Version2.1 2020-12-26T19:28:23Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 26-Nov-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE C[C@H]1Cc2cc(ccc2N1C(=O)COC(=O)C3(CCCCC3)c4cccc(c4)Cl)S(=O)(=O)N C12768716 RHF 6-31G(d) (6D,7F) C[C@H]1Cc2cc(ccc2N1C(=O)COC(=O)C3(CCCCC3)c4cccc(c4)Cl)S(=O)(=O)N C01[X(C24H27Cl1N2O5S1)] 174 C1 557 Clc1cccc(c1)C1(CCCCC1)C(=O)OCC(=O)N1[C@@H](C)Cc2c1ccc(c2)S(=O)(=O)N Clc1cccc(c1)C1(CCCCC1)C(=O)OCC(=O)N1[C@@H](C)Cc2c1ccc(c2)S(=O)(=O)N C[C@H]1Cc2cc(ccc2N1C(=O)COC(=O)C3(CCCCC3)c4cccc(Cl)c4)[S](N)(=O)=O InChIKey=PNFYZAWQZDKPGU-INIZCTEOSA-N InChI=1S/C24H27ClN2O5S/c1-16-12-17-13-20(33(26,30)31)8-9-21(17)27(16)22(28)15-32-23(29)24(10-3-2-4-11-24)18-6-5-7-19(25)14-18/h5-9,13-14,16H,2-4,10-12,15H2,1H3,(H2,26,30,31)/t16-/m0/s1 InChI=1/C24H27ClN2O5S/c1-16-12-17-13-20(33(26,30)31)8-9-21(17)27(16)22(28)15-32-23(29)24(10-3-2-4-11-24)18-6-5-7-19(25)14-18/h5-9,13-14,16H,2-4,10-12,15H2,1H3,(H2,26,30,31)/t16-/m0/s1/f/h26H2 C[C@H]1Cc2cc(ccc2N1C(=O)COC(=O)C3(CCCCC3)c4cccc(c4)Cl)S(=O)(=O)N C01[X(C24H27Cl1N2O5S1)] 174 C01 557 Clc1cccc(c1)C1(CCCCC1)C(=O)OCC(=O)N1[C@@H](C)Cc2c1ccc(c2)S(=O)(=O)N C[C@H]1C[C]2[C]([CH][CH][C]([CH]2)S(=O)(=O)N)N1C(=O)COC(=O)C1(CCCCC1)[C]1[CH][CH][CH][C]([CH]1)Cl C[C@H]1C[C]2[CH][C]([CH][CH][C]2N1C(=O)COC(=O)C3(CCCCC3)[C]4[CH][CH][CH][C](Cl)[CH]4)[S](N)(=O)=O InChIKey=PNFYZAWQZDKPGU-INIZCTEOSA-N InChI=1S/C24H27ClN2O5S/c1-16-12-17-13-20(33(26,30)31)8-9-21(17)27(16)22(28)15-32-23(29)24(10-3-2-4-11-24)18-6-5-7-19(25)14-18/h5-9,13-14,16H,2-4,10-12,15H2,1H3,(H2,26,30,31)/t16-/m0/s1 InChI=1/C24H27ClN2O5S/c1-16-12-17-13-20(33(26,30)31)8-9-21(17)27(16)22(28)15-32-23(29)24(10-3-2-4-11-24)18-6-5-7-19(25)14-18/h5-9,13-14,16H,2-4,10-12,15H2,1H3,(H2,26,30,31)/t16-/m0/s1/f/h26H2 3707.6330910891 -2264.7392645 1-A 24485.7986 129 428 557 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7.3063 7.4338 7.4756 7.5058 7.5235 7.6098 7.6651 8.6959 9.6810 0.0709 0.5056 1.8602 0.5005 0.8096 0.9093 1.9491 0.5368 1.5335 3.0196 3.3524 2.0995 1.7340 1.8511 2.9805 19.8792 12.4506 3.0320 2.2881 1.5909 6.4247 4.2882 0.5824 3.8490 2.1331 3.5973 0.8846 2.2470 2.6859 4.2204 3.8745 6.0208 14.8438 3.7112 9.4201 5.6471 0.8744 1.2169 4.0102 33.0294 2.7403 14.8626 4.8341 12.9729 25.7667 39.0835 1.2396 45.5169 20.1891 52.9126 29.6621 11.1954 10.3186 74.5257 57.3290 28.2553 25.1129 185.1163 28.5281 19.0406 1.8642 0.8951 18.5763 33.4456 4.3106 1.2444 39.2403 43.5781 0.3164 2.0493 243.2812 33.1995 11.9299 8.9220 6.4976 2.8972 1.3955 36.2416 1.2480 9.3554 5.0079 0.3893 2.9437 2.3416 0.7682 11.3740 8.2762 1.7848 37.1683 31.9076 17.3131 5.6613 6.8805 3.7242 22.5837 15.3678 8.9128 94.5281 223.6018 34.4935 199.8780 44.5440 24.4639 47.0841 7.0748 1.4548 35.2080 532.7057 124.8909 193.4390 63.7612 43.3833 7.0615 90.7379 83.3189 21.5457 44.6235 213.9944 5.8210 