Version2.0 2020-01-25T02:15:23Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 16-Oct-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CCOc1ccc(cc1OC)[C@H]2CC3=C([C@@H](Nc4ccccc4N3)c5c[nH]c6c5cccc6)C(=O)C2 C21229089 RHF 6-31G(d) (6D,7F) CCOc1ccc(cc1OC)[C@H]2CC3=C([C@@H](Nc4ccccc4N3)c5c[nH]c6c5cccc6)C(=O)C2 C01[X(C30H29N3O3)] 189 C1 598 CCOc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@H]2c1c[nH]c2c1cccc2 CCOc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@H]2c1c[nH]c2c1cccc2 CCOc1ccc(cc1OC)[C@@H]2CC(=O)C3=C(C2)Nc4ccccc4N[C@H]3c5c[nH]c6ccccc56 InChIKey=XJHYMMJWCAJGGJ-ADSBAMQRSA-N InChI=1S/C30H29N3O3/c1-3-36-27-13-12-18(16-28(27)35-2)19-14-25-29(26(34)15-19)30(33-24-11-7-6-10-23(24)32-25)21-17-31-22-9-5-4-8-20(21)22/h4-13,16-17,19,30-33H,3,14-15H2,1-2H3/t19-,30-/m0/s1 InChI=1/C30H29N3O3/c1-3-36-27-13-12-18(16-28(27)35-2)19-14-25-29(26(34)15-19)30(33-24-11-7-6-10-23(24)32-25)21-17-31-22-9-5-4-8-20(21)22/h4-13,16-17,19,30-33H,3,14-15H2,1-2H3/t19-,30-/m0/s1 CCOc1ccc(cc1OC)[C@H]2CC3=C([C@@H](Nc4ccccc4N3)c5c[nH]c6c5cccc6)C(=O)C2 C01[X(C30H29N3O3)] 189 C01 598 CCOc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@H]2c1c[nH]c2c1cccc2 CCOc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1ccccc1N[C@H]2c1c[nH]c2c1cccc2 CCOc1ccc(cc1OC)[C@@H]2CC(=O)C3=C(C2)Nc4ccccc4N[C@H]3c5c[nH]c6ccccc56 InChIKey=XJHYMMJWCAJGGJ-ADSBAMQRSA-N InChI=1S/C30H29N3O3/c1-3-36-27-13-12-18(16-28(27)35-2)19-14-25-29(26(34)15-19)30(33-24-11-7-6-10-23(24)32-25)21-17-31-22-9-5-4-8-20(21)22/h4-13,16-17,19,30-33H,3,14-15H2,1-2H3/t19-,30-/m0/s1 InChI=1/C30H29N3O3/c1-3-36-27-13-12-18(16-28(27)35-2)19-14-25-29(26(34)15-19)30(33-24-11-7-6-10-23(24)32-25)21-17-31-22-9-5-4-8-20(21)22/h4-13,16-17,19,30-33H,3,14-15H2,1-2H3/t19-,30-/m0/s1 3635.2305257721 -1540.8452381 1-A 25836.1520 127 471 598 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906.3177 934.5315 951.0400 957.1240 959.6500 961.3959 965.7001 986.5876 988.5617 1003.8628 1016.5444 1049.5383 1051.4545 1052.7605 1055.6940 1077.1583 1095.4802 1096.2771 1114.3208 1137.9547 1152.1628 1162.8393 1166.4817 1172.1964 1186.3940 1194.2411 1211.3314 1220.3757 1227.1805 1231.4326 1235.9265 1243.1543 1248.6286 1249.3618 1271.8471 1283.9901 1293.9976 1300.8468 1307.0342 1323.7544 1332.8916 1338.8362 1342.2199 1363.9933 1367.0032 1383.2375 1388.3006 1399.4953 1403.5995 1419.9324 1420.8905 1427.1118 1430.8293 1432.4202 1447.2553 1453.0315 1468.3914 1482.7981 1509.7779 1518.9600 1528.3130 1545.3449 1553.7373 1581.7414 1586.4469 1596.4793 1600.4071 1613.6554 1625.5325 1628.5643 1629.8638 1640.0606 1644.8788 1651.7667 1658.6783 1660.5071 1662.8343 1679.5818 1689.2133 1709.6634 1716.0054 1746.2838 1780.9244 1788.0458 1795.4085 1811.4641 1813.6004 1821.7222 1834.0656 1946.4803 3196.1857 3198.8805 3200.8459 3204.3321 3213.4381 3216.5598 3233.9983 3241.6274 3265.2022 3277.4110 3282.1179 3291.5964 3297.8008 3327.7108 3342.7817 3347.9348 3355.5706 3356.1563 3364.0825 3368.7388 3371.8547 3382.7103 3388.9571 3395.7619 3405.6982 3448.8731 3808.7506 3874.8511 3926.3158 4.5050 5.4866 5.0372 4.4576 4.6094 4.9752 4.4861 4.4603 3.3611 5.8396 1.8785 3.0889 4.2755 4.4744 4.6819 5.3138 4.5918 5.2503 3.5428 3.5129 2.9168 2.4533 1.1844 3.4516 3.0138 2.7611 2.8997 2.9171 3.3291 3.7415 2.8435 3.5019 4.1755 4.2346 4.3409 1.5822 2.2468 3.1112 2.8214 3.3658 4.1199 3.5826 4.0702 