|4.007637|3.849138|3.673135|3.645157|5.720845|2.911636|3.441625|0.087342|3.860581|3.284964|3.255425|2.768876|2.609051|2.804946|3.316795|3.669221|7.598455|5.029579|0.134654|7.896690|6.880303|7.951897|13.757136|36.858105| |2.611219|3.073325|6.066006|4.003892|4.199968|4.567747|4.720312|4.441151|4.107311|6.267539|3.262945|4.326097|0.109781|5.062357|4.036894|3.919466|3.156433|2.905051|3.144017|3.894351|4.577347|10.448981|7.621300|0.207327|13.714398|7.963937|6.896521|7.945368|13.756274|36.858105| |1.856756|2.169451|4.156268|2.787468|3.210720|4.188889|4.546750|3.532793|2.886958|4.345509|2.363812|6.572389|0.154332|7.972437|13.487564|7.732359|6.455592|4.416747|3.743656|3.933645|5.182691|8.301698|5.054409|0.119314|4.069075|4.114500|3.224489|2.721536|2.706598|3.173247|53.358707| |1.699095|1.959071|3.710947|2.437048|2.767899|3.459874|3.674543|2.987771|2.509333|3.857359|2.113763|4.918595|0.122698|5.807737|9.027554|7.167980|7.099701|4.786828|3.858470|3.853818|4.800240|7.339002|4.190690|0.100758|3.488835|3.580925|2.901730|2.467989|2.435705|2.798789|26.039755|0.500000| |1.970819|2.320513|4.489608|3.050439|3.527819|4.696025|5.189597|3.947773|3.176315|4.720472|2.551487|7.610616|0.175822|6.930210|8.076830|5.182031|4.468934|3.383225|2.988202|3.164460|4.002513|6.930131|4.465616|0.112024|3.699104|3.682923|2.978008|2.568919|2.572993|2.988439|19.626623|0.264732|36.858105| |2.241729|2.692066|5.361646|3.798330|4.429011|6.361053|7.786509|5.372340|4.051996|5.772837|3.075680|12.919227|0.254889|7.991929|7.108083|4.595326|3.785551|2.989770|2.755624|3.015157|3.841354|7.146069|5.002899|0.130462|4.123811|3.944723|3.170703|2.778576|2.837720|3.352513|11.315825|0.166415|14.430682|53.358707| |2.252030|2.678620|5.341558|3.707725|4.171791|5.439538|6.314705|4.997755|3.959472|5.779158|3.086032|7.599320|0.190654|5.135643|4.732845|3.474680|3.028541|2.490867|2.310259|2.483897|3.018101|5.610678|3.765828|0.102849|3.270796|3.153105|2.672740|2.406959|2.457110|2.814238|7.615963|0.128073|8.890729|18.875673|53.358707| |1.991976|2.322971|4.491064|2.991840|3.359272|4.149942|4.462413|3.700311|3.105459|4.713376|2.544715|5.338302|0.137765|4.258159|4.326738|3.306009|3.020210|2.482068|2.252069|2.356942|2.804495|5.015686|3.205091|0.085800|2.822079|2.798741|2.409509|2.156100|2.165791|2.435240|7.668491|0.138326|9.118178|11.988412|19.320528|36.858105| |1.852149|2.151449|4.112045|2.723982|3.094299|3.872712|4.122433|3.351502|2.808133|4.278503|2.322493|5.270245|0.132933|4.675342|5.240582|3.934056|3.662920|2.908623|2.563255|2.643183|3.173553|5.470036|3.406712|0.088280|2.951533|2.973203|2.516880|2.210259|2.200228|2.486104|10.895477|0.202357|14.265169|11.748886|11.794601|14.532250|53.358707| |1.873684|2.137482|4.070437|2.610700|2.842641|3.257033|3.384990|3.017589|2.676975|4.215781|2.287045|3.694171|0.099427|3.081637|3.109740|2.553356|2.407227|2.054832|1.882042|1.945025|2.236896|4.000107|2.497430|0.068011|2.270437|2.263407|2.018582|1.841613|1.844736|2.025781|5.148122|0.099128|