Version2.0 2020-05-17T07:33:41Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 26-Jan-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)C[C@H]1[C@H]2[C@H](C(=O)N(C2=O)CCc3ccc(c(c3)OC)OC)[C@@]4([NH2+]1)c5cc(ccc5NC4=O)F C16022249 RHF 6-31G(d) (6D,7F) CC(C)C[C@H]1[C@H]2[C@H](C(=O)N(C2=O)CCc3ccc(c(c3)OC)OC)[C@@]4([NH2+]1)c5cc(ccc5NC4=O)F C01[X(C27H31F1N3O5)] 195 C1 602 COc1cc(CCN2C(=O)[C@@H]3[C@H](C2=O)[C@]2([NH2+][C@H]3CC(C)C)C(=O)Nc3c2cc(F)cc3)ccc1OC COc1cc(CCN2C(=O)[C@@H]3[C@H](C2=O)[C@]2([NH2+][C@H]3CC(C)C)C(=O)Nc3c2cc(F)cc3)ccc1OC COc1ccc(CCN2C(=O)[C@H]3[C@H](CC(C)C)[NH2+][C@@]4([C@H]3C2=O)C(=O)Nc5ccc(F)cc45)cc1OC InChIKey=IOCAYCTUXKSDNB-JVGMMHMTSA-O InChI=1S/C27H30FN3O5/c1-14(2)11-19-22-23(27(30-19)17-13-16(28)6-7-18(17)29-26(27)34)25(33)31(24(22)32)10-9-15-5-8-20(35-3)21(12-15)36-4/h5-8,12-14,19,22-23,30H,9-11H2,1-4H3,(H,29,34)/p+1/t19-,22-,23+,27-/m0/s1 InChI=1/C27H30FN3O5/c1-14(2)11-19-22-23(27(30-19)17-13-16(28)6-7-18(17)29-26(27)34)25(33)31(24(22)32)10-9-15-5-8-20(35-3)21(12-15)36-4/h5-8,12-14,19,22-23,30H,9-11H2,1-4H3,(H,29,34)/p+1/t19-,22-,23+,27-/m0/s1/fC27H31FN3O5/h29-30H/q+1 CC(C)C[C@H]1[C@H]2[C@H](C(=O)N(C2=O)CCc3ccc(c(c3)OC)OC)[C@@]4([NH2+]1)c5cc(ccc5NC4=O)F C01[X(C27H31F1N3O5)] 195 C01 602 COc1cc(CCN2C(=O)[C@@H]3[C@H](C2=O)[C@]2([NH2+][C@H]3CC(C)C)C(=O)Nc3c2cc(F)cc3)ccc1OC COc1cc(CCN2C(=O)[C@@H]3[C@H](C2=O)[C@]2([NH2][C@H]3CC(C)C)C(=O)Nc3c2cc(F)cc3)ccc1OC COc1ccc(CCN2C(=O)[C@H]3[C@H](CC(C)C)[NH2][C@@]4([C@H]3C2=O)C(=O)Nc5ccc(F)cc45)cc1OC InChIKey=ZSLAUCIFXVHXTG-JVGMMHMTSA-N InChI=1S/C27H31FN3O5/c1-14(2)11-19-22-23(27(30-19)17-13-16(28)6-7-18(17)29-26(27)34)25(33)31(24(22)32)10-9-15-5-8-20(35-3)21(12-15)36-4/h5-8,12-14,19,22-23H,9-11,30H2,1-4H3,(H,29,34)/t19-,22-,23+,27-/m0/s1 InChI=1/C27H31FN3O5/c1-14(2)11-19-22-23(27(30-19)17-13-16(28)6-7-18(17)29-26(27)34)25(33)31(24(22)32)10-9-15-5-8-20(35-3)21(12-15)36-4/h5-8,12-14,19,22-23H,9-11,30H2,1-4H3,(H,29,34)/t19-,22-,23+,27-/m0/s1/f/h29H 3972.2534492471 -1677.4215319 1-A 22307.2521 131 471 602 |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| -26.42731 -20.70133 -20.68155 -20.67952 -20.64050 -20.63747 -15.86333 -15.75674 -15.74165 -11.52065 -11.49839 -11.49815 -11.48546 -11.46320 -11.45324 -11.43335 -11.41584 -11.40991 -11.40186 -11.39293 -11.38145 -11.37769 -11.37741 -11.36865 -11.36497 -11.35525 -11.35253 -11.33388 -11.33314 -11.32812 -11.32270 -11.31919 -11.30278 -11.29117 -11.29081 -11.28828 -1.74749 -1.57402 -1.55972 -1.53890 -1.50554 -1.48336 -1.45808 -1.44154 -1.40926 -1.30241 -1.27305 -1.25664 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3213.4639 3254.4305 3256.8950 3259.7413 3265.3118 3270.9214 3272.2505 3275.3874 3287.1350 3289.4403 3292.4734 3293.6148 3322.9045 3336.6798 3337.9519 3348.6983 3358.8002 3386.7171 3397.4511 3401.4787 3409.1896 3415.5692 3607.3777 3720.8386 3863.0228 4.7575 4.6191 6.6178 5.5178 3.8017 3.6965 4.2944 5.3419 4.6982 4.9114 3.3929 5.6840 4.0013 5.1093 6.7840 4.7445 3.9965 4.1401 3.5187 5.0050 3.8517 2.7711 2.3849 2.5265 1.2334 2.2145 3.9472 1.2680 1.6037 1.7447 2.8762 3.0015 6.2510 4.4693 3.2337 3.8686 4.0437 3.7443 4.8566 3.1700 5.0160 4.5558 3.6198 3.3424 3.2544 2.6634 3.2102 3.7937 2.0104 2.5062 4.4691 4.7352 4.9379 4.0542 5.5180 5.1974 5.8424 5.1131 5.2863 5.4902 4.1788 4.3826 3.7003 3.7380 