5.3259 4.7896 5.7810 4.4463 4.6212 3.1814 4.8916 4.3079 4.8606 3.5242 5.4979 4.3257 4.1994 2.8953 3.9402 4.5666 3.7032 3.8794 4.3701 4.0043 1.3502 1.5124 3.4438 4.1063 3.5926 2.0373 1.6407 2.4400 1.4131 3.6780 2.3478 1.5035 1.5043 1.5585 1.8450 2.0285 3.5238 2.4275 1.3899 1.7240 1.9533 1.3672 4.9226 1.3010 1.2933 2.2025 3.9146 2.6949 3.0839 2.9190 3.5780 3.5428 1.6823 3.1705 2.8555 2.0779 3.1485 1.7184 1.5586 1.9891 2.1085 1.3696 1.6253 1.2686 1.5177 2.3136 2.0821 1.5034 2.1582 2.3726 1.9705 2.2016 1.5911 2.6086 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28.8955 2.8274 6.8178 28.3306 2.5146 4.1164 1.3943 11.5672 4.0697 2.6239 21.9951 3.7539 60.7829 29.4236 2.6711 3.2389 7.6567 4.6531 2.6908 12.1404 0.6897 5.7232 12.8164 35.1822 0.4453 4.8803 1.6351 2.7341 2.7479 10.6615 9.5400 11.2524 0.1584 26.0986 5.8586 13.2689 9.6399 6.6703 10.5235 4.1314 69.3028 56.4171 21.9995 23.2523 46.7123 32.3716 37.6055 9.2809 23.8371 3.0011 23.3708 0.0702 7.1339 4.3247 7.3261 18.4365 2.1554 9.0573 6.2932 6.7455 11.0796 2.0947 23.0364 0.1362 0.0869 4.6420 8.9618 13.3075 42.6527 15.6948 37.0136 13.9060 40.6389 20.3423 18.9990 14.5629 48.5101 7.9301 4.6829 4.3724 2.6353 34.0774 147.1079 3.0580 5.5618 38.3878 42.4460 15.5282 18.5294 23.4768 41.0746 21.5180 184.4235 9.4365 199.9163 50.4247 50.2095 73.4880 196.4254 72.8345 0.8542 51.3829 15.9798 251.7274 67.9949 26.8615 1.0528 30.7160 26.7831 120.2246 55.7562 70.1950 19.0700 69.1899 4.4722 44.8392 3.4529 16.2934 4.2820 4.2790 4.8520 132.4452 31.6255 52.3641 56.7101 131.7489 314.2131 459.0277 23.6568 1.3259 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15.99491 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 7729.8713 41490.6529 44174.7126 1.00000 -0.00113 -0.00291 0.00115 0.99998 0.00684 0.00290 -0.00684 0.99997 1 0.01121 0.00209 0.00196 0.23348 0.04350 0.04085 17.13 27.75 28.93 38.10 61.68 67.93 89.64 102.97 113.63 129.76 160.95 169.89 174.77 193.69 202.88 235.25 254.66 273.69 296.36 300.50 346.05 359.20 397.65 412.33 444.58 452.08 455.45 464.74 506.98 518.82 532.50 549.72 591.22 637.51 647.51 675.02 680.81 684.93 723.27 737.68 746.08 752.54 805.19 815.72 857.33 863.54 880.74 903.96 914.53 926.84 941.75 949.69 972.29 986.06 1014.96 1027.66 1066.71 1076.73 1119.49 1155.87 1158.72 1183.49 1188.63 1206.42 1221.60 1226.42 1236.56 1264.24 1292.77 1296.71 1303.99 1344.58 1368.33 1377.09 1380.72 1383.23 1389.43 1419.48 1422.32 1444.33 1462.58 1510.05 1512.81 1514.69 1518.91 1549.79 1576.15 1577.30 1603.26 1637.26 1657.71 1673.07 1678.31 1686.53 1706.96 1718.25 1742.84 1755.85 1765.64 1771.76 1778.22 1788.62 1796.50 1797.55 1829.90 1847.38 1861.77 1871.63 1880.53 1904.59 1917.73 1926.29 1931.16 1962.48 1966.81 1990.17 1997.45 2013.56 2019.47 2042.97 2044.34 2053.30 2058.64 2060.93 2082.28 2090.59 2112.69 2133.42 2172.23 2185.44 2198.90 2223.41 2235.48 2275.77 2282.54 2296.98 2302.63 2321.69 2338.78 2343.14 2345.01 2359.68 2366.61 2376.52 2386.47 2389.10 2392.45 2416.54 2430.40 2459.82 2468.95 2512.51 2562.35 2572.60 2583.19 2606.29 2609.37 2621.05 2638.81 2800.55 4598.60 4602.48 4605.30 4610.32 4623.42 4627.91 4653.00 4663.98 4697.90 4715.46 4722.24 4735.87 4744.80 4787.83 4809.52 4816.93 4827.92 4828.76 4840.16 4846.86 4851.35 4866.97 4875.95 4885.74 4900.04 4962.16 5479.94 5575.05 5649.09 0.575578 0.604644 0.605588 0.512211 -1540.269660 -1540.240594 -1540.239650 -1540.333027 3.131880D-04 MUNgauss RevisionA2.0 retrievium 25-Jan-2020 DUDE CCOc1ccc(cc1OC)[C@H]2CC3=C([C@@H](Nc4ccccc4N3)c5c[nH]c6c5cccc6)C(=O)C2 C21229089 RHF 6-31G(d) (6D,10F) C1 479.220892 |X|Y|Z| 54.566709 40.141465 145.764471 68.347750 30 6 7 27 3 |36.858105| |12.572763|36.858105| |8.091624|13.574578|73.516695| |5.238536|8.001396|25.158882|36.858105| |4.403393|6.703471|14.010478|13.837363|36.858105| |3.334887|4.497233|9.215008|7.900623|13.655666|36.858105| |2.966461|3.769923|8.156093|6.782385|7.901418|13.839440|36.858105| |3.198919|3.980642|9.404828|7.914135|6.922358|8.000591|13.604525|36.858105| |4.080210|5.233634|14.504034|13.533726|7.946417|6.870739|7.850908|13.825492|36.858105| |4.133303|4.784376|13.122728|8.170102|5.303396|4.627761|5.170253|7.894749|14.153943|73.516695| |3.221650|3.544774|8.518352|5.248040|3.995788|3.806340|4.509539|6.744712|8.030133|24.237306|36.858105| |2.399633|2.906921|5.972201|4.401305|4.984398|7.500799|12.533612|7.550711|5.006665|6.861359|3.690035|36.858105| |2.271753|2.686467|5.597177|4.007876|4.207317|5.615560|8.994916|7.486199|4.857635|7.001943|3.998372|17.533811|0.500000| |2.215015|2.649033|5.277732|3.729852|4.271890|5.991500|7.530849|5.374704|4.034466|5.787600|3.122750|12.465021|0.249692|36.858105| |1.885257|2.193600|4.281697|2.892038|3.221876|4.162222|4.890304|3.920179|3.109542|4.703567|2.615972|7.471384|0.189184|12.544516|36.858105| |1.772791|2.046543|3.969915|2.651278|2.937037|3.735159|4.336816|3.544356|2.845383|4.360425|2.446364|6.563110|0.174471|7.588388|14.126884|36.858105| |1.554308|1.760773|3.375351|2.192752|2.382928|2.883914|3.236168|2.799746|2.337877|3.693990|2.099125|4.349187|0.121631|4.829570|7.476428|12.577998|36.858105| |1.522301|1.715407|3.300565|2.134955|2.291376|2.743089|3.108404|2.746118|2.296554|3.662770|2.103528|4.118226|0.119389|4.212765|5.798117|9.163819|17.624221|0.500000| |1.473343|1.651973|3.173974|2.039449|2.175579|2.573929|2.899617|2.597037|2.192641|3.524928|2.030266|3.747499|0.108407|4.321840|6.494737|7.690954|12.939503|0.259583|53.358707| |1.446670|1.619336|3.084969|1.969408|2.111376|2.474220|2.721034|2.433835|2.088588|3.361069|1.916689|3.396267|0.095194|4.155849|6.074219|6.014071|7.732534|0.159855|18.510790|36.858105| |1.314593|1.455694|2.747974|1.727405|1.839397|2.107204|2.273503|2.069888|1.816328|2.963172|1.691005|2.722825|0.076235|3.210628|4.230134|4.248085|5.372940|0.123774|10.641575|13.701017|36.858105| |1.278343|1.409705|2.641952|1.647283|1.753782|1.983475|2.105040|1.926294|1.715361|2.809701|1.593553|2.450824|0.067783|2.915872|3.637309|3.479435|4.020314|0.095040|6.997292|7.869011|13.779736|36.858105| |1.356639|1.502599|2.811136|1.756766|1.881035|2.129129|2.241032|2.037504|1.818270|2.960779|1.665059|2.584760|0.070427|3.183055|3.886233|3.494749|3.747982|0.087600|6.180053|6.813859|7.967125|13.764903|36.858105| |1.503395|1.685061|3.174985|2.013279|2.176232|2.511919|2.666323|2.380429|2.090604|3.355069|1.877034|3.139951|0.084496|4.103272|5.184250|4.307552|4.341988|0.098043|7.035149|7.918208|6.941777|7.979441|13.784786|36.858105| |1.563542|1.765257|3.365013|2.165555|2.345819|2.776762|3.036319|2.670962|2.283322|3.629584|2.045103|3.782811|0.102953|5.069464|7.519659|6.091127|6.189457|0.130305|10.726216|13.683266|7.967283|6.853235|7.890411|13.709488|36.858105| |1.762736|2.022369|3.907999|2.576202