Version2.1 2021-01-09T22:29:52Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 18-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOC[C@@H](C[NH+](Cc1c(nn(c1Oc2ccc(cc2)Cl)c3ccccc3)C)C4CC4)O C36303777 RHF 6-31G(d) (6D,7F) CCOC[C@@H](C[NH+](Cc1c(nn(c1Oc2ccc(cc2)Cl)c3ccccc3)C)C4CC4)O C01[X(C25H31Cl1N3O3)] 183 C1 546 CCOC[C@@H](C[NH+](C1CC1)Cc1c(C)nn(c1Oc1ccc(cc1)Cl)c1ccccc1)O CCOC[C@@H](C[NH+](C1CC1)Cc1c(C)nn(c1Oc1ccc(cc1)Cl)c1ccccc1)O CCOC[C@H](O)C[NH+](Cc1c(C)nn(c2ccccc2)c1Oc3ccc(Cl)cc3)C4CC4 InChIKey=IGEWYQVBHCJCSX-JOCHJYFZSA-O InChI=1S/C25H30ClN3O3/c1-3-31-17-22(30)15-28(20-11-12-20)16-24-18(2)27-29(21-7-5-4-6-8-21)25(24)32-23-13-9-19(26)10-14-23/h4-10,13-14,20,22,30H,3,11-12,15-17H2,1-2H3/p+1/t22-/m1/s1 InChI=1/C25H30ClN3O3/c1-3-31-17-22(30)15-28(20-11-12-20)16-24-18(2)27-29(21-7-5-4-6-8-21)25(24)32-23-13-9-19(26)10-14-23/h4-10,13-14,20,22,30H,3,11-12,15-17H2,1-2H3/p+1/t22-/m1/s1/fC25H31ClN3O3/h28H/q+1 CCOC[C@@H](C[NH+](Cc1c(nn(c1Oc2ccc(cc2)Cl)c3ccccc3)C)C4CC4)O C01[X(C25H31Cl1N3O3)] 183 C01 546 CCOC[C@@H](C[NH+](C1CC1)Cc1c(C)nn(c1Oc1ccc(cc1)Cl)c1ccccc1)O CCOC[C@@H](C[NH](C1CC1)C[C]1[C]([N][N@@]([C]1O[C]1[CH][CH][C]([CH][CH]1)Cl)[C]1[CH][CH][CH][CH][CH]1)C)O CCOC[C@H](O)C[NH](C[C]1[C](C)[N]N([C]2[CH][CH][CH][CH][CH]2)[C]1O[C]3[CH][CH][C](Cl)[CH][CH]3)C4CC4 InChIKey=XVJNRZRZNPZKKM-JOCHJYFZSA-N InChI=1S/C25H31ClN3O3/c1-3-31-17-22(30)15-28(20-11-12-20)16-24-18(2)27-29(21-7-5-4-6-8-21)25(24)32-23-13-9-19(26)10-14-23/h4-10,13-14,20,22,28,30H,3,11-12,15-17H2,1-2H3/t22-/m1/s1 InChI=1/C25H31ClN3O3/c1-3-31-17-22(30)15-28(20-11-12-20)16-24-18(2)27-29(21-7-5-4-6-8-21)25(24)32-23-13-9-19(26)10-14-23/h4-10,13-14,20,22,28,30H,3,11-12,15-17H2,1-2H3/t22-/m1/s1 3397.9227505091 -1811.9000305 1-A 19977.2692 121 425 546 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456.20539 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 60 61 62 63 64 65 66 67 68 69 70 71 72 73 74 75 76 77 78 79 80 81 82 83 84 85 86 87 88 89 90 91 92 93 94 95 96 97 98 99 100 101 102 103 104 105 106 107 108 109 110 111 112 113 114 115 116 117 118 119 120 121 122 123 124 125 126 127 128 129 130 131 132 133 134 135 136 137 138 139 140 141 142 143 144 145 146 147 148 149 150 151 152 153 154 155 156 157 158 159 160 161 162 163 164 165 166 167 168 169 170 171 172 173 174 175 176 177 178 179 180 181 182 183 |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|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| 10.6769 13.7748 22.7517 28.9998 37.1585 41.3029 47.7718 50.4283 65.2058 68.4836 77.9373 92.4889 96.8518 102.1959 120.0363 122.9026 127.4187 155.9423 161.9089 172.9172 203.6321 238.3126 262.5088 274.6428 275.6728 279.9514 287.4556 307.2867 325.2493 348.7116 352.7865 368.3683 388.9882 399.9037 428.9936 441.5882 457.9957 464.9247 471.4214 496.5126 504.6189 515.8610 531.6865 548.6517 567.6523 592.0773 624.8961 658.6732 671.9858 681.2060 704.7446 706.4843 