Version2.1 2021-01-14T20:29:46Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 24-Dec-2020 #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)N1CCNC1=O)Sc2nnc(n2c3ccccc3)c4ccc(cc4)C(C)(C)C C21602986 RHF 6-31G(d) (6D,7F) C[C@@H](C(=O)N1CCNC1=O)Sc2nnc(n2c3ccccc3)c4ccc(cc4)C(C)(C)C C01[X(C24H27N5O2S1)] 171 C1 538 C[C@@H](C(=O)N1CCNC1=O)Sc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C C[C@@H](C(=O)N1CCNC1=O)Sc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C C[C@H](Sc1nnc(n1c2ccccc2)c3ccc(cc3)C(C)(C)C)C(=O)N4CCNC4=O InChIKey=OVTFFOXHPJXXPZ-INIZCTEOSA-N InChI=1S/C24H27N5O2S/c1-16(21(30)28-15-14-25-22(28)31)32-23-27-26-20(29(23)19-8-6-5-7-9-19)17-10-12-18(13-11-17)24(2,3)4/h5-13,16H,14-15H2,1-4H3,(H,25,31)/t16-/m0/s1 InChI=1/C24H27N5O2S/c1-16(21(30)28-15-14-25-22(28)31)32-23-27-26-20(29(23)19-8-6-5-7-9-19)17-10-12-18(13-11-17)24(2,3)4/h5-13,16H,14-15H2,1-4H3,(H,25,31)/t16-/m0/s1/f/h25H C[C@@H](C(=O)N1CCNC1=O)Sc2nnc(n2c3ccccc3)c4ccc(cc4)C(C)(C)C C01[X(C24H27N5O2S1)] 171 C01 538 C[C@@H](C(=O)N1CCNC1=O)Sc1nnc(n1c1ccccc1)c1ccc(cc1)C(C)(C)C C[C@@H](C(=O)N1CCNC1=O)S[C]1[N][N][C]([N@@]1[C]1[CH][CH][CH][CH][CH]1)[C]1[CH][CH][C]([CH][CH]1)C(C)(C)C C[C@H](S[C]1[N][N][C]([C]2[CH][CH][C]([CH][CH]2)C(C)(C)C)N1[C]3[CH][CH][CH][CH][CH]3)C(=O)N4CCNC4=O InChIKey=OVTFFOXHPJXXPZ-INIZCTEOSA-N InChI=1S/C24H27N5O2S/c1-16(21(30)28-15-14-25-22(28)31)32-23-27-26-20(29(23)19-8-6-5-7-9-19)17-10-12-18(13-11-17)24(2,3)4/h5-13,16H,14-15H2,1-4H3,(H,25,31)/t16-/m0/s1 InChI=1/C24H27N5O2S/c1-16(21(30)28-15-14-25-22(28)31)32-23-27-26-20(29(23)19-8-6-5-7-9-19)17-10-12-18(13-11-17)24(2,3)4/h5-13,16H,14-15H2,1-4H3,(H,25,31)/t16-/m0/s1/f/h25H 3248.3128827990 -1744.0768879 1-A 22833.3794 119 419 538 |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|A|A|A|A|A|A|A|A|A|A| -91.95305 -20.55173 -20.53940 -15.63092 -15.61934 -15.59889 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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 55 56 57 58 59 6 6 1 6 8 7 6 6 7 6 8 16 6 7 7 6 7 6 6 6 6 6 6 6 6 6 6 6 6 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 1 1 1 1 12.00000 12.00000 1.00783 12.00000 15.99491 14.00307 12.00000 12.00000 14.00307 12.00000 15.99491 31.97207 12.00000 14.00307 14.00307 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 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 1.00783 1.00783 1.00783 1.00783
6388.7973 35424.5030 39610.4623 0.99999 -0.00421 -0.00008 0.00421 0.99998 -0.00547 0.00010 0.00547 0.99999 1 0.01356 0.00245 0.00219 0.28249 0.05095 0.04556 17.50 26.72 33.33 48.16 52.24 62.20 75.70 86.73 97.80 111.96 144.99 165.89 170.34 189.03 220.61 251.28 272.13 288.60 319.10 340.81 342.92 369.88 375.65 391.26 421.36 422.32 436.98 491.58 501.62 513.98 530.08 551.83 588.66 602.29 623.17 647.19 659.39 663.94 678.00 716.09 721.96 776.95 784.32 797.90 878.96 914.35 968.39 973.61 984.39 1012.79 1040.07 1093.57 1112.86 1114.64 1126.07 1138.60 1154.10 