70.4166 3.2876 63.7334 0.5716 3.4221 1.2857 13.3137 43.0510 5.4865 141.8930 1.1682 4.3933 0.6016 17.7161 3.7992 9.9569 29.5295 134.3603 55.8682 92.7298 8.6716 52.1036 35.1190 28.7793 29.6502 83.3100 501.1000 187.1980 25.3552 34.2630 22.2582 4.2464 27.0624 38.7455 24.4513 84.7499 66.1287 89.1841 26.6433 23.2211 26.8997 22.1291 17.1001 17.5035 7.2580 19.4626 11.3383 0.6201 6.8382 0.5718 2.8217 0.5412 5.3720 77.4283 64.2612 3.1284 1.9159 0.6771 3.6082 0.4389 1.5772 0.7436 1.2191 0.9169 0.5616 1.5095 0.4207 2.2159 2.2740 1.4696 1.4613 0.9042 1.6768 1.2485 1.3518 1.9795 1.0238 1.9281 1.4043 3.2609 2.2089 3.5873 1.4839 0.8558 1.4959 0.3147 2.4775 2.3169 1.0935 1.7081 3.2190 1.1833 0.2662 1.7186 2.4618 0.9059 1.0897 1.4398 2.2389 1.2930 0.9351 3.3298 2.4491 2.1867 4.7430 2.0421 1.5753 5.5991 4.4674 2.0949 4.3636 0.4806 12.3317 2.1293 12.6533 9.5458 1.5321 8.4434 2.0803 2.9473 5.6420 1.5738 3.3730 2.8035 1.0040 5.5837 1.6323 1.5077 1.4866 0.9596 3.4099 2.0542 5.7349 7.7760 4.9221 33.2032 0.8033 3.7787 1.2719 1.1227 17.9241 4.1923 7.4384 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0.6229 0.8551 0.5670 0.8208 0.3154 0.7014 0.4274 0.4520 0.5916 0.2484 0.3613 0.3403 0.2528 0.8374 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 60 6 6 1 6 6 6 6 6 6 6 7 6 8 6 8 6 8 6 6 6 6 6 6 6 6 6 6 6 6 17 16 8 8 7 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 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 31.97207 15.99491 15.99491 14.00307 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 10551.8278 39170.4058 41042.8354 0.99993 0.00702 0.00960 -0.00718 0.99984 0.01665 -0.00948 -0.01672 0.99982 1 0.00821 0.00221 0.00211 0.17104 0.04607 0.04397 11.80 15.62 30.45 42.98 48.36 69.46 85.98 96.82 122.08 133.75 163.18 176.65 183.46 206.28 222.33 242.49 242.75 278.67 302.33 325.41 335.06 366.01 391.22 405.25 411.66 416.32 458.42 468.78 470.20 501.01 547.06 572.29 591.87 603.85 617.96 649.37 668.55 675.30 688.00 692.24 711.87 715.03 765.72 789.99 816.56 839.61 858.89 905.18 909.69 924.39 927.38 959.36 1004.99 1081.96 1094.79 1105.22 1121.74 1128.81 1166.03 1175.58 1221.95 1251.19 1259.62 1305.37 1310.08 1329.44 1345.04 1356.22 1389.91 1412.85 1430.20 1451.32 1457.63 1472.17 1482.67 1502.12 1508.27 1519.71 1527.89 1550.60 1566.12 1579.19 1617.27 1621.39 1633.86 1640.60 1659.20 1668.46 1709.10 1714.11 1726.90 1741.70 1744.47 1753.68 1756.30 1778.98 1779.72 1783.75 1806.44 1831.92 1858.49 1866.76 1884.36 1900.78 1914.09 1924.66 1943.95 1980.53 1990.61 2025.45 2044.80 2046.84 2057.42 2083.69 2107.11 2109.45 2122.82 2126.26 2150.08 2170.62 2175.34 2195.16 2202.86 2209.21 2215.79 2254.80 2271.55 2275.24 2303.91 2348.80 2349.13 2354.33 2359.44 2365.09 2369.81 2370.44 2380.87 2382.65 2389.24 2392.33 2547.20 2550.38 2565.74 2590.28 2605.99 2811.93 2867.50 4584.49 