735.2797 763.9867 771.1845 778.9811 802.4445 820.9637 862.2910 867.3421 888.9453 889.3671 894.7422 906.0996 933.6781 944.2838 948.3771 950.6274 957.0527 958.0515 997.2749 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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 60 61 62 63 6 6 8 6 6 1 6 7 1 6 6 6 7 7 6 8 6 6 6 6 6 6 17 6 6 6 6 6 6 6 6 6 6 8 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 1 1 1 12.00000 12.00000 15.99491 12.00000 12.00000 1.00783 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 14.00307 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 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 1.00783 1.00783 1.00783 12379.5010 26082.6297 33753.2118 0.99983 -0.01793 0.00501 0.01790 0.99982 0.00551 -0.00511 -0.00542 0.99997 1 0.00700 0.00332 0.00257 0.14578 0.06919 0.05347 15.36 19.82 32.73 41.72 53.46 59.43 68.73 72.56 93.82 98.53 112.13 133.07 139.35 147.04 172.71 176.83 183.33 224.37 232.95 248.79 292.98 342.88 377.69 395.15 396.63 402.79 413.58 442.12 467.96 501.72 507.58 530.00 559.67 575.37 617.23 635.35 658.95 668.92 678.27 714.37 726.03 742.21 764.98 789.39 816.73 851.87 899.09 947.68 966.84 980.10 1013.97 1016.47 1057.90 1099.21 1109.56 1120.78 1154.54 1181.18 1240.64 1247.91 1278.99 1279.60 1287.33 1303.68 1343.35 1358.61 1364.50 1367.74 1376.99 1378.42 1434.86 1472.08 1495.67 1503.04 1512.66 1542.65 1553.59 1573.40 1584.66 1590.41 1597.93 1608.59 1619.27 1628.31 1634.48 1656.02 1676.56 1686.24 1705.16 1712.36 1715.73 1745.25 1746.00 1753.81 1767.87 1782.96 1794.02 1804.23 1807.38 1826.37 1830.64 1859.65 1862.82 1869.67 1871.59 1874.92 1890.84 1904.71 1910.94 1928.19 1930.68 1962.27 2006.73 2024.82 2052.43 2058.98 2081.40 2087.70 2113.06 2130.25 2161.24 2191.51 2215.17 2218.91 2239.33 2251.63 2253.15 2260.93 2265.69 2293.29 2324.54 2328.42 2333.62 2341.01 2343.44 2343.52 2350.63 2359.24 2364.71 2365.91 2381.37 2394.13 2401.37 2407.59 2411.82 2423.62 2463.04 2551.28 2564.42 2585.89 2598.17 2600.34 4577.86 4603.81 4617.06 4628.46 4634.02 4652.69 4657.00 4690.86 4722.29 4730.90 4735.87 4743.17 4776.29 4777.86 4800.89 4810.72 4817.72 4853.67 4864.24 4868.75 4880.03 4883.45 4885.65 4900.65 4902.19 4905.97 4906.67 4908.55 4928.13 5269.38 5839.70 0.569582 0.599233 0.600178 0.503100 -1811.330449 -1811.300797 -1811.299853 -1811.396931 3.256012D-04 MUNgauss RevisionA2.0 retrievium 09-Jan-2021 DUDE CCOC[C@@H](C[NH+](Cc1c(nn(c1Oc2ccc(cc2)Cl)c3ccccc3)C)C4CC4)O C36303777 RHF 6-31G(d) (6D,10F) C1 456.205395 |X|Y|Z| 114.562039 73.198848 38.660980 68.697239 23 6 7 8 19 3 1 |36.858105| |12.582596|36.858105| |8.016996|13.480083|73.516695| |5.198346|8.044619|24.396736|36.858105| |4.083035|5.229198|14.629763|12.523771|36.858105| |4.020475|4.886211|13.245611|8.979148|17.548925|0.500000| |3.141183|3.903174|9.176510|7.535405|12.494331|0.244259|36.858105| |2.682916|3.130929|7.092648|4.971872|7.676661|0.186178|12.692741|53.358707| |2.811906|3.224646|7.420681|4.949521|7.794246|0.185357|9.441323|25.643535|0.500000| |2.481826|2.813659|6.254590|4.136357|5.984688|0.176627|7.609541|17.031683|0.256532|36.858105| |2.203929|2.412867|5.214445|3.256249|4.379433|0.128466|4.984649|10.297491|0.200976|12.827592|36.858105| |2.213010|2.354552|5.069238|3.017619|3.965068|0.118313|4.075295|7.535107|0.168092|7.273861|13.387580|36.858105| |1.936619|2.036203|4.261390|2.514059|3.141873|0.091756|3.268395|5.786284|0.126013|5.181476|8.506907|14.698287|53.358707| |1.795927|1.912071|3.960164|2.387573|2.947111|0.084701|3.222227|5.780121|0.118927|5.235482|8.695858|8.976626|19.239716|53.358707| |1.906306|2.070342|4.336427|2.690469|3.400069|0.097298|3.923532|7.470080|0.143709|7.413033|13.877663|8.678057|11.751203|19.457113|36.858105| |1.766769|1.934015|3.983209|2.506327|3.066567|0.086045|3.673393|6.657789|0.121796|6.034973|7.751305|5.418093|7.471088|11.136557|14.255414|73.516695| |1.708895|1.876899|3.825850|2.417198|2.889428|0.082348|3.457780|5.798825|0.103259|5.394117|5.927029|4.347165|5.819391|7.693893|8.040145|24.552260|36.858105| |1.606304|1.773519|3.559606|2.265083|2.626628|0.073338|3.183859|5.081311|0.090206|4.283949|4.345301|3.378233|4.527985|5.664842|5.336747|14.488720|13.762087|36.858105| |1.527814|1.684284|3.335723|2.112426|2.386798|0.067243|2.832943|4.275614|0.076548|3.578070|3.501854|2.842456|3.789108|4.520648|4.016946|9.370419|7.969434|13.790000|36.858105| |1.536263|1.683893|3.331253|2.088614|2.352533|0.067790|2.718508|4.030531|0.072749|3.504307|3.420986|2.828732|3.748784|4.371203|3.805902|8.199490|6.918790|7.957700|13.743133|36.858105| |1.623880|1.769939|3.542677|2.203495|2.532438|0.074598|2.879038|4.355755|0.079013|4.029938|4.043890|3.324732|4.385988|5.122280|4.493792|9.207049|7.975330|6.875307|7.934107|13.798427|36.858105| |1.719259|1.874381|3.814712|2.378325|2.824878|0.083214|3.249276|5.218247|0.094353|5.135854|5.550329|4.297762|5.680636|7.027203|6.658573|13.924879|13.787467|7.914046|6.857406|7.941434|13.722267|36.858105| |1.419832|1.548283|3.007618|1.866500|2.039817|0.058785|2.299223|3.276818|0.060129|2.747478|2.646300|2.283096|3.028839|3.404154|2.836558|5.773228|4.243197|4.773054|7.039559|10.972381|7.047607|4.766200|448.794386| |1.587320|1.676274|3.402227|2.034233|2.425606|0.068977|2.635601|4.493241|0.092221|3.811503|5.303709|5.483245|10.784981|18.137339|7.636465|11.550082|4.888059|3.870229|3.143806|3.008063|3.417691|4.428088|19.169423|36.858105| 