1163.60 1190.28 1207.60 1216.37 1242.15 1254.14 1314.72 1368.22 1372.49 1381.66 1401.71 1456.01 1468.18 1474.33 1510.21 1512.54 1544.10 1549.92 1571.38 1574.68 1588.88 1590.22 1595.70 1602.90 1606.44 1626.15 1640.42 1642.60 1660.09 1679.91 1694.43 1698.88 1702.50 1735.09 1747.55 1751.12 1772.37 1786.44 1812.16 1843.41 1848.08 1863.23 1910.86 1918.63 1929.63 1942.28 1966.09 1973.21 2003.10 2021.21 2038.34 2038.45 2067.92 2100.94 2112.75 2129.00 2159.15 2209.66 2214.26 2236.83 2237.32 2243.50 2257.85 2267.31 2282.12 2305.86 2329.37 2346.91 2351.41 2351.78 2357.59 2372.82 2375.73 2384.83 2400.07 2402.61 2414.05 2425.16 2429.54 2431.03 2498.52 2554.57 2575.13 2602.37 2630.18 2818.18 2890.93 4606.39 4607.08 4621.77 4626.12 4645.65 4689.18 4692.19 4693.73 4707.50 4709.53 4717.09 4722.20 4734.56 4747.79 4786.66 4805.56 4842.28 4858.63 4858.69 4865.60 4871.77 4878.68 4884.51 4891.54 4897.32 4909.54 5592.91 0.518301 0.546593 0.547537 0.455090 -1743.558587 -1743.530295 -1743.529351 -1743.621798 3.100688D-04
MUNgauss RevisionA2.0 retrievium 14-Jan-2021 DUDE C[C@@H](C(=O)N1CCNC1=O)Sc2nnc(n2c3ccccc3)c4ccc(cc4)C(C)(C)C C21602986 RHF 6-31G(d) (6D,10F) C1 449.188547 |X|Y|Z| 137.790466 55.074014 28.530807
60.047277 25 6 7 16 19 5 1
|36.858105| |12.422444|36.858105| |8.872699|17.731568|0.500000| |7.620393|12.534293|0.245024|36.858105| |5.962412|8.014592|0.165342|15.928667|73.516695| |5.762067|7.597887|0.198025|13.799101|15.262171|53.358707| |4.165341|4.947535|0.128797|7.773861|12.651612|17.747859|36.858105| |3.456474|3.957048|0.110996|5.221170|8.203593|11.114966|12.426593|36.858105| |3.927345|4.393516|0.129452|5.357277|7.722295|11.764906|8.258748|13.171914|53.358707| |5.312137|6.295861|0.192325|7.598957|9.556572|18.592448|8.086330|8.149883|19.086571|36.858105| |5.855557|6.595729|0.227797|6.369264|8.137849|11.181789|5.426640|5.474741|11.377654|15.973494|73.516695| |6.790087|10.372458|0.220634|7.123072|11.943031|6.601049|3.779942|3.087851|4.366821|4.060658|7.346323|388.023441| |5.618385|6.970214|0.195618|4.726237|7.545622|5.118169|2.994473|2.624428|3.838477|3.504371|6.798352|76.942366|36.858105| |5.655737|6.495787|0.210197|4.353303|6.636123|5.019761|2.898317|2.625222|3.976528|3.664146|7.537246|49.542970|14.878264|53.358707| |4.127980|4.437745|0.137646|3.325211|5.279457|3.987770|2.409289|2.232287|3.343937|2.948940|5.973209|35.086261|8.927721|19.020784|53.358707| |3.649102|3.968875|0.116328|3.094438|5.101458|3.653955|2.260034|2.071055|3.024655|2.621298|5.120978|35.103054|8.837785|12.080228|20.222585|36.858105| |4.105039|4.691051|0.130517|3.611760|6.077774|4.077468|2.507557|2.234491|3.210088|2.811962|5.359910|49.426101|13.941383|11.906585|11.920041|13.834698|53.358707| |3.492494|3.927237|0.104442|3.262881|5.789404|3.679858|2.341829|2.068324|2.897665|2.480166|4.584969|42.696644|7.627969|7.301431|7.276468|7.512143|18.158187|36.858105| |3.102158|3.625670|0.096793|3.196313|5.812893|3.642749|2.