3.5012 3.7028 3.4695 4.7666 2.8532 2.9992 3.8199 3.1134 2.9695 1.4677 1.4459 2.0246 1.5056 2.7956 1.6340 1.2370 2.2269 2.7053 2.6840 1.4112 1.5302 2.5285 1.3732 1.9943 3.5679 3.6940 3.5079 2.2116 3.0298 5.0093 4.1143 2.6347 3.6479 2.2299 2.6496 2.1513 2.1169 2.2439 2.0575 1.9490 1.2678 1.2679 1.8718 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12.00000 1.00783 12.00000 1.00783 12.00000 1.00783 12.00000 15.99491 14.00307 12.00000 15.99491 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 15.99491 12.00000 15.99491 12.00000 12.00000 14.00307 1.00783 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 15.99491 18.99840 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 10993.5183 32379.5652 37209.2879 0.99980 0.01938 -0.00563 -0.01952 0.99948 -0.02564 0.00513 0.02575 0.99966 1 0.00788 0.00267 0.00233 0.16416 0.05574 0.04850 12.43 22.18 28.44 37.29 48.20 61.37 68.76 80.76 86.40 102.54 110.70 122.06 137.72 161.04 187.87 205.26 243.05 254.19 291.28 295.70 315.04 329.17 343.62 345.53 353.92 370.48 387.65 401.24 422.54 436.90 447.75 464.84 493.32 535.43 560.72 573.42 582.96 610.11 623.56 638.64 652.16 661.37 670.12 695.07 722.02 728.82 747.28 762.01 797.14 832.79 862.32 908.64 936.36 939.31 952.81 976.52 991.19 1011.63 1015.81 1071.30 1124.09 1144.85 1153.73 1170.14 1176.52 1188.95 1204.45 1218.53 1232.39 1249.42 1285.88 1305.51 1321.80 1337.87 1370.63 1378.95 1411.74 1425.97 1432.82 1456.98 1472.05 1482.95 1495.21 1508.23 1512.49 1551.30 1570.49 1582.53 1604.36 1617.14 1630.23 1637.45 1648.58 1671.54 1681.76 1704.50 1720.92 1728.86 1748.54 1780.11 1786.62 1828.38 1836.13 1844.11 1861.65 1862.04 1868.33 1870.82 1877.05 1901.45 1907.05 1920.06 1936.14 1958.89 1974.33 2002.78 2011.34 2020.74 2036.97 2053.18 2064.72 2070.15 2087.07 2092.94 2098.57 2112.47 2129.99 2133.10 2157.59 2176.22 2187.05 2198.56 2209.07 2211.48 2231.47 2251.56 2254.18 2267.34 2278.53 2282.92 2336.81 2344.02 2345.81 2347.03 2347.53 2357.67 2359.47 2367.62 2374.00 2376.04 2376.45 2382.42 2386.10 2386.62 2404.70 2457.92 2577.96 2604.84 2607.14 2614.03 2638.28 2870.61 2905.13 2976.29 4522.75 4599.22 4603.17 4610.35 4615.93 4620.89 4623.46 4682.40 4685.95 4690.04 4698.06 4706.13 4708.04 4712.55 4729.45 4732.77 4737.13 4738.78 4780.92 4800.74 4802.57 4818.03 4832.56 4872.73 4888.17 4893.97 4905.06 4914.24 5190.21 5353.46 5558.03 0.596777 0.628363 0.629307 0.529120 -1676.824755 -1676.793169 -1676.792225 -1676.892412 3.360288D-04 MUNgauss RevisionA2.0 retrievium 17-May-2020 DUDE CC(C)C[C@H]1[C@H]2[C@H](C(=O)N(C2=O)CCc3ccc(c(c3)OC)OC)[C@@]4([NH2+]1)c5cc(ccc5NC4=O)F C16022249 RHF 6-31G(d) (6D,10F) C1 496.224775 |X|Y|Z| 126.431790 67.263422 42.400185 71.176123 24 6 7 21 3 |36.858105| |12.433608|36.858105| |7.557057|12.427218|36.858105| |7.608756|12.373274|7.445712|36.858105| |4.869585|7.317988|6.090911|12.498985|36.858105| |4.478214|6.700746|6.821150|8.834856|17.653277|0.500000| |3.744416|4.780678|4.165045|7.358132|12.405068|0.244274|36.858105| |3.836460|4.600959|3.825280|7.263424|8.783176|0.176706|17.591982|0.500000| |3.078069|3.831075|3.424330|5.057942|7.672040|0.175944|12.436417|0.242202|36.858105| |2.908725|3.477485|3.030641|4.496204|5.943261|0.134793|8.703677|0.224228|17.612748|0.500000| |2.571505|3.096821|2.935330|3.872434|5.364575|0.142238