5.029671|6.776559|9.660143|11.007785|9.509802|388.023441| |1.627245|1.832780|3.421775|2.156896|2.360196|2.680476|2.734343|2.433306|2.185044|3.485949|1.902463|3.040420|0.081454|2.730212|2.897008|2.470466|2.426138|2.084851|1.874353|1.890536|2.135090|3.708698|2.243839|0.060098|2.051701|2.081200|1.869153|1.693285|1.676651|1.824630|4.927187|0.101210|4.457751|5.377914|6.432243|6.968762|8.790218|74.501966|36.858105| |17.586216|8.867434|12.945772|4.889414|4.023061|3.133930|2.863603|3.136864|4.007244|7.518419|3.328156|2.334516|0.062077|2.098681|1.870479|1.695216|1.545896|1.425566|1.420756|1.533029|1.686642|3.248155|2.104197|0.060594|2.265756|2.216448|2.272309|2.393322|2.458393|2.386531|2.449459|0.045845|1.928287|2.989921|3.060760|1.991411|2.492699|13.522306|1.638508|0.500000| |17.562763|8.891542|10.244866|4.246075|3.841706|3.000146|2.651028|2.774684|3.384236|5.996422|2.736704|2.193734|0.057404|2.031139|1.831591|1.683562|1.548701|1.436936|1.431892|1.535896|1.675811|3.191628|2.054133|0.058050|2.273831|2.286238|2.424796|2.578923|2.564869|2.401135|2.386596|0.044883|1.850597|2.822731|2.831937|1.869396|2.382700|12.599103|1.558752|0.300478|0.500000| |17.587245|8.868944|12.941949|4.903586|4.025962|3.140443|2.873399|3.150004|4.027827|7.563693|3.355468|2.341935|0.062095|2.161530|1.912152|1.757092|1.593701|1.481036|1.493485|1.624680|1.777948|3.454674|2.238508|0.064627|2.482168|2.412240|2.534783|2.779931|2.893239|2.712877|2.450514|0.045820|1.891677|2.920312|2.899307|1.883120|2.403055|12.509804|1.537499|0.300979|0.300461|0.500000| |8.838156|17.554383|16.524391|7.124702|6.782930|4.608347|3.766509|3.821725|4.787240|7.575553|3.261443|2.930281|0.074108|2.714467|2.376535|2.150149|1.934805|1.767691|1.761765|1.918881|2.140227|4.131617|2.771141|0.077531|3.214654|3.259140|3.499093|3.741445|3.682839|3.403722|3.021438|0.055672|2.334777|3.650627|3.536969|2.267850|2.911168|14.624108|1.790023|0.173335|0.212368|0.212140|0.500000| |8.842622|17.548852|16.517666|7.075263|6.764634|4.585668|3.742758|3.796312|4.749689|7.525865|3.234906|2.914726|0.074052|2.592124|2.297282|2.039103|1.850640|1.675206|1.645273|1.772201|1.985614|3.789922|2.526742|0.070807|2.780352|2.817904|2.889349|2.927256|2.888813|2.815730|3.018792|0.055706|2.404178|3.788430|3.842083|2.464501|3.074444|16.318677|1.955296|0.212151|0.212567|0.173388|0.300574|0.500000| |4.683549|7.439944|12.585541|8.941229|17.776259|8.946313|5.667314|4.968422|5.624071|7.599371|3.325757|4.090997|0.096808|3.638160|3.131880|2.693736|2.386947|2.104164|2.047013|2.228842|2.576880|4.927952|3.460328|0.093611|3.955787|4.159436|4.143002|3.933907|3.765847|3.776258|4.024565|0.072097|3.201712|5.206002|4.959021|3.075893|3.907474|18.988348|2.267005|0.115250|0.118058|0.115096|0.226092|0.227179|0.500000| |2.982195|3.905028|7.471434|5.645909|8.934762|17.721733|8.923628|5.637113|4.936752|6.521946|3.131483|6.927105|0.140061|6.090876|5.073955|3.933153|3.335336|2.763922|2.610082|2.863677|3.521269|6.620290|4.954607|0.124000|5.296