368337|2.089027|2.867038|2.419381|4.374059|38.899612|5.863468|5.927954|5.750502|5.384225|10.656475|13.750882|36.858105| |2.658121|3.006881|0.079265|2.770499|5.183650|3.209432|2.149432|1.899409|2.569437|2.124750|3.790178|30.041178|4.201206|4.545564|4.455733|3.995393|7.007545|7.955437|13.751507|36.858105| |2.520832|2.731930|0.071331|2.508987|4.706874|2.919234|1.965686|1.741060|2.365321|1.946502|3.486732|26.309068|3.718261|4.130499|4.113907|3.677746|6.185059|6.891478|7.935663|13.752406|36.858105| |2.717786|2.854980|0.074261|2.541273|4.694607|2.938917|1.950789|1.729408|2.383080|1.978329|3.592035|27.399776|4.069740|4.523957|4.579892|4.185299|7.010085|7.959265|6.869495|7.937339|13.744138|36.858105| |3.202170|3.371195|0.088122|2.860231|5.151983|3.262658|2.111220|1.869589|2.615678|2.210475|4.078712|33.661449|5.523606|5.880840|6.021685|5.870432|10.657555|13.750604|7.916789|6.867419|7.934671|13.763033|36.858105| |2.869000|3.036144|0.088014|2.500464|4.204685|3.028277|1.927314|1.790973|2.591821|2.186661|4.221248|25.850593|5.290811|7.253214|10.644280|12.896640|10.173938|6.020400|4.662801|3.739353|3.569145|4.081504|5.371669|36.858105| |2.645459|2.695818|0.078386|2.240593|3.750912|2.761737|1.768393|1.662496|2.425567|2.028028|3.948896|21.644398|4.181591|6.123728|8.826363|7.722938|7.003620|4.327329|3.504972|2.978619|2.937787|3.375158|4.202206|13.671875|36.858105| |2.223450|2.259545|0.065236|1.933542|3.272987|2.413158|1.571908|1.488740|2.155109|1.772734|3.413925|17.946168|3.244681|4.631304|6.047792|5.089917|5.290025|3.541980|3.021616|2.683533|2.690181|3.039032|3.554158|7.911807|13.821988|36.858105| |2.027151|2.093769|0.060045|1.825263|3.126322|2.279758|1.501475|1.421063|2.033340|1.659407|3.153280|16.924624|2.969243|4.082597|5.087740|4.429404|4.922943|3.495254|3.099886|2.821498|2.831566|3.124304|3.509666|6.743605|7.853315|13.629985|36.858105| |2.127700|2.247407|0.064236|1.961647|3.380685|2.427341|1.597539|1.501021|2.131855|1.746343|3.294006|18.775490|3.312233|4.391616|5.410226|5.031953|5.757760|4.245497|3.830491|3.449569|3.389519|3.668169|4.126919|7.903040|6.917524|8.022027|13.718781|36.858105| |2.491169|2.679396|0.076787|2.287886|3.921266|2.786423|1.807142|1.681308|2.394762|1.990857|3.770222|23.199906|4.341805|5.611297|7.148454|7.562758|8.255333|5.885365|5.022599|4.171664|3.941968|4.321995|5.276006|13.755540|7.989927|6.925687|7.857643|13.724846|36.858105| |1.746686|1.791331|0.051173|1.590980|2.740451|2.008914|1.339690|1.276549|1.818515|1.466002|2.768168|14.218565|2.395624|3.293631|3.931196|3.263491|3.820087|2.770619|2.541037|2.393961|2.430948|2.630216|2.825090|4.367207|4.980267|7.492448|12.389798|7.401456|4.944993|36.858105| |1.654901|1.695714|0.048956|1.511790|2.584668|1.932737|1.290668|1.242946|1.779371|1.426549|2.705738|13.144065|2.204746|3.101822|3.693904|2.935400|3.409492|2.407030|2.232657|2.085567|2.081480|2.221278|2.398640|3.750638|4.380877|6.219500|7.575591|5.273584|4.002957