Version2.0 2020-07-26T21:02:02Z 10.1021/jm300687e Gaussian16 RevisionB.01 CFLINN 06-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1ccc2c(c1)[C@@]3([C@@H]([C@@H]4CCC[NH+]4[C@@]35c6cc(ccc6NC5=O)F)C(=O)c7ccc(cc7)F)C(=O)N2 C09447182 RHF 6-31G(d) (6D,7F) c1ccc2c(c1)[C@@]3([C@@H]([C@@H]4CCC[NH+]4[C@@]35c6cc(ccc6NC5=O)F)C(=O)c7ccc(cc7)F)C(=O)N2 C01[X(C28H22F2N3O3)] 168 C1 584 Fc1ccc(cc1)C(=O)[C@@H]1[C@@H]2CCC[NH+]2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(F)cc1 Fc1ccc(cc1)C(=O)[C@@H]1[C@@H]2CCC[NH+]2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(F)cc1 Fc1ccc(cc1)C(=O)[C@@H]2[C@@H]3CCC[NH+]3[C@]4(C(=O)Nc5ccc(F)cc45)[C@@]26C(=O)Nc7ccccc67 InChIKey=RFCJBSJAGLJPRN-WLGONLEPSA-O InChI=1S/C28H21F2N3O3/c29-16-9-7-15(8-10-16)24(34)23-22-6-3-13-33(22)28(19-14-17(30)11-12-21(19)32-26(28)36)27(23)18-4-1-2-5-20(18)31-25(27)35/h1-2,4-5,7-12,14,22-23H,3,6,13H2,(H,31,35)(H,32,36)/p+1/t22-,23-,27+,28+/m0/s1 InChI=1/C28H21F2N3O3/c29-16-9-7-15(8-10-16)24(34)23-22-6-3-13-33(22)28(19-14-17(30)11-12-21(19)32-26(28)36)27(23)18-4-1-2-5-20(18)31-25(27)35/h1-2,4-5,7-12,14,22-23H,3,6,13H2,(H,31,35)(H,32,36)/p+1/t22-,23-,27+,28+/m0/s1/fC28H22F2N3O3/h31-33H/q+1 c1ccc2c(c1)[C@@]3([C@@H]([C@@H]4CCC[NH+]4[C@@]35c6cc(ccc6NC5=O)F)C(=O)c7ccc(cc7)F)C(=O)N2 C01[X(C28H22F2N3O3)] 168 C01 584 Fc1ccc(cc1)C(=O)[C@@H]1[C@@H]2CCC[NH+]2[C@@]2([C@]31C(=O)Nc1c3cccc1)C(=O)Nc1c2cc(F)cc1 F[C]1[CH][CH][C]([CH][CH]1)C(=O)[C@@H]1[C@@H]2CCC[N@@H]2[C@@]2([C@]31C(=O)N[C]1[C]3[CH][CH][CH][CH]1)C(=O)N[C]1[C]2[CH][C]([CH][CH]1)F F[C]1[CH][CH][C]([CH][CH]1)C(=O)[C@@H]2[C@@H]3CCC[NH]3[C@@]4([C]5[CH][C](F)[CH][CH][C]5NC4=O)[C@]26[C]7[CH][CH][CH][CH][C]7NC6=O InChIKey=XMHIUDKILJESKX-WLGONLEPSA-N InChI=1S/C28H22F2N3O3/c29-16-9-7-15(8-10-16)24(34)23-22-6-3-13-33(22)28(19-14-17(30)11-12-21(19)32-26(28)36)27(23)18-4-1-2-5-20(18)31-25(27)35/h1-2,4-5,7-12,14,22-23,33H,3,6,13H2,(H,31,35)(H,32,36)/t22-,23-,27+,28+/m0/s1 InChI=1/C28H22F2N3O3/c29-16-9-7-15(8-10-16)24(34)23-22-6-3-13-33(22)28(19-14-17(30)11-12-21(19)32-26(28)36)27(23)18-4-1-2-5-20(18)31-25(27)35/h1-2,4-5,7-12,14,22-23,33H,3,6,13H2,(H,31,35)(H,32,36)/t22-,23-,27+,28+/m0/s1/f/h31-32H 4101.7031552212 -1659.768497 1-A 14178.4522 126 458 584 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -26.41227 -26.40229 -20.67563 -20.67034 -20.66943 -15.82832 -15.73439 -15.72925 -11.50077 -11.49133 -11.46867 -11.45361 -11.43601 -11.42844 -11.42604 -11.42390 -11.41590 -11.40954 -11.40197 -11.39328 -11.38420 -11.37170 -11.36616 -11.36379 -11.36233 -11.35996 -11.35782 -11.35760 -11.35182 -11.34765 -11.34683 -11.34437 -11.34328 -11.33307 -11.33211 -11.33019 -1.73171 -1.72376 -1.55198 -1.54074 -1.52151 -1.47610 -1.42105 -1.41282 -1.28554 -1.27332 -1.26719 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144.2075 153.3091 173.9136 188.5889 203.2511 212.7385 228.1905 234.3496 249.2493 265.3318 285.2617 300.4399 327.7291 