|2.821693|3.462149|3.899638|3.316789|2.744374|4.259630|2.382779|5.136945|0.136501|8.021589|13.931779|7.829931|6.218421|0.133277|9.110567|7.762569|5.146703|4.553102|5.184611|7.958892|13.538272|53.358707| |1.469273|1.658880|3.122879|2.003707|2.203996|2.626311|2.811708|2.424554|2.082572|3.299909|1.848508|3.563819|0.095492|3.951553|5.474464|7.511623|12.598010|0.251731|10.429606|6.436007|5.211008|4.047878|3.719178|4.112476|5.310010|6.727637|36.858105| |1.504989|1.708354|3.176465|2.036152|2.282363|2.722931|2.814489|2.383892|2.072604|3.257125|1.794677|3.473808|0.089328|3.951858|5.184362|6.305136|7.387272|0.159918|7.387652|5.341704|4.533640|3.853952|3.732594|4.171499|5.030977|6.499121|14.124231|36.858105| |1.382595|1.553237|2.856605|1.802302|2.005434|2.328733|2.366942|2.048209|1.818647|2.894160|1.594322|2.799757|0.072862|3.088930|3.778545|4.369041|5.130360|0.123521|5.733007|4.243949|3.993260|3.537538|3.348946|3.511820|3.928280|4.932605|8.510825|13.873656|53.358707| |1.368814|1.535953|2.798588|1.755190|1.962635|2.256071|2.250344|1.949133|1.750914|2.788145|1.525178|2.599648|0.067052|2.863062|3.366586|3.735629|4.123833|0.101266|4.780827|3.623629|3.474369|3.220960|3.127450|3.253188|3.491931|4.442833|5.977725|9.036879|26.138747|0.500000| |1.290466|1.437043|2.654852|1.664601|1.822399|2.093654|2.161795|1.908749|1.697584|2.733205|1.522940|2.552717|0.068230|2.749044|3.366324|3.981641|5.073025|0.129823|5.850399|4.146348|4.079350|3.492088|3.138624|3.181455|3.586058|4.417100|8.309669|8.538455|18.942741|0.251024|36.858105| |1.329068|1.482461|2.771815|1.750602|1.902103|2.207629|2.338068|2.069972|1.813524|2.919970|1.643987|2.839662|0.077419|3.043714|3.891068|4.888783|7.237076|0.188775|7.922172|5.085186|4.777874|3.773297|3.308131|3.415756|4.085228|5.014045|13.145215|8.527483|11.614244|0.165762|13.601544|36.858105| |1.244594|1.375642|2.579268|1.615859|1.728779|1.977953|2.113104|1.914261|1.687478|2.753521|1.567743|2.528584|0.070686|2.644414|3.281571|4.024031|5.761170|0.170846|7.102737|4.402720|4.363633|3.442578|2.942621|2.959506|3.473910|4.275397|7.266234|5.265165|7.309260|0.118847|7.903904|13.621002|36.858105| |1.150715|1.262665|2.350084|1.457027|1.553398|1.750742|1.845698|1.688187|1.510545|2.483865|1.411437|2.150832|0.059880|2.234440|2.671475|3.138380|4.083684|0.118869|5.235728|3.474284|3.613747|3.026921|2.597973|2.548770|2.862253|3.532735|5.001900|4.177229|6.329264|0.109426|6.932636|7.957352|13.846109|36.858105| |1.126525|1.235600|2.279986|1.407930|1.510981|1.694543|1.757468|1.599060|1.443128|2.368151|1.333775|2.020490|0.055377|2.113074|2.486230|2.858248|3.545480|0.099033|4.487194|3.130360|3.285231|2.879631|2.517522|2.451280|2.678223|3.309778|4.538766|4.187183|7.024780|0.126240|8.043398|6.857071|7.885252|13.581517|36.858105| |1.185251|1.307872|2.403231|1.489903|1.617297|1.825463|1.873366|1.680786|1.514982|2.464764|1.376098|2.159169|0.058192|2.289132|2.705402|3.102322|3.789024|0.101474|4.641282|3.325862|3.428932|3.047926|2.720502|2.676760|2.911166|3.597241|5.247961|5.294014|10.345060|0.184940|13.673653|7.786826|6.756176|7.870418|13.848094|36.858105| |1.880901|2.189731|4.265348|2.882137|3.221506|4.178903|4.898479|3.899783|3.092417|4.672321|2.598995|7.572914|0.194778|6.582638|7.787991|12.917052|7.585395|0.209725|6.948177|4.140595|3.241932|2.755982|2.760264|3.257478|4.152207|6.909601|5.821708|5.201345|5.318