766|5.760254|4.787859|3.995958|3.833135|4.280310|6.450241|0.107791|5.231903|9.053091|7.357469|4.360252|5.773427|23.819062|2.833791|0.077611|0.076728|0.077778|0.114050|0.113487|0.217544|0.500000| |2.809263|3.322141|7.617682|5.628201|4.965929|5.662155|8.890034|17.745592|8.969753|12.634587|7.513761|7.085748|0.234002|5.029073|3.795881|3.091897|2.546393|2.229211|2.243580|2.583398|3.118408|6.696341|4.860422|0.166090|4.204615|3.457016|2.965921|2.926003|3.338111|4.088444|4.676544|0.081580|3.806715|6.849761|6.458215|3.579114|4.436911|20.930313|2.385634|0.077462|0.068273|0.077789|0.088696|0.088172|0.107825|0.124102|0.500000| |2.949133|3.249483|7.558027|4.761495|3.802070|3.749750|4.570354|6.717920|7.061431|16.435149|17.559892|3.860454|0.117912|3.314282|2.703920|2.389894|2.037432|1.858572|1.916590|2.196903|2.510375|5.346941|3.560735|0.120328|3.375122|2.807580|2.570316|2.702282|3.196713|3.688749|3.336336|0.060769|2.595320|4.229445|4.099886|2.493735|3.160861|15.646834|1.857715|0.082050|0.070391|0.086000|0.085938|0.081958|0.088329|0.086837|0.224236|0.500000| |2.925869|3.221552|7.502875|4.722346|3.775707|3.726280|4.546126|6.698624|7.007561|16.428796|17.556520|3.849534|0.119300|3.109165|2.594476|2.243375|1.941028|1.752820|1.770846|1.987395|2.275197|4.679034|3.092560|0.099659|2.881354|2.504315|2.288324|2.333222|2.628628|2.969921|3.339492|0.060922|2.698664|4.464943|4.620145|2.771483|3.381165|17.827260|2.047894|0.084668|0.069842|0.082092|0.081929|0.084457|0.087734|0.086271|0.226178|0.298442|0.500000| |3.217657|3.353695|7.805924|4.415514|3.416486|3.186927|3.609632|4.905659|5.898302|17.016298|17.667684|3.048196|0.090413|2.627444|2.229885|1.990887|1.743379|1.602439|1.637036|1.833878|2.054179|4.208523|2.728365|0.086919|2.665561|2.333009|2.201991|2.319662|2.646183|2.880779|2.837746|0.052445|2.232530|3.573935|3.613747|2.247697|2.806627|14.687071|1.740648|0.093495|0.075562|0.094340|0.085033|0.084380|0.082114|0.075084|0.146622|0.299978|0.300136|0.500000| |1.594327|1.821882|3.379886|2.173133|2.467797|2.962738|3.002270|2.508512|2.187715|3.409453|1.856459|3.652332|0.091303|4.663664|6.806458|8.858401|17.702972|8.978663|5.663249|4.942452|5.629771|7.492888|3.941525|0.091472|3.536222|3.866625|3.185850|2.638496|2.524675|2.827687|9.623156|0.241851|4.842321|5.294374|4.293325|3.254326|5.560409|18.408117|2.677501|0.042499|0.042589|0.043339|0.052817|0.051309|0.066053|0.093145|0.067772|0.053850|0.052265|0.046720|0.500000| |1.399225|1.565322|2.879379|1.804392|1.991273|2.279191|2.309045|2.027919|1.818519|2.910938|1.602025|2.658659|0.069244|3.288411|4.084226|5.637315|8.936669|17.741653|8.890419|5.632721|4.954687|6.522248|3.173384|0.076137|2.980249|3.207217|2.817542|2.421618|2.318253|2.523282|5.211913|0.118149|3.035023|3.631802|3.101145|2.309064|3.675629|13.870496|2.016468|0.037202|0.037631|0.038487|0.045642|0.043532|0.053846|0.069096|0.055465|0.046847|0.044581|0.040961|0.216864|0.500000| |1.396721|1.548448|2.870773|1.786662|1.927272|2.168375|2.235683|2.