|7.869006|0.170123|12.494788|0.248321|36.858105| |2.242656|2.645586|2.535424|3.159841|4.120303|0.111390|5.335865|0.125809|7.897284|0.194155|16.089628|73.516695| |2.638689|3.156214|3.068002|4.012842|5.420717|0.151640|8.106846|0.176136|8.107699|0.171877|13.852353|14.812157|53.358707| |3.186210|3.893579|3.729424|5.349744|7.454004|0.204390|12.514090|0.249134|7.897188|0.165755|8.276701|9.857925|18.897700|36.858105| |3.249811|3.869055|3.850208|5.165169|6.258750|0.184310|7.908133|0.190469|5.350496|0.122522|5.543843|7.493908|11.341920|16.051660|73.516695| |2.256666|2.615751|2.618401|3.157758|3.921894|0.113746|5.054019|0.122158|5.050758|0.119686|7.611171|11.695535|17.629713|7.622086|11.700104|36.858105| |2.147899|2.504515|2.608911|2.897007|3.576269|0.109703|4.138757|0.098482|4.160913|0.097829|5.695890|9.483602|10.379617|5.707506|9.590699|12.446008|36.858105| |1.864823|2.115856|2.210081|2.389368|2.805253|0.084483|3.164290|0.078957|3.168722|0.078187|4.066873|7.166766|6.774327|4.085547|7.259555|7.586521|12.593186|36.858105| |1.673348|1.883050|1.950672|2.098620|2.441934|0.072341|2.733666|0.069072|2.842025|0.071811|3.623622|6.793575|5.541195|3.328965|5.748874|5.648122|7.571408|13.882071|36.858105| |1.509829|1.672604|1.733449|1.841239|2.088710|0.061410|2.304381|0.059424|2.365148|0.060919|2.887938|5.376775|4.347490|2.737910|4.831272|4.162262|5.008964|7.916726|13.630528|36.858105| |1.489233|1.634156|1.702683|1.792575|1.998779|0.058873|2.187087|0.056997|2.183728|0.056350|2.598418|4.695009|3.998569|2.613641|4.757200|3.773455|4.418330|6.805325|7.904849|13.855797|36.858105| |1.623244|1.783626|1.872096|1.968770|2.188999|0.065060|2.395229|0.062326|2.324815|0.059331|2.751029|4.813097|4.406404|2.945454|5.540006|4.230831|5.016166|7.868278|6.859768|7.924773|13.479698|36.858105| |1.827187|2.040144|2.148497|2.286535|2.597959|0.078237|2.879244|0.073520|2.765371|0.069095|3.354398|5.739921|5.641244|3.707037|7.032335|5.794096|7.546987|13.577130|7.975598|6.903236|7.908177|13.852537|36.858105| |1.558321|1.688685|1.777042|1.847099|2.008460|0.059455|2.168171|0.057226|2.071529|0.053325|2.378277|4.117992|3.775863|2.620599|5.030577|3.438310|3.861140|5.178123|4.627973|5.305016|8.174075|14.197912|7.905483|73.516695| |1.661640|1.790091|1.896459|1.957278|2.097983|0.062354|2.244316|0.059570|2.088470|0.053574|2.350488|3.978946|3.789823|2.730313|5.425120|3.353812|3.678053|4.502337|3.799742|3.990954|5.243700|8.030983|6.734707|24.220708|36.858105| |1.358840|1.474417|1.533834|1.601623|1.758094|0.051441|1.903899|0.050193|1.897130|0.049527|2.204407|3.985861|3.329731|2.224002|4.061790|3.005978|3.372315|4.604351|5.190453|7.898846|14.206772|8.171670|5.299901|13.171044|4.802226|73.516695| |1.257370|1.361123|1.408846|1.470479|1.612397|0.046880|1.740882|0.046010|1.761102|0.046385|2.036165|3.743241|2.997057|1.992510|3.582540|2.643302|2.920142|3.784278|4.507842|6.732979|8.037775|5.243230|3.988319|8.533093|3.552929|24.192185|36.858105| |3.200008|4.156659|3.763267|5.016628|7.744878|0.188424|7.690327|0.161939|12.261848|0.245003|7.319594|10.680316|7.457361|5.506857|7.566053|3.955914|3.646052|2.837782|2.591061|2.178170|2.007908|2.118425|2.486145|3.376508|1.912340|3.128144|1.647164|36.858105| |4.254765|6.116296|5.074591|7.553856|12.549042|0.254037|8.041569|0.176547|8.051702|0.