4593.33 4615.21 4618.10 4622.27 4629.61 4631.53 4653.23 4661.03 4682.54 4692.67 4698.18 4706.62 4733.09 4754.96 4764.59 4778.46 4790.03 4852.62 4887.69 4897.01 4914.20 4915.40 4949.23 4964.55 5399.39 5561.47 0.521410 0.550157 0.551101 0.457160 -2264.217854 -2264.189107 -2264.188163 -2264.282105 3.150830D-04 MUNgauss RevisionA2.0 retrievium 26-Dec-2020 DUDE C[C@H]1Cc2cc(ccc2N1C(=O)COC(=O)C3(CCCCC3)c4cccc(c4)Cl)S(=O)(=O)N C12768716 RHF 6-31G(d) (6D,10F) C1 490.132922 |X|Y|Z| 50.846067 59.009225 135.714146 74.119781 25 6 7 8 23 1 1 |36.858105| |12.491311|36.858105| |8.894791|17.679615|0.500000| |7.450564|12.377599|0.242518|36.858105| |5.771256|7.990304|0.163366|12.643751|36.858105| |4.252294|5.117649|0.115859|7.330821|13.916392|36.858105| |3.529572|4.061374|0.095064|4.973821|8.009272|13.655853|36.858105| |3.535827|4.063391|0.095487|4.482338|6.905281|7.900797|13.819649|36.858105| |4.280428|5.128987|0.117435|5.158381|7.888997|6.801796|7.916466|13.688152|36.858105| |5.818177|8.052082|0.166240|8.002975|13.608100|7.910837|6.907354|7.978938|13.766575|36.858105| |7.685326|12.836161|0.253792|8.034075|8.342909|5.320690|4.595714|5.083534|7.512418|13.548318|53.358707| |5.945255|7.783857|0.206590|5.256324|5.270312|3.914584|3.621708|4.138954|5.876576|7.517031|18.940130|36.858105| |5.903847|7.067764|0.219797|4.646393|4.267893|3.288907|3.006320|3.303972|4.312699|5.319119|11.618918|15.931498|73.516695| |4.166812|4.959902|0.131311|3.983908|4.368700|3.536081|3.526954|4.307281|6.180884|6.277329|10.470751|12.537691|14.280686|36.858105| |3.500719|3.977840|0.112082|3.233289|3.364924|2.826106|2.808593|3.293315|4.263283|4.341650|7.165101|8.096932|13.123966|13.605215|73.516695| |2.839158|3.158948|0.088244|2.711891|2.876146|2.517264|2.571847|3.034513|3.743094|3.591923|5.443283|5.292656|8.667959|8.179728|25.490532|36.858105| |2.661226|2.959428|0.080686|2.627272|2.882491|2.583124|2.720430|3.297588|4.007557|3.616596|5.144675|4.650873|7.240590|7.289891|15.358261|16.025822|73.516695| |2.464400|2.683147|0.076841|2.323244|2.390979|2.121092|2.141508|2.443363|2.890400|2.846604|4.333110|4.051509|7.250827|5.166450|14.223323|12.424150|13.975352|36.858105| |2.110196|2.254580|0.063550|2.004622|2.090020|1.900945|1.952311|2.227751|2.554887|2.447254|3.583765|3.169502|5.556535|3.962545|9.251850|7.631302|12.117748|12.341540|36.858105| |2.090679|2.175079|0.060366|1.928941|2.023359|1.850269|1.913601|2.194118|2.505255|2.371836|3.447035|3.007616|5.249168|3.719450|8.219591|6.157465|10.487619|7.408351|12.428500|36.858105| |2.144330|2.181777|0.060986|1.903994|1.959413|1.776599|1.809441|2.045151|2.344011|2.276817|3.386320|2.975566|5.393056|3.488951|7.759669|5.124031|8.049709|6.314772|7.509844|12.464677|36.858105| |2.524296|2.565483|0.072460|2.171456|2.202618|1.953684|1.958872|2.211475|2.600144|2.591546|4.003