021375|1.823882|2.959123|1.646996|2.522720|0.067225|3.148831|3.589182|4.954985|5.659205|8.912292|17.729966|8.956766|5.671696|7.563897|3.371234|0.082191|3.199279|3.269095|2.911393|2.608798|2.571635|2.811083|4.222197|0.089164|2.561875|3.246424|2.782520|2.001865|3.062320|12.129479|1.707777|0.036987|0.037404|0.038972|0.045380|0.042318|0.051654|0.063716|0.055949|0.049008|0.045250|0.042294|0.124564|0.214613|0.500000| |1.590735|1.774639|3.360980|2.118611|2.252180|2.552971|2.718938|2.490132|2.212230|3.579833|2.011480|3.073403|0.083057|3.999868|4.192753|5.643040|4.945833|5.617013|8.862213|17.749708|8.974202|13.176134|4.908525|0.119355|4.482519|4.112463|3.493966|3.232429|3.400971|3.968659|4.501754|0.089247|2.772931|3.686050|3.095978|2.141849|3.203083|12.762536|1.732708|0.041963|0.042037|0.044875|0.052158|0.047721|0.058988|0.072934|0.069732|0.061417|0.054609|0.051119|0.107391|0.123619|0.213938|0.500000| |2.252548|2.706168|5.016983|3.358690|4.099391|5.113921|4.660032|3.637560|3.214024|4.740695|2.445247|4.905235|0.110481|6.763347|6.616058|6.532089|5.272327|4.333075|4.153528|4.690303|5.983040|10.038741|6.845406|0.140437|8.885142|17.737435|8.963406|5.655998|4.957511|5.649832|6.748272|0.118976|4.248467|5.929212|4.612895|3.068466|4.573493|17.314572|2.269383|0.057964|0.059532|0.061583|0.082528|0.074355|0.109654|0.169531|0.091027|0.071731|0.066015|0.060408|0.133181|0.101940|0.096549|0.113238|0.500000| |2.410473|2.859293|4.986244|3.129119|3.733002|3.962506|3.408602|2.922776|2.825494|4.319923|2.182637|3.223012|0.077421|3.744750|3.582130|3.656133|3.357777|3.116485|3.112023|3.350284|3.664354|6.422286|4.062788|0.096747|5.635775|8.930533|17.718720|8.913296|5.650936|4.964329|4.176844|0.078101|2.836009|4.015963|3.438765|2.325193|3.324792|14.015615|1.850596|0.060275|0.065392|0.066404|0.091859|0.077368|0.108838|0.123301|0.072687|0.063208|0.057591|0.055430|0.088125|0.078581|0.078337|0.087730|0.216863|0.500000| |2.696114|3.094517|5.376026|3.204237|3.501066|3.401284|3.052793|2.843706|2.900076|4.611722|2.319064|2.759475|0.069288|3.044430|2.770486|2.796360|2.525110|2.421066|2.538048|2.818212|2.990236|5.641790|3.539021|0.091437|4.931684|5.642928|8.910387|17.722206|8.912391|5.647821|3.251781|0.061022|2.275002|3.318366|2.938316|1.957070|2.717881|12.103278|1.575066|0.065782|0.072880|0.077572|0.102698|0.079101|0.100519|0.095568|0.071363|0.067892|0.059278|0.059940|0.065548|0.061466|0.065971|0.078623|0.124411|0.214795|0.500000| |2.788720|3.143740|5.920722|3.555345|3.554821|3.460513|3.370863|3.366929|3.455760|5.657693|2.903110|3.002478|0.078175|3.256843|2.808991|2.786966|2.415317|2.308353|2.492106|2.908941|3.134325|6.456234|4.111508|0.115299|5.631699|4.956364|5.649371|8.910575|17.724433|8.926006|3.227620|0.059909|2.280282|3.416825|3.027634|1.970244|2.700276|12.135864|1.551556|0.069012|0.072166|0.083567|0.099974|0.077391|0.094272|0.090543|0.086431|0.088837|0.071686|0.074752|0.061628|0.057679|0.064593|0.084379|0.107610|0.124137|0.214607|0.500000| |2.545