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|17.573343|8.856856|12.812813|4.816445|4.007995|0.107666|3.086232|3.675115|0.080327|2.470150|2.228122|2.269654|2.709814|2.491862|1.926729|3.153695|1.695933|1.589089|1.499668|1.499914|1.587538|1.695057|11.062096|1.619434|1.572635|1.414065|1.321785|1.350151|1.485955|2.608566|2.321724|2.318391|2.131924|7.479351|0.500000| |17.569956|8.887044|10.205479|4.242550|3.381846|0.092190|2.733301|3.209194|0.067974|2.192271|1.964320|1.966149|2.374497|2.220000|1.725151|2.870229|1.570128|1.488364|1.425167|1.432892|1.504207|1.579177|10.733013|1.456946|1.406979|1.277368|1.207323|1.239236|1.356462|2.199682|2.066895|2.049929|1.881670|5.864036|0.300969|0.500000| |17.579812|8.862463|12.846795|4.819097|4.001709|0.115466|3.062398|3.610261|0.076954|2.524610|2.250374|2.279216|2.705787|2.492456|1.937210|3.170865|1.733463|1.617162|1.542948|1.566041|1.669395|1.764824|11.634170|1.613632|1.546487|1.391053|1.311893|1.353059|1.494918|2.625391|2.247293|2.169676|2.028642|6.845192|0.300650|0.300797|0.500000| |8.838015|17.531510|16.549437|7.244961|4.764094|0.128149|3.733820|4.039166|0.082685|2.725509|2.317998|2.233843|2.641443|2.505240|2.003933|3.360762|1.861812|1.769684|1.699835|1.710614|1.791555|1.873769|12.750462|1.619067|1.534328|1.381221|1.313202|1.366011|1.513556|2.445424|2.537081|2.448969|2.202890|7.240378|0.173187|0.212581|0.211795|0.500000| |8.832235|17.525958|16.534150|7.257532|4.784653|0.117942|3.783300|4.136030|0.087029|2.660512|2.296058|2.227003|2.647425|2.506686|1.994116|3.343131|1.817009|1.734378|1.643617|1.626585|1.692733|1.792324|12.015580|1.626097|1.560897|1.404582|1.323892|1.363852|1.505274|2.434274|2.648536|2.671781|2.339169|8.018512|0.211800|0.212236|0.173186|0.301057|0.500000| |4.709736|7.125810|16.488051|17.502362|8.822686|0.216543|6.748361|6.109541|0.118018|3.951737|3.079034|2.807225|3.216747|3.098582|2.582635|4.347578|2.417474|2.286633|2.169780|2.165841|2.273029|2.408002|15.717358|1.952130|1.811549|1.605458|1.527432|1.609932|1.817918|2.972284|3.619041|3.315325|2.908968|10.129596|0.115682|0.111457|0.125435|0.214286|0.174615|0.500000| |4.735673|7.189474|16.546678|17.501109|8.845668|0.174611|6.965913|6.408829|0.130849|3.737290|3.013336|2.782485|3.216470|3.090070|2.550718|4.291326|2.312184|2.203257|2.048972|1.995559|2.073355|2.233401|14.356623|1.958303|1.850514|1.638359|1.540495|1.602096|1.798186|2.942039|3.940116|3.920074|3.230321|12.586796|0.125976|0.112039|0.116218|0.175785|0.217088|0.299700|0.500000| |2.937868|3.641527|8.174578|6.554999|8.733965|0.214140|17.618790|12.303670|0.183609|7.358595|4.700886|3.753288|4.173956|4.207315|3.816068|6.565361|3.660182|3.414902|3.108717|3.016257|3.175526|3.502653|20.494936|2.552507|2.284533|1.980208|1.889388|2.034033|2.368034|3.586397|6.588935|4.946707|4.386986|10.306432|0.078379|0.072097|0.080688|0.101165|0.096862|0.190179|0.163782|0.500000| |3.058134|3.845351|8.612409|7.088233|8.882913|0.173722|17.661384|12.433096|0.213894|5.627848|4.149038|3.493296|3.968440|3.958143|3.467300|5.950956|3.135314|2.989866|2.669520|2.512689|2.594305|2.884658|17.298631|2.445288|2.261293|1.964795|1.844732|1.941906|2.225444|3.394804|7.695582|7.007737|5.154370|12.732738|0.084113|0.074997|0.080651|0.101310|0.108607|0.172977|0.216458|0.300730|0.500000| |2.748372|