878|0.095391|3.604396|4.266131|3.642989|2.930666|2.690681|2.897458|36.858105| |1.747946|2.006792|3.872503|2.558077|2.811606|3.479267|3.938997|3.317321|2.727560|4.224782|2.370856|5.341203|0.145749|4.653717|5.384240|8.141880|6.925944|0.225397|6.342039|3.703866|3.027093|2.559695|2.500594|2.845421|3.528008|5.444491|5.788240|4.948519|5.347203|0.095076|3.792260|4.569469|4.015949|3.215161|2.908572|3.082089|15.855393|73.516695| |2.206839|2.643825|5.231473|3.694225|4.285001|6.086523|7.459705|5.218617|3.950920|5.660858|3.046394|12.481141|0.249538|7.684931|6.597113|7.396191|4.863535|0.131859|5.187916|3.343736|2.706868|2.399775|2.472943|2.932361|3.549501|6.119129|4.116464|4.024365|4.361397|0.081920|2.904427|3.237772|2.833123|2.389205|2.248301|2.423309|12.563538|14.390091|36.858105| |17.550583|8.872089|10.257761|4.242735|3.846549|3.002196|2.645754|2.772689|3.379832|5.971731|2.725232|2.189756|0.057338|2.048125|1.764396|1.665745|1.471494|0.039973|1.897708|1.374864|1.256533|1.226786|1.302000|1.435391|1.483663|2.257722|1.404418|1.446841|1.822129|0.037007|1.247855|1.276608|1.194672|1.109808|1.091860|1.150774|1.761971|2.926626|2.046199|0.500000| |17.579593|8.866304|12.969762|4.883024|4.023848|3.133698|2.855817|3.132218|3.999352|7.481810|3.312559|2.329187|0.061828|2.179422|1.857104|1.732072|1.522999|0.041344|1.983945|1.437654|1.308863|1.277565|1.359904|1.506087|1.558557|2.388446|1.433711|1.463894|1.828942|0.036895|1.256796|1.297299|1.217593|1.125515|1.099873|1.154877|1.815150|2.988608|2.108791|0.300278|0.500000| |17.580545|8.867080|12.968041|4.889839|4.025530|3.136751|2.860554|3.139408|4.010150|7.508529|3.328780|2.332032|0.062046|2.118682|1.818900|1.728750|1.522292|0.041727|1.961063|1.404310|1.277206|1.236244|1.303180|1.438959|1.505039|2.302421|1.435628|1.461094|1.830151|0.036879|1.262460|1.304131|1.227696|1.136418|1.109569|1.162439|1.850086|3.083127|2.165559|0.300280|0.301095|0.500000| |8.847579|17.532950|16.534079|7.095519|6.787979|4.598823|3.743454|3.807532|4.765777|7.523407|3.238031|2.915249|0.073858|2.741394|2.256471|2.076993|1.783462|0.047805|2.285021|1.663160|1.495811|1.458336|1.567836|1.764735|1.832059|2.861048|1.688334|1.753845|2.168816|0.043944|1.463900|1.503237|1.386881|1.272640|1.249968|1.329559|2.189795|3.537248|2.629093|0.212597|0.212136|0.173423|0.500000| |8.846147|17.535341|16.536724|7.118900|6.797510|4.609210|3.754794|3.821275|4.785369|7.552429|3.253818|2.921219|0.074241|2.623593|2.189094|2.071441|1.782452|0.048403|2.250406|1.612219|1.449142|1.397807|1.482686|1.659388|1.746876|2.716702|1.691562|1.749114|2.170910|0.043917|1.472932|1.513973|1.401942|1.288527|1.264306|1.341183|2.252179|3.697388|2.741978|0.212521|0.173403|0.212150|0.301014|0.500000| |4.693074|7.462414|12.551363|8.947232|17.761738|8.940181|5.652579|4.981304|5.641255|7.596673|3.331636|4.079805|0.096673|3.687113|2.895897|2.665875|2.206035|0.058761|2.742647|1.974970|1.740585|1.673512|1.798198|2.062092|2.190248|3.516619|2.084708|2.190079|2.655273|0.053630|1.763647|1.815814|1.646871|1.492260|1.464776|1.574850|2.899282|4.575188|3.721093|0.118375|0.115346|0.115259|0.227917|0.227263|0.500000| |2.988065|3.917241|7.461017|5.654270|8.954900|17.715795|8.914733|5.654737|4.951225|6.524729|3.140898|6.887350|0.139580|6.108792|4.376305|3.956604|3.036305|0.079031|3.617556|2.577383|2.192998|2.067736|2.227407|2.637703|2.909500|4.917596|2.