181748|5.194485|7.543746|6.244838|5.283121|7.763920|3.428551|3.196163|2.549574|2.294933|1.968435|1.855400|1.985402|2.315781|3.224533|1.860808|2.919411|1.528709|12.638651|53.358707| |4.405765|5.971163|4.562637|7.289832|9.089288|0.181349|6.937224|0.174282|7.043180|0.183798|4.559305|6.825130|5.447408|4.554438|6.836424|3.065300|2.809441|2.299378|2.094513|1.819600|1.721211|1.832042|2.108480|2.998303|1.730147|2.731747|1.437731|9.284418|25.535601|0.500000| |4.319546|6.397111|5.637595|6.583613|9.006525|0.229678|5.839585|0.134455|5.830794|0.137168|4.299907|6.547457|5.310278|4.388954|6.799980|3.067397|2.974425|2.409341|2.182249|1.885043|1.780687|1.900523|2.200773|3.100451|1.790083|2.815233|1.478090|9.062044|25.684654|0.325428|0.500000| |2.800258|3.585532|3.536666|4.003024|5.725055|0.166782|5.430323|0.118097|7.178411|0.154607|6.390929|10.425100|6.889788|4.754967|6.883042|3.958496|3.983051|3.066144|2.827489|2.343914|2.129867|2.228003|2.624550|3.509890|1.966210|3.295434|1.740042|12.617782|10.227545|0.159665|0.202663|36.858105| |2.709205|3.458613|3.657300|3.777945|5.260662|0.173412|4.880985|0.106367|5.551573|0.120536|5.662921|9.190949|6.991439|4.831022|7.328372|4.259895|4.710031|3.520713|3.172455|2.588288|2.352609|2.487300|2.983775|3.882790|2.176847|3.597419|1.880108|7.208779|7.844986|0.124409|0.163850|13.779092|36.858105| |2.320248|2.851352|3.065482|2.995466|3.825956|0.121909|3.618283|0.083502|4.069009|0.094925|4.328881|7.650538|5.441383|3.678020|5.847671|3.634465|4.238351|3.381922|3.174187|2.617959|2.351049|2.432936|2.854036|3.789707|2.092523|3.615379|1.912220|4.970710|5.676535|0.096562|0.121939|8.064105|13.792569|36.858105| |2.099967|2.524865|2.642320|2.622981|3.242589|0.098036|3.117675|0.074130|3.631331|0.088694|3.804302|7.101959|4.584446|3.070468|4.871421|3.094555|3.461186|2.901854|2.841761|2.398058|2.136536|2.161158|2.465810|3.390152|1.854317|3.336177|1.798154|4.492130|5.029851|0.089177|0.108208|6.907728|7.875218|13.803400|36.858105| |2.139022|2.568728|2.590778|2.690976|3.335814|0.096541|3.242665|0.077708|3.982383|0.099801|3.996292|7.613946|4.549695|3.046892|4.728932|2.970517|3.135851|2.629078|2.584198|2.199019|1.964977|1.983755|2.249906|3.132467|1.718298|3.090532|1.674263|5.202980|5.500337|0.099575|0.116956|7.884504|6.768847|7.944834|13.728151|36.858105| |2.437201|2.995320|2.928016|3.225534|4.184656|0.117428|4.075302|0.095356|5.377566|0.131799|5.000028|9.180420|5.360553|3.621211|5.424292|3.288555|3.318342|2.694516|2.584678|2.181698|1.965855|2.012943|2.312506|3.184083|1.763929|3.078815|1.652290|8.146127|7.473693|0.132101|0.154047|13.715061|7.917947|6.992806|8.041192|13.832045|36.858105| |2.454850|2.964127|2.767952|3.218404|4.037520|0.106230|4.018440|0.097855|5.491709|0.148404|4.681911|8.587908|4.915128|3.384518|5.052678|2.981534|2.872085|2.383316|2.297012|1.972326|1.792115|1.832159|2.080378|2.927988|1.627658|2.835694|1.528619|8.170365|7.582776|0.147212|0.149413|8.312342|5.296643|4.627606|5.124857|7.612512|13.551137|53.358707| |2.838109|3.485368|3.102969|3.947198|5.087121|0.124682|5.111465|0.124449|7.422264|0.209232|5.310836|8.944919|5.485487|3.928896|5.720610|3.162915|2.930352|2.400204|2.265476|1.945344|1.788483|1.853314|2.119797|2.977476|1.673064|2.826895|1.510650|12.316923|10.593042|0.219112|0.186148|7.990896|5.072641|4