|12.360718|36.858105| |1.618236|1.677168|0.047674|1.511496|2.626921|1.911307|1.286486|1.225387|1.729171|1.385132|2.588889|13.424399|2.206577|2.973545|3.448113|2.879175|3.513864|2.633477|2.503899|2.423332|2.458458|2.581145|2.675112|3.685649|3.826559|4.938512|7.459031|6.586407|4.452593|12.400358|7.653742|36.858105| |1.687585|1.700709|0.048096|1.514234|2.619985|1.909178|1.277356|1.213909|1.728687|1.390990|2.622378|13.415645|2.225117|3.049842|3.574112|2.930012|3.502236|2.568315|2.326069|2.226452|2.323669|2.565324|2.718134|3.753231|4.381365|6.216883|7.575996|5.271909|4.002978|12.360625|7.569823|7.654188|36.858105| |17.579435|8.783286|0.173613|6.988776|11.191621|7.023820|4.021478|3.246828|4.799914|4.491797|8.202588|45.092785|4.890681|6.267630|4.861219|3.310143|5.173127|3.412719|3.048953|2.679266|2.585843|2.796911|3.230944|2.671896|2.465584|2.101540|1.934682|2.033936|2.360929|1.679602|1.579724|1.566025|1.637690|0.500000| |17.584860|8.830396|0.214020|6.885261|9.359277|8.311248|4.387784|3.759885|6.123889|6.200411|12.669114|36.014511|4.448839|6.431783|4.935371|3.162070|4.650267|2.940197|2.666671|2.322770|2.207195|2.355459|2.719186|2.560833|2.410016|2.054326|1.872007|1.944378|2.239684|1.631660|1.563708|1.511997|1.578599|0.298943|0.500000| |17.627201|8.861340|0.214488|5.545238|8.205490|6.102755|3.410902|2.956840|4.577438|4.368377|8.955600|45.264225|6.328688|9.316720|6.706210|4.210522|6.251171|3.746659|3.190831|2.701355|2.590682|2.863487|3.472565|3.241101|3.021722|2.487027|2.223890|2.313472|2.727754|1.895196|1.791602|1.732602|1.835848|0.299799|0.302391|0.500000| |4.107896|4.510361|0.113452|6.756716|11.999974|12.369661|17.597847|8.728399|9.040462|6.444046|8.374435|24.931167|2.781828|3.655030|3.067529|2.125530|3.205479|2.223357|2.227903|2.048597|1.903037|1.900423|2.042350|1.826571|1.688870|1.507144|1.437812|1.522068|1.711694|1.288343|1.238737|1.236401|1.237694|0.115120|0.121798|0.092776|0.500000| |3.745693|4.593632|0.118624|7.100564|13.248891|12.357374|17.673897|8.681558|8.105863|5.979703|7.898217|27.233540|2.973254|3.820040|3.203675|2.247850|3.439919|2.404341|2.487413|2.275480|2.057876|2.010381|2.153211|1.925481|1.749541|1.560876|1.504621|1.614492|1.828298|1.343176|1.288927|1.299060|1.276891|0.102255|0.104707|0.087098|0.301771|0.500000| |3.049863|3.335442|0.092265|4.240397|6.984960|8.055532|8.721813|17.617766|12.353436|5.966247|7.884793|19.081197|2.309856|3.145299|2.719413|1.865013|2.721584|1.870131|1.885894|1.737104|1.608532|1.599026|1.713502|1.633331|1.528521|1.379460|1.318880|1.386282|1.539178|1.193216|1.163590|1.147363|1.140189|0.081330|0.092650|0.073373|0.222128|0.188247|0.500000| |3.092508|3.632957|0.104155|4.622856|7.420371|8.946768|8.746817|17.540611|12.316370|6.541435|8.548827|21.106771|2.558141|3.472136|2.985003|2.046899|2.999417|2.047197|2.097430|1.908204|1.732263|1.704056|1.835255|1.780109|1.644638|1.478378|1.420099|1.506774|1.685749|1.277428|1.246490|1.232139|1.207