332.2182 342.9188 366.0489 395.0051 421.4274 431.8224 436.9998 454.2019 459.9354 464.8830 489.1777 494.6142 501.7542 512.6314 528.4201 542.0872 564.3993 585.1513 608.3965 618.7175 635.8757 644.2126 651.2183 657.0881 683.4253 693.3427 697.5548 699.9491 721.7403 740.8245 748.1459 763.8495 789.6400 812.2864 825.8929 846.3404 862.4844 868.8687 878.2272 889.0571 890.2244 907.3809 928.1518 934.2452 948.4994 957.5098 962.5172 967.9109 980.2591 989.8996 995.3148 1002.5238 1032.8063 1034.5777 1049.5321 1073.2536 1081.0914 1087.5202 1093.3934 1105.7732 1109.8531 1114.4049 1122.8320 1129.2807 1136.9825 1137.7783 1141.3133 1163.3552 1178.6259 1205.4866 1209.6830 1219.3799 1219.7378 1226.7698 1236.8232 1250.1665 1286.9554 1291.2509 1307.1079 1311.4575 1322.0794 1332.8590 1339.5033 1343.6483 1357.0885 1360.6098 1376.1411 1387.7234 1408.3788 1414.5799 1420.8401 1431.2240 1447.6871 1449.8294 1470.1760 1480.0737 1486.1850 1499.8020 1515.9777 1526.6592 1548.7224 1549.0240 1557.1286 1565.5414 1573.7075 1598.7565 1624.7659 1641.3824 1645.3541 1648.5286 1659.4845 1666.2415 1675.5774 1696.6483 1777.6027 1790.7028 1805.5655 1812.8083 1823.4557 1831.3234 1962.9598 1971.8159 2024.6542 3228.8499 3278.1413 3296.7875 3303.2304 3307.7989 3356.1028 3367.1291 3378.7508 3390.1905 3393.6302 3398.0609 3402.1976 3406.4862 3413.6395 3414.9935 3421.1271 3423.8521 3429.4632 3430.4418 3727.4060 3867.5188 3870.4108 8.5878 6.8975 6.2669 4.1894 5.5515 5.4272 4.8606 4.3678 7.8325 6.2578 8.7780 6.6469 8.7600 7.4323 4.6051 6.2130 6.5496 4.0127 5.7020 3.3408 7.4555 5.1104 6.6238 6.9143 8.0138 4.8581 5.3610 6.8993 4.4120 6.0651 4.4999 4.4112 3.8251 5.0472 2.3340 4.4752 2.5058 7.9485 1.7075 2.4095 1.7238 2.8913 2.9752 5.1072 4.1099 4.9797 3.7857 5.3824 5.7040 4.9994 5.4683 5.6532 6.2750 5.7133 4.7631 4.2737 5.1465 5.1268 4.7021 1.3512 4.9990 4.2856 3.6952 3.8783 3.6540 1.3300 3.7499 1.4634 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24.9245 19.8583 15.0153 3.5451 5.3867 2.8502 1.1521 1.2249 5.4743 1.8082 11.5384 8.7593 0.2941 0.1036 2.7438 6.9424 1.2429 4.5878 0.8082 51.1166 130.2070 119.2835 1.1505 1.5395 6.5659 4.2038 6.4586 0.3692 0.8768 3.6715 0.3492 1.2370 1.4120 0.2649 1.0527 0.9374 1.4443 2.2387 1.2210 1.2686 3.1452 0.7108 2.3168 2.0400 3.7115 1.4493 3.8772 3.0085 4.4218 3.7409 1.2544 0.9771 1.3787 3.3611 2.9110 1.3494 0.1382 1.1671 1.3007 6.0155 1.4503 1.0844 0.6677 0.8132 1.2322 1.5471 1.1484 2.2236 1.0653 1.9743 5.7687 2.5042 3.7893 4.2976 3.2465 6.8999 4.3840 2.2586 2.9217 0.9341 4.5261 0.3071 9.1355 3.2251 2.2611 2.9369 6.7185 2.9714 12.9804 1.6278 4.1564 6.5942 2.8728 7.5561 1.7425 3.4037 1.6750 12.9577 2.0100 3.7284 8.1957 3.5506 0.8118 4.5519 0.9292 1.4619 2.5230 0.4682 16.6894 2.7375 5.3554 1.3137 6.1439 5.6601 2.3026 2.7174 7.0400 10.9192 4.1488 10.0909 8.7735 7.0836 6.4984 4.5377 8.7109 4.8223 24.7091 7.7936 18.7168 17.2120 33.6745 15.7176 