.092097|4.126829|5.281895|8.371446|19.312645|36.858105| |2.903188|3.454921|2.956388|3.912876|4.662101|0.110060|4.721017|0.123856|6.251952|0.200829|4.463902|7.468711|4.828146|3.561137|5.293708|2.829440|2.577228|2.157959|2.040616|1.779227|1.651852|1.713037|1.939109|2.780920|1.570007|2.634584|1.410553|7.924892|9.158696|0.226211|0.159773|5.409073|3.915240|3.269795|3.291097|4.030116|5.544124|11.275233|15.994714|73.516695| |2.186535|2.639608|2.931646|2.733229|3.357873|0.109059|3.174850|0.074718|3.373817|0.079997|3.656652|6.410324|4.916693|3.374839|5.616187|3.479764|4.320179|3.580129|3.338060|2.776089|2.514220|2.614927|3.062086|4.070893|2.245002|3.857270|2.026510|3.844814|4.691744|0.081444|0.100683|5.341191|8.202344|14.413405|8.173791|5.294899|4.708484|4.769065|3.217841|4.786388|97.533100| |17.579649|8.794056|6.918587|5.511791|4.014766|0.106456|3.157337|0.088369|2.701082|0.071169|2.299632|3.626436|3.188125|2.752863|4.985420|2.038189|1.970353|1.729429|1.564096|1.419990|1.401714|1.520372|1.697328|2.604213|1.558447|2.285906|1.194450|2.868916|5.047673|0.105992|0.108427|2.583748|2.518561|2.203140|2.012706|2.043042|2.291550|3.131430|2.602962|4.718459|4.706682|0.500000| |17.556925|8.743978|5.481387|6.967126|4.567198|0.111504|3.691224|0.109016|3.080827|0.083140|2.539279|3.953917|3.493804|3.065312|5.451040|2.186790|2.049304|1.785952|1.614465|1.459750|1.435850|1.555810|1.743178|2.652984|1.582549|2.334764|1.220231|3.156751|5.643104|0.125744|0.113429|2.694622|2.545877|2.185895|2.007364|2.075815|2.381191|3.343367|2.880578|5.397139|4.590418|0.301987|0.500000| |17.547247|8.777947|6.847668|6.866404|4.509721|0.118291|3.625563|0.104454|2.916356|0.076288|2.499086|3.865585|3.579687|3.215882|6.044478|2.280327|2.166941|1.895217|1.688086|1.529624|1.522185|1.673381|1.882493|2.878187|1.745333|2.472638|1.279959|2.933199|5.097017|0.105171|0.103445|2.601987|2.568576|2.211989|1.987396|2.000760|2.256611|3.061111|2.572799|4.637385|4.761637|0.301837|0.301311|0.500000| |8.961899|17.448607|8.888542|8.842058|6.674446|0.166140|4.465015|0.118030|3.846298|0.098388|3.050403|4.706653|4.075661|3.549714|6.045378|2.478289|2.383152|2.016623|1.819352|1.615668|1.565373|1.689022|1.921174|2.829542|1.668356|2.515674|1.316273|4.444051|9.297834|0.194952|0.215731|3.798099|3.531214|2.927809|2.645445|2.746855|3.239275|4.447938|3.873773|6.900986|5.973064|0.215395|0.213682|0.174028|0.500000| |5.464337|8.660801|17.519083|6.617356|6.612064|0.232364|4.400600|0.106861|3.720586|0.088977|3.213490|4.928591|4.537851|3.987331|7.147251|2.825757|2.877957|2.395111|2.108593|1.853204|1.804650|1.979708|2.293804|3.302805|1.966162|2.868488|1.482094|4.268573|7.773297|0.133265|0.186523|4.196945|4.495496|3.686178|3.085623|2.976271|3.369414|4.191465|3.401607|5.566566|7.884902|0.141615|0.121950|0.138839|0.211992|0.500000| |7.012449|8.807209|17.581402|5.453261|4.606295|0.138937|3.391398|0.088134|2.915633|0.073207|2.541813|3.992773|3.570993|3.079905|5.633014|2.291265|2.305742|1.993122|1.781795|1.600330|1.575391|1.720033|1.946438|2.922582|1.750462|2.544698|1.321881|3.234202|5.694630|0.108069|0.131797|3.107270|3.205768|2.793762|2.459975|2.410156|2.667120|3.451619|2.785207|4.763079|6.080022|0.211450|0.142194|0.173029|0.212120|0.303611|0.500000| |6.764340|8.768416|17.547674|6.810359|5.548490|0.176344|4.