3.113322|7.105842|4.620190|6.946429|0.237658|7.455972|12.392365|0.218274|17.649423|8.976455|6.755527|6.437938|6.081573|5.653522|8.264450|4.392362|3.591184|3.156777|3.206322|3.729704|4.516563|20.919014|3.358326|2.894150|2.406305|2.263098|2.467400|3.003578|6.322064|5.641507|4.111926|4.398951|10.373398|0.075287|0.066556|0.079039|0.084028|0.079662|0.123354|0.109976|0.204561|0.147190|0.500000| |2.304304|2.629236|5.678274|3.809809|5.087144|0.148248|6.846734|12.405134|0.181765|17.638362|8.887227|5.502896|5.955607|6.439282|6.852059|11.566781|6.541390|5.207955|4.341952|4.241158|4.859083|6.179715|25.738119|3.618835|3.011453|2.523027|2.425492|2.712604|3.351427|4.466325|7.222386|4.624923|5.137555|7.763533|0.062918|0.057297|0.065011|0.072230|0.069469|0.105672|0.096951|0.214543|0.147517|0.302498|0.500000| |1.576162|1.742756|3.485278|2.222953|2.562849|0.070140|3.135403|5.033409|0.090129|3.981650|4.051736|3.202881|4.329014|5.397252|4.964277|13.408251|8.948675|17.740561|8.896059|5.646072|4.955308|5.648206|31.548848|3.775058|3.150460|2.844760|2.938362|3.423271|3.996427|2.602298|4.476007|3.671787|4.340873|4.344315|0.043524|0.040651|0.043747|0.048046|0.047786|0.061771|0.060984|0.091461|0.084021|0.092038|0.129271|0.500000| |1.450736|1.599983|3.134382|1.983476|2.199642|0.061317|2.600664|3.836656|0.069285|3.082916|2.987625|2.483078|3.319044|3.887017|3.358210|7.576760|5.660054|8.929291|17.751449|8.918737|5.649874|4.946591|53.772606|2.753005|2.355665|2.203453|2.333794|2.716585|3.019193|2.127948|3.118449|2.658263|2.878062|3.625288|0.039526|0.037814|0.040511|0.044964|0.043656|0.056744|0.054000|0.078997|0.069476|0.076523|0.101448|0.213981|0.500000| |1.605506|1.736487|3.456108|2.122203|2.411838|0.072081|2.664658|3.940920|0.072607|3.630197|3.631397|3.114608|4.102647|4.614374|3.876659|7.426937|5.665635|4.955837|5.647901|8.937784|17.750695|8.919098|53.813304|3.097061|2.527951|2.296329|2.418747|2.901762|3.425683|2.689411|2.790420|2.298186|2.531683|3.916602|0.043432|0.041394|0.046191|0.049068|0.045831|0.061166|0.055035|0.081551|0.066498|0.097423|0.117364|0.107609|0.124307|0.500000| |1.779280|1.921876|3.940224|2.420553|2.911721|0.087614|3.241834|5.256417|0.097477|5.413219|6.305247|5.070927|6.697672|8.063828|7.276904|12.503672|8.884481|5.628676|4.946062|5.655374|8.925547|17.743302|31.614219|4.821377|3.587374|3.043497|3.104523|3.805511|5.093314|3.903543|3.625964|2.854977|3.351224|4.863183|0.048868|0.045171|0.051133|0.053120|0.050635|0.067538|0.062403|0.095304|0.078741|0.137261|0.167475|0.124120|0.107453|0.215658|0.500000| |1.608707|1.677806|3.396340|1.994770|2.361907|0.065971|2.492374|4.203237|0.091234|3.290730|4.342546|5.019400|9.641298|9.894589|5.092566|7.626620|3.359837|2.872170|2.412684|2.297558|2.525516|3.072265|15.319886|8.932813|17.754060|8.892820|5.637024|4.952280|5.642149|4.008109|3.153284|2.954324|3.778763|4.575035|0.046345|0.040989|0.045112|0.044343|0