8.8703 4.9793 1.8633 14.3543 16.2528 1.1930 1.0907 0.5332 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0.517121 0.518065 0.434780 -1659.277190 -1659.251376 -1659.250432 -1659.333717 2.793393D-04 MUNgauss RevisionA2.0 retrievium 26-Jul-2020 DUDE c1ccc2c(c1)[C@@]3([C@@H]([C@@H]4CCC[NH+]4[C@@]35c6cc(ccc6NC5=O)F)C(=O)c7ccc(cc7)F)C(=O)N2 C09447182 RHF 6-31G(d) (6D,10F) C1 486.162923 |X|Y|Z| 58.439094 41.342838 95.152892 61.259755 31 6 7 28 3 |36.858105| |13.761490|36.858105| |7.887996|13.706950|36.858105| |6.964864|8.066774|13.852734|36.858105| |7.964464|6.879363|7.839452|13.689994|36.858105| |13.702400|7.903593|6.781135|7.967020|13.766972|36.858105| |4.911348|4.459774|5.154791|8.036705|12.469238|7.146404|36.858105| |4.026203|3.601283|3.942084|5.318951|7.125610|5.507999|12.112434|36.858105| |3.743342|3.499721|3.936162|5.227647|6.185538|4.788382|8.807186|17.647571|0.500000| |3.148687|2.880567|3.142817|4.034265|4.922952|4.042639|7.830670|12.375231|0.250034|36.858105| |2.905612|2.752564|3.088046|3.963668|4.494616|3.599121|6.931549|9.028845|0.236634|17.718653|0.500000| |2.649301|2.409751|2.547747|3.086096|3.660578|3.269476|4.916699|7.033438|0.166355|12.360160|0.244382|36.858105| |2.460897|2.230594|2.330208|2.772957|3.272882|2.999486|4.233210|5.098250|0.119091|7.801292|0.173090|12.377522|36.858105| |2.856061|2.539251|2.637554|3.187406|3.916337|3.591490|5.160171|5.600355|0.121852|7.820736|0.164760|7.904956|12.528119|36.858105| |3.212488|2.911206|3.146993|4.021336|4.993812|4.155357|7.789949|7.812781|0.160743|12.465842|0.254109|7.802249|8.102567|12.564718|53.358707| |2.858952|2.666474|2.925514|3.678788|4.272641|3.548895|6.260207|5.995595|0.137451|9.268709|0.248233|6.630334|7.325043|9.390999|25.786243|0.500000| |4.059711|3.646582|4.003789|5.413696|7.230635|5.533471|11.990961|7.559211|0.156478|7.616232|0.180471|5.079748|5.010857|7.188508|17.083489|0.260309|36.858105| |3.537707|3.374781|3.810440|4.916116|5.516749|4.363682|7.154311|4.946112|0.117005|5.220287|0.142168|3.882662|4.009569|5.282904|10.320793|0.220945|12.458588|36.858105| |2.961132|2.944135|3.409576|4.262078|4.345871|3.471612|5.489498|4.199715|0.106294|4.623598|0.138331|3.546104|3.621599|4.332692|8.106645|0.198423|7.163867|13.748336|36.858105| |2.642702|2.675177|3.054845|3.583323|3.525883|2.965261|4.039602|3.235289|0.083722|3.471150|0.102246|2.848944|2.963739|3.458563|5.799780|0.136239|4.941451|8.042813|13.788355|36.858105| |2.671852|2.690370|2.984264|3.371480|3.351220|2.939688|3.613288|2.894892|0.074126|3.019672|0.085597|2.546011|2.690254|3.201370|5.074663|0.113156|4.455738|6.877146|7.868417|13.821256|36.858105| |3.063044|2.996713|3.229135|3.652705|3.793613|3.414034|3.972320|3.102673|0.077358|3.164940|0.086366|2.661167|2.838295|3.531318|5.496067|0.116724|5.155474|7.866490|6.778900|7.966977|13.731522|36.858105| |3.604279|3.397980|3.665902|4.397663|4.908988|4.282984