064766|0.105111|3.247342|0.079823|2.869178|4.388636|4.226040|3.849283|7.456866|2.696747|2.690756|2.295767|2.000531|1.784493|1.772611|1.974644|2.272903|3.359800|2.047251|2.838161|1.454445|3.396420|5.894304|0.108722|0.126281|3.215460|3.406375|2.883246|2.465232|2.386127|2.663949|3.411596|2.790162|4.732215|6.358012|0.167332|0.138772|0.200340|0.173244|0.301627|0.302032|0.500000| |6.919909|8.814815|6.793529|17.544286|9.075256|0.214483|6.826732|0.195926|4.520018|0.111890|3.705167|5.368213|5.538372|5.677580|10.745078|3.277019|2.985769|2.481763|2.148392|1.892954|1.865373|2.077743|2.422563|3.493598|2.113886|2.961726|1.516377|4.211246|7.574846|0.146563|0.138060|3.526371|3.467539|2.799590|2.432026|2.449214|2.865751|3.833725|3.349308|5.864669|5.899927|0.140869|0.171476|0.205118|0.173406|0.163570|0.140194|0.203068|0.500000| |7.102675|8.804419|5.457304|17.504751|8.921756|0.174153|6.882186|0.217474|5.004274|0.132461|3.730961|5.482409|5.098559|4.796236|7.991757|2.959224|2.655533|2.221966|1.978642|1.747285|1.697567|1.847943|2.122601|3.088649|1.829833|2.711789|1.408993|4.790850|9.355917|0.214817|0.159981|3.675851|3.343374|2.705091|2.434015|2.550705|3.072874|4.345822|4.018267|7.485407|5.512912|0.143789|0.215261|0.173757|0.211880|0.136659|0.122911|0.140007|0.303941|0.500000| |2.260578|2.571965|2.572214|3.118400|3.705235|0.106570|4.730844|0.120380|4.368633|0.106908|5.782366|8.837352|12.580881|7.300681|12.925635|17.646505|8.800214|6.907441|5.037881|3.985987|3.831167|4.512163|6.213379|6.681650|3.777087|5.477553|2.653909|3.447661|4.275150|0.079303|0.078350|3.357624|3.586842|3.099164|2.666911|2.567111|2.826627|3.561339|2.808702|4.582759|6.815853|0.056486|0.060860|0.064475|0.066639|0.075606|0.062555|0.075027|0.092723|0.081431|0.500000| |2.058901|2.354720|2.326820|2.805462|3.418038|0.096499|4.378675|0.109643|4.709575|0.117671|7.296986|13.030941|12.577707|5.784159|8.806954|17.649136|8.810849|6.863600|5.923432|4.366030|3.800128|4.022654|5.128387|5.786759|3.076633|5.412722|2.735840|3.696247|4.255885|0.079319|0.077858|3.687496|3.816147|3.367053|2.985824|2.921296|3.204172|4.026844|3.094769|4.955537|7.159660|0.051997|0.056063|0.057425|0.062879|0.069290|0.057340|0.065817|0.079641|0.074757|0.301600|0.500000| |2.102092|2.473903|2.574031|2.822366|3.549141|0.108908|4.022517|0.094274|4.326415|0.101009|6.061038|10.857912|9.466108|5.106504|8.124811|8.883658|17.560010|8.898945|7.192836|4.726485|3.965127|4.198142|5.633900|5.884288|3.114045|5.519914|2.785071|3.956201|4.524986|0.080486|0.086730|4.598715|5.601298|5.209807|4.196572|3.714470|3.858844|4.383959|3.189469|4.867434|11.690304|0.053923|0.055828|0.058093|0.066589|0.080065|0.063607|0.072214|0.078699|0.072119|0.173684|0.213381|0.500000| |2.328375|2.745342|2.937851|3.160565|3.905646|0.125370|4.320859|0.101325|4.084656|0.094391|5.139499|8.094053|9.538465|6.112103|11.092047|8.878829|17.540494|8.884595|5.709779|4.225745|3.970834|4.721600|7.093108|6.783841|3.822396|5.554925|2.685221|3.683661|4.582000|0.080953|0.088070|4.038450|5.004764|4.397415|3.449569|3.075121|3.267842|3.821817|2.894914|4.533638|10.453062|0.059231|0.060801|0.065691|0.071510|0.091001|0.071369|0.085478|0.091748|0.078438|0.211466|0.173750|0.302019|0.500000| |1.663808|1.882734|1.936712|2.096181|2.468073|0.072643|2.769402|0.069495|2.984586|0.075