.045543|0.052114|0.053943|0.064906|0.065532|0.082656|0.083246|0.080866|0.060810|0.065123|0.091565|0.500000| |1.331850|1.379912|2.726147|1.593623|1.819613|0.050734|1.918723|3.075387|0.064900|2.378878|2.887434|3.104843|5.266147|5.703054|3.366314|5.670905|2.711606|2.452380|2.132997|2.029525|2.170080|2.511707|13.937459|5.665273|8.946133|17.730090|8.908198|5.647775|4.950454|2.670801|2.356680|2.266131|2.735676|3.443885|0.038170|0.034429|0.037293|0.036812|0.037676|0.042244|0.043465|0.051045|0.051353|0.060909|0.062929|0.069724|0.055029|0.056530|0.072650|0.214724|0.500000| |1.208669|1.257950|2.465215|1.451116|1.638286|0.046020|1.746921|2.750162|0.056335|2.173730|2.571572|2.630689|4.294506|4.925262|3.071651|5.524503|2.805205|2.596953|2.311008|2.209372|2.334754|2.633210|15.291022|4.967259|5.644740|8.911918|17.729637|8.919938|5.644201|2.253828|2.119875|1.996854|2.364404|3.011174|0.034242|0.031431|0.033960|0.033975|0.034275|0.039101|0.039471|0.047583|0.046653|0.055769|0.059523|0.072956|0.059895|0.060873|0.074574|0.123983|0.214728|0.500000| |1.262519|1.326420|2.612143|1.555370|1.767368|0.050207|1.913792|3.021415|0.060266|2.484061|2.943800|2.876079|4.617049|5.672940|3.677302|6.975813|3.757640|3.420421|3.057547|2.964707|3.178353|3.596151|19.912287|5.666369|4.950338|5.646604|8.913150|17.730329|8.940669|2.389673|2.321014|2.099429|2.494659|3.167977|0.035402|0.032762|0.035654|0.036158|0.035917|0.042434|0.041937|0.053218|0.050418|0.063245|0.070069|0.092168|0.077151|0.081771|0.100122|0.107531|0.124112|0.214829|0.500000| |1.489149|1.582059|3.178313|1.917425|2.245793|0.064698|2.473856|4.053011|0.079287|3.573046|4.521698|4.185960|6.795384|9.691538|6.367253|12.107908|6.458018|4.926577|4.090130|4.046451|4.774824|6.304628|24.651325|8.902775|5.632050|4.952445|5.646848|8.921067|17.751667|3.205555|3.054789|2.600169|3.193569|3.972638|0.041586|0.038220|0.042260|0.043154|0.042467|0.052368|0.050994|0.069334|0.063423|0.088545|0.101858|0.122989|0.095583|0.117194|0.182969|0.124141|0.107534|0.124213|0.215813|0.500000| |2.617943|2.713114|5.952828|3.344299|4.348254|0.143359|3.906107|6.181538|0.138246|5.656887|6.354456|8.888353|8.324125|6.269865|4.634563|6.328639|3.230227|2.658341|2.378414|2.453454|2.877434|3.423898|16.672505|3.513631|3.167119|2.598052|2.370659|2.508511|3.011343|17.542283|3.519842|2.988495|3.309031|8.134324|0.074275|0.063405|0.077550|0.071278|0.068781|0.086355|0.081746|0.101147|0.091076|0.189211|0.124505|0.069325|0.058734|0.078775|0.111860|0.093818|0.066584|0.058301|0.063220|0.085012|0.500000| |2.338593|2.380211|5.071061|2.823380|3.531264|0.106611|3.275548|5.328260|0.124610|4.418871|5.482997|8.986249|10.263800|6.754718|4.450312|6.033851|2.944312|2.457538|2.170143|2.189701|2.511126|2.994096|14.939275|3.896583|3.742693|2.996752|2.619180|2.673302|3.164401|17.621751|3.271817|2.921648|3.331374|7.133065|0.068069|0.057410|0.067865|0.061677|0.061885|0.071818