|5.365555|3.937377|0.094338|3.984104|0.105451|3.213303|3.415343|4.515306|7.410185|0.150780|8.035253|13.728871|7.944282|7.014025|8.038980|13.829284|36.858105| |4.148088|3.648792|3.705095|4.371048|5.351212|5.126061|5.483286|4.127956|0.095784|4.009798|0.100522|3.311285|3.536954|4.882688|7.394551|0.136883|8.099821|8.372371|5.324566|4.650519|5.141388|7.647540|13.660007|53.358707| |4.459419|3.745524|3.796326|4.704878|6.480428|6.138709|7.295455|5.512521|0.118972|5.228194|0.122322|4.166522|4.376065|6.527168|10.116053|0.164808|12.159168|7.981541|5.069092|4.090974|4.119863|5.273493|8.338016|19.204833|36.858105| |4.490309|3.588559|3.470399|4.126762|5.735424|6.214111|6.028992|5.302596|0.114185|4.882845|0.110683|4.196755|4.399397|6.395862|8.455967|0.135825|7.730287|5.375828|3.893174|3.266574|3.298163|4.055984|5.565476|11.451195|16.053962|73.516695| |2.290977|2.352100|2.689565|3.075962|2.956422|2.519023|3.349289|2.821754|0.075195|3.048878|0.092177|2.574834|2.651596|2.947215|4.805067|0.113381|3.829751|5.330747|8.198545|14.382807|8.176796|5.299842|4.714831|4.784836|3.216647|4.777931|97.533100| |4.220633|3.543816|3.594777|4.453151|6.099747|5.805133|7.229604|12.412596|0.247934|7.350873|0.154099|6.163870|4.699151|5.108470|7.782378|0.124354|5.590443|3.885829|3.273406|2.671145|2.491508|2.728258|3.391056|5.166623|5.113255|10.086820|5.288342|36.858105| |3.785621|3.137298|3.105629|3.717161|4.974894|5.061148|5.779760|8.077903|0.167188|6.660842|0.136279|6.492779|5.391397|6.029680|7.932308|0.124584|5.364193|3.752796|3.118869|2.581164|2.446618|2.716541|3.379354|5.330032|5.408880|11.783316|5.089471|15.924687|73.516695| |4.356793|3.682593|3.628776|4.229001|5.339990|5.482935|5.334185|7.273801|0.197165|4.893041|0.116038|4.395318|3.498103|3.655289|5.435404|0.093507|4.079940|3.125327|2.729000|2.303712|2.171959|2.353448|2.817940|4.237683|3.881880|7.582658|4.652049|12.797794|14.467263|36.858105| |3.873927|3.234607|3.055852|3.368965|4.099071|4.542864|3.970788|4.921150|0.130976|3.825508|0.091899|3.722064|3.125833|3.230863|4.503777|0.078943|3.336488|2.652172|2.330147|2.017044|1.934968|2.105795|2.473803|3.775025|3.371390|6.841714|4.101156|7.736074|12.318393|13.627555|36.858105| |3.522437|3.042909|2.838143|2.996651|3.438891|3.814503|3.233203|3.785237|0.105664|3.060326|0.076530|2.987640|2.564771|2.620144|3.665573|0.066132|2.742659|2.274632|2.039917|1.798747|1.733987|1.869629|2.147110|3.225559|2.767639|5.469796|3.703392|5.083719|8.205920|7.882794|13.825649|36.858105| |3.535901|3.197279|3.025982|3.136873|3.440117|3.695211|3.178443|3.643214|0.106937|2.909554|0.074925|2.762303|2.352161|2.395795|3.453855|0.063239|2.619531|2.214331|2.017043|1.784083|1.709436|1.822661|2.074626|3.052812|2.573050|4.914810|3.702616|4.488834|6.869209|6.909002|8.034077|13.783156|36.858105| |3.876982|3.618461|3.566980|3.774010|4.050823|4.124265|3.730226|4.302170|0.133556|3.279052|0.085777|