632|3.878849|7.647257|5.616870|3.285216|5.488663|5.450037|6.979550|8.941885|17.704260|8.916380|5.647988|4.944312|5.647377|6.523568|3.136761|7.456600|3.916901|2.746833|3.230620|0.060148|0.062670|3.048917|3.385951|3.447716|3.151321|2.872009|2.838550|3.406110|2.426887|3.847235|7.972354|0.043256|0.044763|0.046214|0.051058|0.058481|0.049207|0.054496|0.058777|0.055169|0.127476|0.167957|0.216032|0.144459|0.500000| |1.409600|1.555082|1.604321|1.700317|1.919739|0.056028|2.106605|0.054615|2.192419|0.057121|2.647196|5.023365|3.859595|2.440936|4.259943|3.544449|4.097642|5.658729|8.926461|17.765086|8.952361|5.630640|4.971610|7.600199|3.329348|12.565273|7.493126|2.039981|2.500164|0.047472|0.049031|2.198840|2.395782|2.458347|2.306295|2.128432|2.087686|2.584019|1.854438|3.024149|5.821105|0.036980|0.038003|0.039503|0.042016|0.047565|0.041402|0.045571|0.048206|0.045112|0.093400|0.105681|0.112606|0.097559|0.217153|0.500000| |1.974554|2.204640|2.340887|2.483958|2.797621|0.085071|3.078693|0.078715|2.848135|0.070597|3.370580|5.568338|5.857858|4.067796|8.168202|5.752329|7.047729|8.899842|5.675813|4.969572|5.628061|8.969815|17.740904|12.624417|7.531366|7.604939|3.330049|2.549682|3.304220|0.061197|0.064008|2.654764|3.028982|2.831106|2.412925|2.209133|2.300121|2.826150|2.144821|3.502757|6.825790|0.050694|0.051972|0.057079|0.056899|0.069069|0.058467|0.069928|0.074424|0.063386|0.183786|0.132834|0.143348|0.212740|0.124319|0.107873|0.500000| |1.556821|1.658061|1.753447|1.795348|1.897859|0.056025|2.012491|0.053920|1.876546|0.048577|2.080486|3.538338|3.290774|2.392221|4.722055|2.831880|3.044152|3.610806|3.190839|3.418943|4.413667|5.896097|4.911148|17.027494|17.655807|7.797007|3.352943|1.730797|2.307552|0.044104|0.045484|1.772211|1.944142|1.879071|1.683678|1.567853|1.604799|2.029617|1.531321|2.571460|4.523308|0.040774|0.041272|0.045516|0.043000|0.050121|0.045348|0.052550|0.053788|0.046886|0.087544|0.073351|0.073594|0.087493|0.075149|0.082125|0.146859|0.500000| |1.746288|1.893497|2.038929|2.054657|2.207266|0.066619|2.321334|0.060940|2.144520|0.054442|2.396935|4.025758|3.876771|2.831035|5.690998|3.375131|3.846221|4.569207|3.751128|3.799370|4.750225|7.046794|6.728671|16.443083|17.553907|7.532740|3.243674|1.987625|2.650691|0.049916|0.052398|2.063881|2.322329|2.237704|1.957803|1.794499|1.837327|2.286449|1.723987|2.860786|5.489538|0.045594|0.045796|0.051011|0.048846|0.059055|0.052250|0.061538|0.061738|0.052747|0.103686|0.084085|0.090573|0.116000|0.086808|0.088220|0.226034|0.299970|0.500000| |1.754860|1.887203|1.979223|2.093922|2.238324|0.066012|2.433303|0.065142|2.232893|0.057356|2.516334|4.207071|4.138537|3.010972|6.091444|3.690256|3.855255|4.564471|3.745259|3.792558|4.742107|7.039789|6.727399|16.441032|17.552224|7.519809|3.237355|2.008336|2.666763|0.050718|0.051867|2.033385|2.229539|2.104930|1.861724|1.742375|1.810949|2.290183|1.747641|2.927300|5.000688|0.045353|0.046571|0.051459|0.048565|0.056645|0.050347|0.059628|0.063468|0.054529|0.120825|0.093085|0.088711|0.110951|0.086665|0.088051|0.226072|0.299994|0.298733|0.500000| |1.251055|1.354092|1.389888|1.470977|1.616859|0.046660|1.763454|0.046774|1.799750|0.047724|2.095326|3.892858|3.059835|2.011782|3.580442|2.708059|2.916402|3.733754|4.570541|6.729921|7.051739|4.746643|3.793709|7.521952|3.238825|16.438