445|3.677528|6.914951|4.245188|10.126056|6.083091|8.574368|7.401588|6.468418|7.581283|12.467469|36.858105| |2.556514|2.695896|0.078089|2.278893|2.286913|2.011617|1.998419|2.243371|2.652252|2.687366|4.216422|3.979281|7.655994|4.607943|12.240123|7.468351|9.378964|12.285568|7.575629|6.474129|7.524980|12.440130|36.858105| |2.348111|2.623110|0.076909|2.309893|2.342106|2.082368|2.078460|2.325761|2.710207|2.724101|4.138954|3.774135|6.853678|4.507025|11.204711|7.763845|10.444363|12.313585|7.406584|4.827821|4.309534|4.859567|7.516041|36.858105| |2.573585|2.939438|0.089070|2.552806|2.517264|2.198470|2.144170|2.359641|2.772281|2.898064|4.550556|4.204787|7.993114|4.633707|11.136807|6.206762|8.479472|7.457740|4.919284|3.727190|3.561620|4.233651|6.301927|13.643193|36.858105| |2.343310|2.694193|0.082524|2.413445|2.351552|2.081301|2.015707|2.173003|2.489097|2.619906|4.025379|3.507774|6.615921|3.685410|7.906969|4.400945|6.620131|4.969246|3.821529|3.004722|2.873146|3.264838|4.403069|7.879988|13.781568|36.858105| |2.023451|2.295792|0.068871|2.112605|2.090938|1.893521|1.859220|1.999993|2.238946|2.302864|3.420121|2.884643|5.283131|3.100400|6.449024|3.815213|6.056571|4.371312|3.689507|2.865534|2.673855|2.891697|3.744797|6.776969|7.913449|13.752883|36.858105| |1.911996|2.140592|0.062941|1.973278|1.991729|1.821407|1.819177|1.982901|2.210616|2.217958|3.243411|2.742119|4.926500|3.071519|6.487327|4.121495|6.684176|4.963985|4.464882|3.286623|2.951992|3.073547|3.969397|7.914738|6.939753|8.036189|13.822123|36.858105| |2.028168|2.254009|0.065586|2.044552|2.087094|1.896719|1.910661|2.120361|2.399812|2.376413|3.494443|3.033120|5.410514|3.553083|7.930083|5.480150|8.613402|7.424903|6.601917|4.314777|3.714891|3.835149|5.182095|13.706785|7.976889|6.903319|7.894952|13.757594|36.858105| |1.637191|1.810480|0.052634|1.704335|1.731331|1.615638|1.627720|1.759037|1.912575|1.895522|2.707392|2.218918|3.944387|2.460523|4.968266|3.144923|5.384698|3.620614|3.604347|2.809176|2.510500|2.508682|3.026721|4.757988|4.241723|4.782235|7.044830|10.909921|7.049476|448.794386| |2.723516|2.994207|0.073174|3.573640|4.762334|6.972458|10.808264|6.990811|4.729858|4.214189|4.390944|2.715899|4.182059|2.697787|4.018714|2.131954|4.032802|1.825038|1.702595|1.676685|1.582886|1.681131|1.705745|1.781953|1.819407|1.735758|1.632601|1.607797|1.672823|11.808952|388.023441| |2.410446|2.628647|0.065286|2.978752|3.844106|4.937635|7.374253|6.585226|4.451379|3.711431|3.967153|2.550876|3.927631|2.637917|3.970358|2.156384|4.166140|1.841950|1.745914|1.726378|1.608480|1.684168|1.700797|1.787581|1.794486|1.705944|1.622474|1.619585|1.694303|12.000993|94.651706|73.516695| |2.550053|2.839863|0.070864|3.496575|4.378430|6.309811|7.321232|5.038022|3.855667|3.692397|4.012746|2.495775|3.917150|2.435729|3.697914|1.959941|3.661328|1.704754|1.585631