|0.071946|0.082975|0.080430|0.129410|0.100181|0.065640|0.054184|0.067883|0.095662|0.117515|0.077940|0.064028|0.065894|0.085101|0.301501|0.500000| |2.820208|2.957194|6.665217|3.764394|5.140098|0.154181|4.524641|7.540172|0.194861|5.842508|6.432636|8.838896|8.136354|6.171014|4.614924|6.345744|3.086318|2.606013|2.284975|2.274906|2.571258|3.060367|15.442681|3.472432|3.272547|2.652144|2.354424|2.428239|2.877297|17.548501|4.177047|3.672557|4.053497|11.314137|0.082512|0.067528|0.080872|0.075138|0.076533|0.092021|0.094272|0.108156|0.107428|0.177348|0.122227|0.070167|0.057192|0.068502|0.094797|0.101510|0.069076|0.057961|0.060561|0.078929|0.301639|0.301009|0.500000| |2.154429|2.492394|5.229125|3.601353|4.478104|0.112997|6.802108|12.263532|0.180695|7.010007|5.526528|4.032719|4.789763|5.322484|5.211636|10.258950|5.208044|5.110009|4.069358|3.516261|3.543510|4.166395|22.266731|3.257647|2.872179|2.459262|2.342226|2.538862|2.998784|3.391866|17.741895|8.554776|8.564764|7.369962|0.059637|0.054321|0.058760|0.067530|0.068940|0.096960|0.100634|0.187259|0.186864|0.145752|0.219582|0.151128|0.102755|0.084840|0.106242|0.080431|0.062457|0.058183|0.065525|0.086861|0.088706|0.080861|0.098689|0.500000| |2.104933|2.422379|4.924767|3.302702|3.777815|0.090289|4.969336|7.556081|0.143986|4.067063|3.660546|3.107549|3.856805|4.093879|3.517870|6.544265|3.246534|3.290417|2.795552|2.455985|2.436495|2.742895|16.673588|2.669277|2.538772|2.235401|2.085699|2.157320|2.423017|2.797497|8.637730|17.730128|8.544425|6.900566|0.059521|0.053676|0.055821|0.064069|0.069910|0.085190|0.100112|0.122165|0.166980|0.096456|0.111315|0.101840|0.074841|0.060686|0.072486|0.073358|0.058796|0.052863|0.055608|0.067158|0.071501|0.069794|0.084597|0.210457|0.500000| |2.482435|2.862243|6.045229|4.030132|4.865814|0.110570|6.053792|9.481886|0.211422|4.559424|4.085194|3.615694|4.317409|4.333677|3.642664|6.221413|3.017638|2.881379|2.469644|2.255923|2.318285|2.648660|15.379946|2.734411|2.638040|2.272867|2.071293|2.118433|2.401939|3.392179|8.601516|17.694503|8.631603|9.974349|0.071667|0.062014|0.065331|0.073250|0.082627|0.097528|0.123118|0.131676|0.204821|0.110964|0.114125|0.085147|0.064762|0.058806|0.072612|0.078774|0.060204|0.052204|0.053965|0.065916|0.084591|0.083602|0.108454|0.170774|0.292757|0.500000| |2.117858|2.335088|4.927755|3.106343|3.938605|0.100266|4.671552|9.400718|0.217330|5.531488|6.162933|5.401617|6.696776|6.979563|5.853559|9.296973|3.932640|3.509473|2.829671|2.567036|2.718280|3.305072|16.809948|4.183179|4.020951|3.223872|2.821426|2.878109|3.397483|4.402393|8.614197|8.629563|17.723824|7.980480|0.061076|0.052998|0.057699|0.060716|0.064749|0.078127|0.086936|0.110672|0.127936|0.123783|0.131572|0.104007|0.071867|0.067802|0.092328|0.123756|0.083238|0.068667|0.070562|0.090227|0.102333|0.108454|0.132946|0.170932|0.170810|0.213015|0.500000| 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