735|0.080433|0.090969|0.075185|0.174870|0.221704|0.300612|0.500000| |3.464365|3.787969|0.114714|4.299799|6.354503|8.313503|5.825737|8.840412|26.056860|9.437064|13.344434|20.355209|2.613659|3.753754|3.217639|2.124941|3.015187|1.992174|1.967145|1.765600|1.629363|1.643985|1.803455|1.839218|1.736369|1.550129|1.460375|1.522503|1.699217|1.311441|1.292566|1.245262|1.244866|0.086047|0.110135|0.085258|0.138395|0.129009|0.203752|0.208730|0.500000| |3.118452|3.801653|0.104104|3.389230|6.078697|3.899782|2.525179|2.238250|3.063183|2.589230|4.663095|40.045010|5.960078|6.137898|5.826165|5.207390|9.811644|8.934937|17.731430|8.886270|5.638289|4.951351|5.643820|4.398673|3.333975|2.874372|2.938720|3.604824|4.690106|2.425674|2.177956|2.395123|2.189460|0.083423|0.075230|0.087803|0.064841|0.074311|0.055578|0.063193|0.058396|0.500000| |2.426834|2.767263|0.073426|2.629892|4.964269|3.096127|2.110535|1.873783|2.503787|2.044775|3.607897|26.552471|3.598598|4.014562|3.912661|3.389418|5.682127|5.656835|8.932599|17.726014|8.908759|5.643845|4.949790|3.207193|2.618243|2.400972|2.545434|3.081023|3.597702|2.208061|1.949189|2.272096|2.045403|0.067898|0.059776|0.067522|0.055688|0.062820|0.047717|0.052769|0.047847|0.214511|0.500000| |2.247117|2.409535|0.062988|2.261852|4.276388|2.668877|1.826049|1.625123|2.192299|1.782559|3.172778|22.260647|3.083949|3.530038|3.516707|3.054704|4.922763|4.961896|5.645670|8.917548|17.721341|8.914793|5.645814|3.019557|2.568876|2.409150|2.558404|3.005570|3.341981|2.260194|1.943160|2.324240|2.183970|0.064465|0.055394|0.063628|0.049399|0.053256|0.042022|0.044977|0.042043|0.123983|0.214785|0.500000| |2.508683|2.564268|0.066678|2.304769|4.261001|2.696271|1.805271|1.608635|2.217953|1.826874|3.317537|23.462241|3.453382|3.987685|4.063858|3.599127|5.683652|5.658479|4.950843|5.644603|8.907781|17.725842|8.936920|3.607752|3.137195|2.897082|2.972286|3.369157|3.771582|2.565532|2.157441|2.516908|2.576896|0.072450|0.061070|0.073593|0.049303|0.051403|0.041640|0.043862|0.042632|0.107508|0.124068|0.214795|0.500000| |3.306996|3.329951|0.087321|2.773381|4.919885|3.185545|2.049192|1.825262|2.583428|2.188211|4.088377|31.398082|5.372458|6.047780|6.355808|6.062610|9.814558|8.936380|5.644405|4.950614|5.637887|8.890214|17.735606|5.618369|4.651377|3.850965|3.640987|4.070569|5.066997|2.913755|2.472574|2.677219|2.871720|0.092623|0.078032|0.102827|0.055441|0.057278|0.046641|0.049405|0.049663|0.124372|0.107496|0.123989|0.214581|0.500000| |2.839689|2.822171|0.082608|2.312057|3.825191|2.859926|1.816043|1.711732|2.526839|2.124660|4.195760|21.880861|4.248621|6.593944|9.690492|7.200328|6.629400|3.949948|3.193270|2.717146|2.684957|3.091340|3.852640|8.927671|17.745600|8.941029|5.611768|4.977345|5.674812|4.076541|3.791356|3.207651|3.788332|0.072701|0.072281|0.092142|0.048312|0.049411|0.043729|0.046716|0.050366|0.085119|0.066739|0.065636|0.080685|0.121503|0.500000| |2.092869|2.094052|0.060455|1.803994|3.049034|2