|1.545338|1.464833|1.557682|1.597648|1.693109|1.747159|1.693929|1.599336|1.560033|1.600514|11.522447|94.670670|13.581354|73.516695| |2.700435|2.817932|0.068438|3.309864|4.174531|5.703402|7.072957|5.252795|3.965134|3.675311|3.995156|2.482002|3.894027|2.422227|3.656919|1.931876|3.612917|1.674242|1.569591|1.568270|1.501084|1.593594|1.593695|1.618093|1.650793|1.569253|1.472718|1.451220|1.514267|10.682311|82.026659|13.488882|13.810834|53.358707| |17.546845|8.847552|0.213519|6.703318|4.889727|3.826619|3.147748|3.058167|3.528465|4.579173|7.588156|4.596117|8.474415|3.415677|5.309779|2.482548|4.142307|2.210640|1.912075|1.889605|1.947234|2.268789|2.306210|2.137101|2.353500|2.185040|1.899149|1.783196|1.868674|12.367259|17.940093|3.946943|4.296246|3.451543|0.500000| |17.601878|8.828412|0.213673|5.456905|4.616880|3.556144|3.103718|3.218857|3.949940|5.045119|9.486393|6.380881|12.344197|4.417747|6.813007|3.048566|4.972783|2.665487|2.259147|2.256756|2.358755|2.841720|2.843930|2.495411|2.732804|2.441112|2.089044|1.980908|2.124299|13.505858|17.392561|3.946870|4.049863|3.293272|0.301238|0.500000| |17.542803|8.797623|0.173620|6.861681|6.126071|4.665745|3.907515|3.895785|4.635329|6.097230|9.436359|5.233877|8.627465|3.972436|5.821353|2.720082|4.638405|2.338415|2.040106|2.048728|2.086278|2.414542|2.398258|2.200947|2.359446|2.147123|1.883755|1.803240|1.921245|12.531483|21.218929|4.653714|4.850974|4.138362|0.300835|0.300069|0.500000| |5.580228|8.738829|0.224904|17.541499|8.889337|6.289540|4.462640|4.006677|4.478080|6.354116|8.822224|4.740055|7.680386|3.710045|5.513688|2.631919|4.519839|2.285394|1.967659|1.865486|1.832312|2.080128|2.222587|2.328940|2.612823|2.528096|2.212783|2.037614|2.078291|14.132155|23.910139|5.030614|6.099532|4.123867|0.148550|0.124146|0.139051|0.500000| |7.294494|8.715212|0.188274|17.585395|8.777089|6.557306|4.503309|3.926804|4.273317|5.911040|7.959613|4.224940|6.941497|3.327865|4.956691|2.382008|4.113523|2.078786|1.819543|1.768700|1.760012|1.992406|2.064132|2.057870|2.254729|2.145835|1.899092|1.780598|1.839084|12.497275|24.444729|5.025648|6.065430|4.556179|0.207620|0.144104|0.196861|0.302118|0.500000| |3.853101|4.476272|0.105189|6.604143|8.941273|17.736808|8.871144|5.632352|4.916515|5.624616|5.875350|3.318974|5.154659|2.986261|4.394430|2.222564|4.027156|1.913558|1.726307|1.679469|1.621861|1.774923|1.828836|1.895692|2.008832|1.928484|1.765904|1.690726|1.742602|12.153027|47.253538|8.059623|12.496161|7.916390|0.101092|0.089357|0.115865|0.167824|0.183863|0.500000| |3.002003|3.342880|0.080947|3.579852|4.972228|5.636334|8.962318|17.760517|8.917150|5.668258|5.573404|3.566000|5.186323|3.890424|5.476729|2.942483|5.843443|2.381152|2.221474|2.206426|2.029599|2.152797|2.164403|2.249943|2.237780|2.061284|1.925236|1.936110|2.079346|13.960555|47.508927|13.693649|8.338111|