098|17.558316|1.670473|2.095058|0.040353|0.041135|1.754278|1.874586|1.896763|1.796728|1.689908|1.673845|2.121262|1.540597|2.562551|4.458226|0.032938|0.033879|0.035298|0.036463|0.040566|0.036157|0.039718|0.042025|0.039371|0.075229|0.079711|0.077667|0.073138|0.113194|0.225048|0.088113|0.084423|0.081788|0.084864|0.500000| |1.248919|1.357438|1.411257|1.458278|1.606119|0.046907|1.720472|0.045173|1.753134|0.046019|2.025316|3.747474|2.950781|1.956783|3.496929|2.576948|2.913505|3.736455|4.572833|6.730529|7.054477|4.751386|3.797099|7.531973|3.244452|16.438966|17.558748|1.659013|2.088265|0.039964|0.041419|1.774100|1.929260|1.992288|1.882262|1.736995|1.694582|2.118287|1.524564|2.518074|4.794699|0.033055|0.033601|0.035183|0.036605|0.041456|0.036872|0.040305|0.041547|0.038711|0.070546|0.073840|0.078904|0.074584|0.113265|0.225008|0.088225|0.084570|0.085188|0.081768|0.298739|0.500000| |1.190740|1.280076|1.324865|1.375771|1.493867|0.043324|1.602945|0.042630|1.612012|0.042650|1.837433|3.356667|2.696865|1.819051|3.289432|2.335109|2.541140|3.179669|3.614875|4.910148|5.898753|4.411454|3.416424|7.789417|3.351924|17.018466|17.656890|1.513051|1.927729|0.037161|0.038131|1.589221|1.708943|1.735331|1.637868|1.531463|1.512874|1.916477|1.394713|2.328598|4.133523|0.031508|0.032122|0.033738|0.034369|0.038521|0.034681|0.038051|0.039471|0.036696|0.065747|0.066655|0.067289|0.066049|0.089108|0.146338|0.082147|0.091154|0.084525|0.084376|0.299948|0.299939|0.500000| |2.909385|3.763872|4.117848|4.190982|5.965697|0.219376|5.415318|0.115202|5.499413|0.117016|5.673225|8.614166|7.863252|5.763507|8.965166|4.753729|5.388490|3.868272|3.325248|2.699053|2.494871|2.706710|3.327924|4.228452|2.406971|3.784427|1.946365|6.354123|7.759497|0.121769|0.158601|8.774041|17.741853|8.992037|5.644784|4.900993|5.600923|5.809887|4.363390|6.304591|16.891851|0.074299|0.074724|0.077847|0.102648|0.143349|0.097384|0.109395|0.109766|0.099419|0.112556|0.112032|0.168131|0.172832|0.095498|0.068133|0.096362|0.059163|0.072211|0.068832|0.053564|0.055138|0.049152|0.500000| |1.902752|2.244344|2.366772|2.303015|2.760369|0.083159|2.665424|0.064655|3.027764|0.075558|3.200335|6.025658|3.959653|2.663814|4.316830|2.763420|3.130852|2.731990|2.733293|2.350038|2.091514|2.089750|2.343376|3.290742|1.787711|3.295013|1.792931|3.585481|4.178437|0.075763|0.089887|4.973082|5.641762|8.985538|17.748467|8.875283|5.680527|5.600659|3.386657|4.992537|16.775003|0.051105|0.050536|0.050310|0.065003|0.075734|0.062129|0.061897|0.060007|0.059665|0.067103|0.074759|0.104078|0.086408|0.084235|0.063542|0.063160|0.045332|0.052437|0.049388|0.049570|0.052637|0.045449|0.124968|0.500000| |1.954708|2.299108|2.300353|2.385625|2.863332|0.081500|2.806790|0.068995|3.404553|0.088589|3.408328|6.603156|3.918703|2.635502|4.141138|2.608780|2.725074|2.354428|2.355552|2.041484|1.825567|1.823840|2.035506|2.898402|1.583799|2.902729|1.589115|4.253850|4.675781|0.087777|0.099077|5.612240|4.899632|5.647520|8.890887|17.742300|8.883910|9.216141|4.647871|6.634303|9.589922|0.052251|0.053113|0.050797|0.068545|0.072029|0.060270|0.059032|0.060585|0.063745|0.063497|0.072436|0.088132|0.073648|0.072828|0.055594|0.055244|0.040419|0.045694|0.044503|0.044694|0.045886|0.040542|0.106677|0.213054|0.500000| 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