691|2.935460|5.954787|3.891422|3.855595|4.140844|4.557313|4.617061|4.241477|6.703144|3.622235|4.216509|0.112731|4.728912|3.740430|3.602399|2.907064|2.697163|2.947226|3.676247|4.269984|10.230354|7.120680|0.230344|8.910011|5.653402|4.963228|5.654864|8.942518|17.704345|4.063167|0.073499|2.846600|4.379152|3.736266|2.363173|3.252304|14.083462|1.773679|0.065456|0.064363|0.074335|0.088012|0.074188|0.094544|0.104643|0.123642|0.118761|0.090217|0.088427|0.072448|0.065350|0.073905|0.106775|0.124022|0.107700|0.124310|0.216166|0.500000| |2.499715|3.011994|6.095593|4.296128|4.793816|6.054337|6.835872|5.617223|4.559432|6.530151|3.393902|6.789684|0.171183|4.566118|4.051607|3.089271|2.704136|2.269492|2.132819|2.301437|2.760501|5.212392|3.546637|0.098746|3.193360|3.073407|2.659428|2.429913|2.487233|2.815095|6.102512|0.105078|6.270347|12.686040|25.927154|9.096990|8.327382|45.694228|4.190560|0.069901|0.063560|0.064960|0.079627|0.089281|0.114062|0.157294|0.141982|0.089551|0.104472|0.080569|0.077456|0.057915|0.052890|0.059290|0.089692|0.069730|0.060859|0.062981|0.076440|0.500000| |1.543681|1.731449|3.252314|2.052738|2.228718|2.549119|2.654619|2.373003|2.107731|3.379241|1.867856|3.035795|0.082760|2.771098|2.990639|2.567662|2.535626|2.177794|1.951028|1.960929|2.210967|3.816473|2.273989|0.060929|2.046399|2.058594|1.835240|1.663762|1.656561|1.815342|5.160735|0.108862|4.566868|5.311625|6.110524|6.480596|9.057620|56.079579|17.668599|0.043085|0.040998|0.040827|0.047175|0.050758|0.059034|0.074517|0.065601|0.051126|0.055926|0.047453|0.077853|0.058552|0.049325|0.049781|0.062433|0.050249|0.042867|0.042587|0.049260|0.107522|0.500000| |1.644479|1.862415|3.438372|2.168663|2.416208|2.754557|2.740538|2.394912|2.161073|3.420002|1.845959|3.032718|0.079231|2.783503|3.003998|2.574598|2.567122|2.192150|1.946244|1.945655|2.195294|3.765343|2.279774|0.060204|2.110023|2.179171|1.961607|1.757783|1.720313|1.861557|5.176035|0.107489|4.601214|5.394019|6.154360|6.505698|9.012377|56.039357|17.665828|0.045680|0.043997|0.043059|0.050925|0.055427|0.065292|0.082866|0.064324|0.050238|0.054568|0.046919|0.080128|0.059226|0.049160|0.049221|0.066819|0.054478|0.045466|0.043999|0.049754|0.111797|0.298111|0.500000| |1.557291|1.734903|3.219631|1.999835|2.161261|2.397559|2.430895|2.209639|2.019338|3.266047|1.786141|2.636288|0.071308|2.377426|2.490463|2.166808|2.136579|1.869369|1.695871|1.707565|1.904894|3.323681|2.001230|0.054007|1.850194|1.874989|1.706435|1.560631|1.545716|1.667620|4.088122|0.084012|3.572089|4.471649|5.309178|5.206011|6.453336|57.796063|17.627267|0.043802|0.041597|0.040816|0.046843|0.051524|0.058092|0.069651|0.060313|0.048182|0.053402|0.045820|0.064877|0.050545|0.043311|0.043833|0.056214|0.047060|0.040618|0.040019|0.045184|0.100414|0.299284|0.299237|0.500000| 1913.825180 -12574.347697 4921.207086 -231.428742 -5970.744173 4055.048827 -1915.695346 2.000977 40DCB00000000009 455D55A1AEE7FCAB 44DC8DC1652400A6 4251F1A224000004 33A011C2D10134D9 449DF38F899AA740