6.875875|0.073260|0.077812|0.091239|0.091151|0.089491|0.124121|0.500000| |3.878740|4.465259|0.106644|4.194036|5.598099|4.923671|5.671112|8.994520|17.818552|8.810822|8.971284|6.052943|7.835276|7.527028|8.835628|4.448212|8.812090|3.279057|2.906906|2.877941|2.645842|2.925663|2.951824|2.977692|2.965618|2.599279|2.342034|2.352927|2.612296|16.236289|27.973650|6.996868|5.793151|4.623265|0.089089|0.104504|0.114687|0.103931|0.098966|0.107056|0.217995|0.500000| |3.725307|4.605609|0.121906|3.992751|4.568719|3.780216|3.857367|4.820520|6.911070|6.555039|9.493913|8.825157|10.853855|17.633648|16.564976|7.395113|13.386053|4.773859|3.797642|3.457415|3.128403|3.616932|4.004314|4.454607|4.550131|3.760107|3.230712|3.207745|3.652090|20.749327|20.781823|5.129490|4.697421|3.453038|0.086894|0.104867|0.099908|0.106240|0.091444|0.087740|0.121068|0.233634|0.500000| |4.061351|4.506071|0.114391|3.708359|4.209149|3.506410|3.614190|4.578490|6.641304|6.079231|9.159407|8.876237|11.197031|17.612023|16.627813|7.145394|12.653469|4.661388|3.837357|3.835903|3.591958|4.267225|4.260932|3.873940|3.806641|3.101032|2.696215|2.726290|3.165465|18.064157|19.716924|4.885067|4.343476|3.441398|0.091905|0.120326|0.112761|0.093403|0.088425|0.081776|0.117457|0.252888|0.301897|0.500000| |1.940435|2.062455|0.058674|1.844652|1.899630|1.736000|1.770415|1.988495|2.249572|2.183387|3.202754|2.790784|4.998038|3.326705|7.552560|5.562285|8.838827|8.895912|17.534028|8.893592|6.814833|5.713532|6.870162|6.956290|4.713649|3.809475|3.798070|4.722504|6.926108|31.260916|11.099195|2.835871|2.607540|1.967537|0.049421|0.057641|0.051887|0.050637|0.046844|0.044212|0.054972|0.069687|0.089053|0.088745|0.500000| |2.030482|2.192942|0.061393|1.984092|2.096951|1.928260|2.004003|2.300881|2.608323|2.452399|3.508226|3.037932|5.189723|3.857578|8.506004|7.114081|13.241295|8.786592|17.610104|8.870931|5.499589|4.852272|5.502509|6.718206|4.551824|3.693538|3.698340|4.622601|6.800593|31.005070|12.503220|3.239751|2.908213|2.184205|0.051136|0.059529|0.054908|0.054336|0.049906|0.048570|0.064469|0.082795|0.107471|0.104006|0.302362|0.500000| |1.876079|1.943906|0.053834|1.750776|1.839967|1.705124|1.773129|2.019007|2.257784|2.125273|3.039289|2.583030|4.497392|3.118137|6.564395|4.698499|8.456637|5.455592|8.889451|17.538687|8.820645|5.509980|4.861884|4.045994|3.190530|2.676482|2.623711|3.041434|3.876084|21.821567|11.222482|2.909360|2.591828|2.014851|0.047519|0.055753|0.051372|0.047183|0.044915|0.043271|0.056965|0.071306|0.082445|0.089635|0.217357|0.215288|0.500000| |2.225208|2.314055|0.063278|2.052052|2.187913|2.001889|2.094169|2.444337|2.813893|2.606231|3.741920|3.258321|5.523664|4.184819|8.924398|6.776363|12.661523|6.640287|8.834579|17.546809|8.845422|6.781390|5.647830|4.419636|3.538210|2.861885|2.701357|3.040497|3.895953|20.925427|12.952873|3.354645