836103|3.025476|3.501968|0.069782|2.266467|2.359841|2.078366|1.838299|1.795759|1.960119|4.424820|6.502108|6.386981|0.076940|0.077755|0.077810|0.114115|0.114300|0.218423|0.500000| |2.805030|3.326108|7.598660|5.635737|4.980505|5.687838|8.925840|17.754489|8.970524|12.637612|7.562323|7.080017|0.234412|5.128310|3.948743|3.611747|2.888594|0.079780|3.705664|2.512542|2.130131|1.964767|2.059036|2.395727|2.719358|4.571731|2.444527|2.351166|2.747015|0.052896|1.906173|2.095405|1.961304|1.722089|1.614023|1.680680|3.921497|5.987535|4.936970|0.068215|0.077342|0.077540|0.088386|0.088699|0.108054|0.124381|0.500000| |2.931545|3.242734|7.529501|4.762639|3.810755|3.763846|4.585053|6.747513|7.057488|16.441195|17.554666|3.869423|0.119795|3.150369|2.678360|2.561700|2.199074|0.062057|2.866618|1.956056|1.719943|1.604420|1.660429|1.867620|2.060041|3.261344|1.923288|1.850219|2.233649|0.043407|1.576286|1.712673|1.640737|1.472885|1.384545|1.423160|2.782480|4.561669|3.265678|0.070026|0.081617|0.085223|0.081946|0.085615|0.088424|0.087035|0.226748|0.500000| |3.191975|3.342364|7.772891|4.412181|3.419227|3.193441|3.613560|4.914290|5.891480|17.028319|17.645829|3.051908|0.090788|2.661106|2.284502|2.152176|1.882528|0.052513|2.496015|1.741085|1.554944|1.474023|1.536398|1.713193|1.846618|2.877546|1.675630|1.629270|1.990391|0.038996|1.403056|1.507067|1.446065|1.312214|1.242853|1.277801|2.270267|3.735566|2.603822|0.075034|0.092778|0.093288|0.084245|0.084641|0.082096|0.075202|0.147277|0.299950|0.500000| |2.917795|3.225799|7.495747|4.739131|3.793547|3.749366|4.572019|6.735884|7.028769|16.438008|17.551471|3.867829|0.119071|3.369100|2.812268|2.578354|2.206223|0.060979|2.948824|2.054739|1.803880|1.701353|1.785963|2.025708|2.209422|3.530353|1.920843|1.856461|2.231453|0.043417|1.565943|1.699056|1.619217|1.451068|1.366754|1.409804|2.672129|4.277388|3.082878|0.069700|0.084442|0.081646|0.084725|0.081916|0.088039|0.086720|0.227559|0.298947|0.300027|0.500000| |2.250613|2.669487|5.391157|3.777855|4.139336|5.415890|6.869468|5.529946|4.194668|6.115325|3.338094|8.871767|0.219259|17.542572|8.934675|5.754502|4.125734|0.101664|5.428803|3.958477|3.114819|2.887693|3.208130|4.158883|4.941865|10.503035|3.397906|3.362162|3.697216|0.070498|2.458604|2.710692|2.408378|2.059738|1.945349|2.084909|4.954744|6.738602|5.567673|0.057451|0.062473|0.059511|0.077216|0.071828|0.098612|0.143913|0.150657|0.091222|0.078743|0.103558|0.500000| |2.290579|2.775840|5.391096|3.798146|4.606704|6.592993|6.940929|4.826504|3.861936|5.496277|2.874340|8.820539|0.174785|17.513018|8.954878|6.206918|4.267701|0.102812|5.151754|3.791577|3.023984|2.819921|3.136392|4.032851|4.695546|9.351702|3.776938|4.015529|4.313941|0.083404|2.740504|2.936064|2.513671|2.154899|2.077486|2.285776|5.638832|7.444704|6.785699|0.059350|0.062245|0.060127|0.081401|0.076834|0.113752|0.208565|0.121155|0.079489|0.068987|0.084607|0.303824|0.500000| |1.378245|1.532259|2.934201|1.865402|1.972319|2.294987|2.564392|2.340187|2.003676|3.262287|1.890942|3.214276|0.093851|3.552621|4.877821|5.770831|9.351412|0.240081|25.980503|9.619510|7.652164|4.931910|4.109855|4.349176|5.876037|6.782551|6.794535|4.776550|5.414359|0.092249|4.323525|6.058311|6.072495|4.360861|3.562568|3.536687|4.345504|7.511473|3.315057|0.036315|0.037881|0.037591|0.043080|0.042658|0.051016|0.065505|0.068433|0.054690|0.047856|0.055772|0.092457|0.088