.271814|1.486093|1.416029|2.056682|1.681656|3.245923|16.227382|2.863912|4.149392|5.260886|4.163001|4.481569|3.008082|2.600731|2.345184|2.368585|2.664841|3.056098|5.657142|9.030004|17.732034|8.871617|5.673083|4.980929|6.969705|6.542848|4.502484|6.534607|0.055037|0.054329|0.065041|0.039748|0.040794|0.036626|0.038959|0.041279|0.069116|0.058919|0.059773|0.071856|0.092844|0.218235|0.500000| |1.956859|2.079593|0.059129|1.847843|3.213842|2.295930|1.527277|1.436694|2.022922|1.643644|3.070198|17.393623|2.953788|3.856351|4.554226|4.115244|5.024296|3.871456|3.695883|3.469821|3.406109|3.542825|3.775710|5.664362|4.979867|5.668139|8.888040|17.767791|9.019124|6.807875|4.896081|7.598981|4.887696|0.052344|0.049870|0.058291|0.040433|0.043143|0.036962|0.040236|0.040127|0.097031|0.088026|0.085660|0.090805|0.100340|0.108019|0.124001|0.500000| |2.518159|2.777416|0.079050|2.398989|4.153334|2.900697|1.888154|1.744874|2.459998|2.044764|3.826931|24.899663|4.531702|5.552005|6.605730|6.907266|8.824796|6.929572|6.447045|5.174108|4.599477|4.767319|5.687471|8.902137|5.658475|4.982239|5.632552|8.969409|17.748348|4.055816|3.381913|3.927962|3.377543|0.066631|0.062519|0.075245|0.049444|0.053621|0.044218|0.048859|0.048227|0.167185|0.122652|0.105797|0.110565|0.139274|0.124307|0.108045|0.220212|0.500000| |1.665711|1.726334|0.050199|1.541998|2.628826|1.978712|1.320938|1.276774|1.827413|1.463672|2.776299|13.370088|2.248021|3.172623|3.783223|2.992920|3.467337|2.429313|2.285045|2.118124|2.077165|2.184540|2.365958|3.795128|4.262153|5.649672|6.903225|5.353624|4.125407|8.743523|17.553812|6.918332|5.488090|0.043941|0.043782|0.049868|0.035042|0.036712|0.033119|0.035734|0.036950|0.062815|0.055380|0.053717|0.058186|0.066796|0.102086|0.154361|0.140799|0.098120|0.500000| |1.514588|1.547011|0.044487|1.392595|2.390466|1.788157|1.202536|1.161059|1.656504|1.319422|2.490879|11.921428|1.962049|2.746018|3.200269|2.520345|2.997736|2.141809|2.009444|1.904620|1.911811|2.025247|2.150269|3.106174|3.531401|4.678391|5.498171|4.220141|3.316691|8.771662|17.537476|7.067773|6.910428|0.040362|0.039935|0.045268|0.032148|0.033382|0.030318|0.032357|0.033470|0.054462|0.049869|0.050165|0.055150|0.061377|0.087534|0.138917|0.114298|0.080471|0.301061|0.500000| |1.707120|1.732966|0.050209|1.535114|2.609295|1.966459|1.307568|1.261816|1.818329|1.460803|2.789707|13.270184|2.242885|3.209391|3.859521|2.999733|3.427517|2.372618|2.169393|2.007023|2.004756|2.162538|2.367214|3.795306|4.708459|6.804071|6.847646|4.708665|3.811331|8.693702|17.574610|5.513383|6.869104|0.045080|0.044964|0.051707|0.034903|0.036077|0.032820|0.035029|0.036772|0.058837|0.051865|0.051771|0.058468|0.068831|0.117100|0.228435|0.116157|0.088659|0.301980|0.302101|0.500000| |1.641693|1.702222|0.047975|1.537328|2.691051|1.931014|1.302122|1.232316|1.730943|1.388414|2.582719|13.814749|2.251824|2.981604|3.419772|2.906598|3.629203|2.800746|2.671526|2.637530|2.726540|2.864360|2.903429|3.693