|2.949629|2.315399|0.055272|0.066562|0.061230|0.054627|0.052090|0.050028|0.068786|0.092028|0.107448|0.125350|0.174154|0.215838|0.304285|0.500000| |1.965738|2.001699|0.056487|1.760599|1.794615|1.634959|1.656698|1.849206|2.094247|2.053030|3.050086|2.646094|4.864015|3.015442|6.625833|4.287121|6.763306|5.571802|6.753124|8.849813|17.497451|8.863824|6.778784|4.148785|3.440260|2.837313|2.683102|2.982043|3.708291|20.637182|10.402449|2.637804|2.427223|1.890288|0.050185|0.059777|0.052854|0.047445|0.045427|0.041793|0.050932|0.064624|0.076491|0.084401|0.200256|0.139417|0.215315|0.173709|0.500000| |2.087877|2.087995|0.057761|1.830657|1.891156|1.726295|1.765534|1.993468|2.264945|2.186362|3.218261|2.770953|4.984808|3.196543|6.740071|4.268529|7.030889|4.760700|5.478708|8.818733|17.535358|8.814692|5.483803|3.489055|2.998209|2.485918|2.325063|2.533413|3.082592|17.725571|11.052425|2.814135|2.545075|2.026198|0.052758|0.063844|0.057057|0.048584|0.047393|0.043856|0.055245|0.070923|0.079603|0.094132|0.139711|0.123495|0.210782|0.215160|0.303250|0.500000| |2.491130|2.477608|0.070454|2.088947|2.085548|1.850188|1.837049|2.043947|2.381327|2.412539|3.753925|3.386175|6.572947|3.675370|8.285371|4.643531|6.794633|5.445381|4.851120|5.506493|8.810130|17.540321|8.879557|4.073279|3.760062|3.003335|2.655732|2.762469|3.312566|18.387521|11.275187|2.804179|2.624995|2.066489|0.062918|0.078833|0.065823|0.055521|0.053813|0.047068|0.055003|0.073003|0.087383|0.102417|0.127849|0.106885|0.123331|0.139124|0.215069|0.210730|0.500000| |2.822563|2.846300|0.078973|2.376704|2.438921|2.145580|2.159561|2.472322|2.963009|2.932048|4.555197|4.258207|7.808015|5.057999|11.826993|6.694185|9.548239|6.651869|5.660258|6.794271|8.845491|17.502342|8.829343|4.452262|3.999285|3.102331|2.726902|2.862344|3.516728|18.864611|13.004968|3.253925|2.980482|2.363778|0.069157|0.089163|0.075655|0.062339|0.060305|0.053604|0.066640|0.094330|0.114414|0.148283|0.131740|0.126760|0.139231|0.198613|0.173764|0.214870|0.304259|0.500000| |2.878382|3.052890|0.090246|2.513062|2.472365|2.136227|2.087711|2.325291|2.786339|2.909234|4.737504|4.637943|9.534865|5.050529|13.697027|6.858242|8.576812|8.738543|5.499675|4.846973|5.503868|8.864661|17.639837|6.869412|6.972613|4.754839|3.802053|3.798012|4.665819|23.005778|12.524668|3.083620|2.944430|2.241608|0.071867|0.090325|0.073449|0.068106|0.062856|0.053918|0.061342|0.084877|0.118145|0.124404|0.140608|0.122938|0.106940|0.126111|0.140004|0.123453|0.215678|0.214465|0.500000| |2.280949|2.394587|0.069902|2.058155|2.048378|1.821718|1.805903|2.000422|2.317652|2.354150|3.644533|3.314849|6.415196|3.694870|8.992711|5.506702|7.574754|8.916501|6.902309|5.736792|6.831215|8.862072|17.527956|7.078055|5.944920|4.411357|3.867090|4.144003|5.322998|25.560572|11.119247|2.773454|2.625444|1.993999|0.058140|0.069853|0.059422