034|0.500000| |1.246994|1.373797|2.590895|1.620278|1.715831|1.952227|2.106768|1.935419|1.706251|2.802768|1.607479|2.506699|0.070857|2.852000|3.666251|3.859723|5.093141|0.124519|9.779229|8.958675|17.703941|8.932895|5.659126|4.986728|5.666771|5.669352|5.059073|4.222499|5.286382|0.093125|4.235884|5.108439|5.041666|4.182349|3.662955|3.665680|3.063906|5.254856|2.536785|0.033146|0.034431|0.033809|0.039001|0.038106|0.045169|0.056231|0.055576|0.045692|0.041240|0.047375|0.076425|0.074446|0.231953|0.500000| |1.193491|1.307099|2.438510|1.507448|1.597023|1.785218|1.881845|1.738468|1.564560|2.582735|1.466538|2.155828|0.059768|2.504242|3.024363|2.944136|3.392588|0.083010|5.678591|5.621716|8.934829|17.721891|8.898922|5.657731|4.942186|4.930683|3.489858|3.345295|4.370160|0.082542|3.247869|3.423158|3.227870|2.947491|2.836172|2.952151|2.415941|4.060716|2.125521|0.031917|0.033151|0.032113|0.037507|0.036025|0.042555|0.051572|0.049240|0.041008|0.037935|0.043317|0.069032|0.067707|0.116395|0.215784|0.500000| |1.314162|1.447623|2.690245|1.666117|1.779297|1.985997|2.064062|1.891490|1.711368|2.802755|1.570365|2.325020|0.063106|2.822567|3.287988|2.961214|3.107529|0.074494|4.919898|4.921759|5.650927|8.890428|17.723250|8.934012|5.629291|5.731197|3.126614|3.204998|4.037829|0.078949|2.775674|2.848636|2.567309|2.324736|2.288177|2.469179|2.421397|3.929253|2.218620|0.035171|0.036693|0.034976|0.042123|0.039582|0.047611|0.057651|0.052816|0.043249|0.040501|0.046699|0.079829|0.078533|0.092935|0.124149|0.213411|0.500000| |1.581301|1.778508|3.340000|2.117467|2.300093|2.641444|2.762835|2.460158|2.178568|3.481318|1.927738|3.171897|0.083940|4.233852|4.934999|3.939345|3.741581|0.086488|5.703465|5.642153|4.985216|5.662197|8.932366|17.686695|8.936808|10.029137|3.557509|3.725925|4.317607|0.083706|2.827445|2.971101|2.586166|2.262060|2.200712|2.410886|3.086781|4.748178|2.893878|0.041964|0.044154|0.041744|0.052244|0.048376|0.060777|0.077178|0.067925|0.052718|0.048858|0.057933|0.122689|0.119724|0.099348|0.108056|0.124215|0.215729|0.500000| |1.845733|2.122816|4.108108|2.708751|2.960591|3.594315|4.002683|3.437690|2.873870|4.452242|2.470690|4.970433|0.130358|8.043557|9.554812|5.841239|4.709853|0.107443|6.847456|5.833311|4.346129|4.119144|4.944708|7.650129|9.450300|26.095929|3.967454|3.968918|4.293438|0.081106|2.821746|3.108713|2.702947|2.292591|2.173676|2.355978|4.296572|6.125640|4.114050|0.048156|0.051391|0.048827|0.061915|0.057578|0.075226|0.103032|0.095604|0.067844|0.060868|0.075490|0.251892|0.201521|0.111589|0.099259|0.093167|0.116816|0.232385|0.500000| |1.615735|1.853040|3.436352|2.221772|2.536967|3.076246|3.123311|2.580615|2.237700|3.470094|1.889160|3.856827|0.095646|4.568848|5.869419|6.563486|6.371282|0.138235|6.635199|4.997130|4.135229|3.674450|3.768313|4.417527|5.243397|7.235368|8.705031|17.805350|12.216332|0.212832|5.887280|5.794593|4.092300|3.383801|3.409633|4.179505|5.408049|8.515056|4.432179|0.043142|0.043596|0.043295|0.053258|0.052714|0.067815|0.097376|0.069593|0.053745|0.047410|0.054319|0.105253|0.135441|0.115550|0.103378|0.087846|0.090852|0.113872|0.124502|0.500000| |1.257075|1.387491|2.621332|1.644941|1.744257|1.996618|2.167482|1.983532|1.737592|2.847741|1.637600|2.614197|0.074649|2.701873|3.364984|4.165336|6.095314|0.198072|7.871539|4.521143|4.374209|3.374322|2.881062|2.924226|3.497382|4.354728|6.438091|4.559263|