958|3.704539|4.577324|6.726502|6.691155|4.586921|8.711999|5.510283|17.554724|6.943312|0.044437|0.042369|0.048720|0.034837|0.036644|0.032059|0.034377|0.034474|0.069792|0.068369|0.072049|0.078184|0.080005|0.086182|0.113560|0.231034|0.115123|0.140616|0.142947|0.122300|0.500000| |1.487751|1.533611|0.043538|1.392639|2.423875|1.771456|1.199173|1.146726|1.616169|1.286887|2.400158|12.131031|1.964186|2.658102|3.040004|2.486462|3.068608|2.295817|2.197359|2.147565|2.188350|2.285818|2.343095|3.072024|3.230412|4.071654|5.465457|4.798622|3.555742|8.830923|7.051668|17.555695|7.055486|0.040103|0.038849|0.044080|0.032099|0.033603|0.029946|0.032025|0.032407|0.058645|0.056480|0.058221|0.062631|0.065403|0.077797|0.108816|0.148181|0.089206|0.171670|0.215785|0.143261|0.302345|0.500000| |1.620157|1.698364|0.048556|1.535237|2.663629|1.947612|1.311712|1.253139|1.765769|1.412608|2.637095|13.602455|2.236394|3.014520|3.490876|2.909309|3.555181|2.651297|2.571196|2.472650|2.450692|2.520313|2.620709|3.690765|3.703297|4.577009|6.723376|6.688043|4.584202|8.712756|6.946952|17.556171|5.510763|0.043361|0.042100|0.047952|0.034853|0.036894|0.032521|0.035171|0.035371|0.069429|0.065095|0.064180|0.067128|0.071673|0.086197|0.113590|0.231550|0.115212|0.206610|0.174410|0.140623|0.300786|0.302384|0.500000| |1.744297|1.738609|0.049262|1.537870|2.646930|1.941098|1.293424|1.230697|1.762961|1.421728|2.696292|13.559547|2.265236|3.150654|3.720236|2.994261|3.525097|2.531883|2.257661|2.135810|2.225820|2.487541|2.683723|3.798760|4.710096|6.802417|6.849520|4.708249|3.811990|8.694101|6.868354|5.513561|17.573455|0.046889|0.045441|0.053136|0.034874|0.035728|0.032123|0.033887|0.035316|0.059145|0.054277|0.057788|0.069539|0.080425|0.117003|0.228027|0.116022|0.088566|0.140144|0.170107|0.204342|0.140588|0.143292|0.122310|0.500000| |1.539887|1.550856|0.043830|1.394527|2.418686|1.769201|1.191600|1.136974|1.614852|1.290773|2.424563|12.125610|1.976552|2.709304|3.120448|2.516884|3.061015|2.254610|2.077591|2.011541|2.097020|2.279667|2.374811|3.107650|3.531811|4.677587|5.498162|4.218901|3.316531|8.770887|6.911286|7.066016|17.537949|0.041623|0.040260|0.046201|0.032124|0.033107|0.029772|0.031462|0.032375|0.054696|0.051960|0.055476|0.063964|0.069025|0.087491|0.138835|0.114142|0.080388|0.140886|0.207474|0.170180|0.174223|0.215853|0.142960|0.302116|0.500000| |1.723989|1.735199|0.048635|1.546296|2.693386|1.935749|1.296627|1.224125|1.736128|1.399511|2.626912|13.871212|2.285145|3.078496|3.569787|2.982529|3.639707|2.737489|2.465945|2.393504|2.552319|2.856975|2.979272|3.798796|4.261555|5.644045|6.901509|5.349623|4.124631|8.742644|5.487756|6.920442|17.550807|0.046827|0.044511|0.052042|0.034987|0.036097|0.031944|0.033774|0.034574|0.063427|0.060601|0.066844|0.080986|0.087688|0.101924|0.154058|0.140348|0.097870|0.122491|0.140886|0.140129|0.206561|0.171848|0.140619|0.301886|0.301094|0.500000|
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