|0.056288|0.052261|0.046484|0.053830|0.070531|0.092589|0.095422|0.205596|0.140959|0.128619|0.131874|0.201312|0.139820|0.215226|0.173628|0.303686|0.500000| |2.960502|3.399206|0.105004|2.843422|2.755744|2.353444|2.263840|2.489836|2.987736|3.209461|5.273643|5.139008|10.417705|5.371327|13.425699|6.369251|8.376657|6.930076|4.483571|3.626608|3.603715|4.553043|6.740235|8.873457|17.766095|8.992057|5.656828|4.990893|5.657039|27.490222|13.450285|3.281040|3.217318|2.350227|0.074479|0.088815|0.074055|0.080160|0.069253|0.059445|0.064675|0.088395|0.138235|0.118623|0.116334|0.112804|0.085073|0.097684|0.094803|0.085245|0.114116|0.122753|0.241997|0.164682|0.500000| |2.430442|2.819866|0.088457|2.528943|2.405452|2.115556|2.015307|2.138917|2.442508|2.631075|4.089225|3.499626|6.750322|3.480830|7.151134|3.781253|5.775040|4.067815|3.203374|2.633766|2.571258|2.948643|3.824378|5.625328|8.947348|17.720177|8.937752|5.690748|4.967983|31.629320|12.325010|2.993606|3.035008|2.138284|0.063658|0.069925|0.061089|0.074705|0.062498|0.054872|0.055792|0.069536|0.098097|0.081328|0.088320|0.085853|0.065612|0.070528|0.070447|0.062910|0.077137|0.078894|0.118705|0.105819|0.217824|0.500000| |1.889100|2.138784|0.064253|1.999904|1.967304|1.798105|1.758844|1.867675|2.060824|2.127384|3.127509|2.573175|4.708428|2.705257|5.434275|3.160034|5.142419|3.507524|3.072235|2.474647|2.330345|2.495312|3.111393|4.904496|5.627729|8.867632|17.749896|8.925581|5.629869|53.759519|11.104325|2.752119|2.746484|1.918657|0.049766|0.053733|0.048909|0.058719|0.050296|0.047029|0.049959|0.059144|0.078624|0.066152|0.088170|0.086160|0.063939|0.065248|0.065265|0.057219|0.064678|0.065816|0.088246|0.089531|0.124287|0.213993|0.500000| |1.890688|2.074709|0.059570|1.897037|1.957753|1.799993|1.834650|2.045732|2.289266|2.226658|3.219804|2.754848|4.850991|3.267019|7.118541|5.111806|8.554232|6.829535|7.618468|4.773027|3.887905|3.763992|4.771388|8.856416|5.647017|4.975817|5.664225|9.017407|17.807588|54.687350|11.542378|2.952932|2.747336|2.005764|0.048409|0.054952|0.050298|0.053181|0.047727|0.045970|0.056457|0.069792|0.093266|0.083488|0.234506|0.240439|0.123610|0.116864|0.108763|0.089594|0.089528|0.095469|0.114473|0.136872|0.123735|0.107915|0.124780|0.500000| |2.548227|2.615883|0.063821|2.963616|3.685952|4.697310|5.937318|4.985314|3.800546|3.413342|3.764605|2.384501|3.746358|2.366191|3.591177|1.914114|3.604783|1.659132|1.569421|1.582304|1.511911|1.593820|1.579407|1.589298|1.606521|1.519213|1.430541|1.419975|1.489903|10.485401|60.715928|13.293422|10.352318|25.901069|0.066114|0.064458|0.080025|0.075166|0.082717|0.127347|0.141629|0.093274|0.068426|0.069656|0.040086|0.044618|0.041639|0.047892|0.038769|0.041887|0.042138|0.048360|0.045056|0.040311|0.046569|0.042004|0.037941|0.040516|0.500000| 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