5.906391|0.099020|5.612410|8.829183|17.699158|8.951475|5.619663|4.889959|3.766798|7.436348|2.898204|0.033382|0.034232|0.034543|0.038708|0.039161|0.045798|0.057582|0.057150|0.047854|0.041909|0.047134|0.068851|0.069903|0.202296|0.142501|0.087340|0.069524|0.070900|0.076229|0.103062|0.500000| |1.098850|1.199100|2.234307|1.378231|1.457261|1.629275|1.723051|1.595002|1.433928|2.376285|1.357948|1.989032|0.055928|2.045776|2.408548|2.790389|3.535576|0.105116|4.676143|3.095159|3.246944|2.756540|2.368125|2.309626|2.570515|3.195912|4.031143|3.412225|5.014370|0.089587|4.982958|5.649729|8.957115|17.715483|8.881135|5.630022|2.638092|5.151141|2.186164|0.029433|0.029899|0.030231|0.033471|0.033941|0.038856|0.047123|0.045433|0.039426|0.035222|0.038751|0.052933|0.054529|0.109737|0.105361|0.075643|0.059417|0.057307|0.058219|0.079597|0.216117|0.500000| |1.062561|1.159154|2.131308|1.307361|1.397135|1.551723|1.601703|1.468771|1.336540|2.205753|1.242536|1.816007|0.049849|1.888494|2.180614|2.461802|2.957867|0.083004|3.812353|2.692404|2.852248|2.568874|2.264326|2.186166|2.346233|2.918241|3.614224|3.421628|5.630213|0.106452|5.687899|4.943528|5.634755|8.880059|17.712243|8.975198|2.345756|4.489892|2.004166|0.028682|0.028829|0.029106|0.032547|0.032949|0.037768|0.045520|0.041154|0.035778|0.032319|0.035288|0.048700|0.051748|0.083780|0.087919|0.071521|0.058066|0.055094|0.053955|0.080360|0.124080|0.215450|0.500000| |1.155825|1.272581|2.321962|1.431933|1.557970|1.744631|1.768602|1.588308|1.444252|2.352339|1.306540|2.007366|0.053719|2.129034|2.462806|2.757486|3.222813|0.085736|3.989901|2.925947|3.027823|2.793381|2.546271|2.493247|2.644509|3.294463|4.284318|4.609152|9.129558|0.187859|8.829279|5.566296|4.890173|5.601901|8.901651|17.705623|2.605415|4.869815|2.240492|0.031305|0.031254|0.031439|0.036023|0.036307|0.042469|0.052241|0.043844|0.037393|0.033806|0.037084|0.054105|0.059829|0.083121|0.088098|0.076010|0.065407|0.063352|0.060870|0.106646|0.106437|0.123750|0.215029|0.500000| |2.255168|2.732943|5.261283|3.693474|4.534705|6.571481|6.739304|4.626713|3.722068|5.308389|2.779215|8.811988|0.174447|6.927237|5.887871|6.295578|4.397028|0.115604|4.715550|3.160002|2.602741|2.347627|2.445111|2.893809|3.410103|5.768584|4.030147|4.209588|4.593638|0.088073|2.960370|3.183480|2.728741|2.334502|2.245326|2.466575|8.997016|11.842650|17.507813|0.058671|0.059351|0.060912|0.076444|0.079878|0.113231|0.220300|0.116154|0.081112|0.066920|0.077476|0.140512|0.200448|0.084181|0.067455|0.057965|0.061469|0.080405|0.109642|0.134608|0.075670|0.058897|0.055718|0.064181|0.500000| |2.242889|2.671719|5.319996|3.724204|4.188563|5.585767|6.761569|5.209510|4.027104|5.843447|3.161165|8.754738|0.213228|5.534870|4.901630|5.560803|4.132307|0.118248|4.524609|2.896823|2.409907|2.145064|2.185572|2.529942|2.997587|4.944182|3.574080|3.445796|3.894102|0.073687|2.657845|2.949769|2.656659|2.273849|2.134016|2.267686|9.007042|13.675425|17.605216|0.057571|0.059036|0.062045|0.072213|0.077953|0.100931|0.154272|0.138528|0.096884|0.075096|0.086564|0.123706|0.139133|0.082957|0.063825|0.053506|0.054991|0.069235|0.093780|0.101952|0.076069|0.058484|0.053308|0.058423|0.302811|0.500000| 1539.199021 -10871.039214 4366.920001 -211.155914 -5176.076106 3635.230787 -1540.845318 2.001070 40F39E000000000B 45393FE772EA786A 44B972CD0D04816D 4294F57B5079C006 B7E282E87638A87C 44BB47937ABF4FB2