2.985610|2.484334|2.538826|3.798688|0.069601|2.916983|2.454861|2.248389|1.965172|1.859179|1.968318|2.254635|3.266252|2.763139|5.137879|4.077606|5.004869|7.120996|7.888186|6.862046|7.874774|13.809195|36.858105| |4.356747|3.946652|4.020453|4.601456|5.267661|5.091112|5.016132|6.252007|0.200142|4.280712|0.109302|3.720759|2.986016|3.084592|4.758834|0.085052|3.665117|2.949800|2.654979|2.259404|2.112941|2.249408|2.642033|3.841435|3.364696|6.229320|4.625039|7.476129|9.361751|13.665646|7.930972|6.855612|8.026995|13.789372|36.858105| |3.045208|2.838358|2.673653|2.689470|2.852346|3.055064|2.632684|2.922314|0.085721|2.429653|0.063640|2.332932|2.029170|2.056220|2.939942|0.054713|2.227960|1.934302|1.784975|1.603260|1.544451|1.636528|1.831898|2.672985|2.201539|4.168112|3.358909|3.425433|5.445510|4.674883|5.335184|8.193094|14.457037|8.205121|5.332902|97.533100| |4.074447|4.129426|5.287025|8.361800|8.005364|5.074257|12.252791|7.650267|0.215746|6.238850|0.190636|4.156983|3.581263|4.034448|7.977643|0.154401|7.435002|6.566684|6.187061|4.482291|3.756568|3.822602|4.749908|5.875469|4.916800|7.319521|8.666887|4.941497|7.241686|4.173901|3.221004|2.775388|2.845645|3.416751|4.365357|5.459555|36.858105| |3.247563|3.293767|4.048663|5.550586|5.373707|3.887576|7.778462|6.565056|0.196902|6.456103|0.232910|4.354713|3.711745|3.965360|7.834954|0.165391|6.153655|5.863257|6.382436|4.569059|3.632636|3.518301|4.189542|5.043384|4.140705|6.290634|9.308902|4.313646|6.523733|3.657973|2.895108|2.522395|2.585032|3.065987|3.812514|5.028571|15.902468|73.516695| |4.622032|5.146570|7.658003|13.614645|8.349652|5.323646|8.102906|5.475239|0.158444|4.405115|0.128975|3.259428|2.891167|3.245990|5.835213|0.113696|5.525057|5.350641|5.091557|4.113241|3.616779|3.690353|4.364271|5.447678|4.280033|6.511265|8.089525|4.145604|6.161562|3.811914|3.022225|2.692652|2.830263|3.427655|4.188192|5.516195|14.184611|14.914814|53.358707| |17.741751|8.927777|5.629025|5.001509|5.663826|8.927780|3.983812|3.463559|0.089520|2.797923|0.071403|2.435307|2.291632|2.638715|3.894581|0.071044|3.480363|3.063899|2.593176|2.354590|2.410328|2.767182|3.187190|5.075221|3.959406|7.413565|4.637629|3.787935|6.280001|3.995439|3.795236|3.543026|3.480310|3.623532|3.893060|6.881868|3.340974|4.918844|4.992025|0.500000| |8.935020|17.729772|8.936504|5.706817|4.956317|5.635664|3.564878|3.004651|0.082048|2.479498|0.066319|2.125156|1.984006|2.229093|3.407338|0.064520|3.038419|2.880508|2.572958|2.395775|2.435012|2.682496|2.942934|4.262076|3.146912|5.429410|4.818442|2.995988|4.810091|3.161291|2.876884|2.791289|2.957696|3.265990|3.399822|6.102998|3.393658|5.007726|5.635030|0.215722|0.500000| |5.615308|8.849566|17.731334|8.894235|5.595579|4.905244|4.227447|3.376779|0.095929|2.796280|0.078022|2.303339|2.115578|2.353830|3.791873|0.073568|3.425679|3.397423|3.183523|2.933797|2.856125|2.996055|3.268534|4.353622|3.205819|5.210686|5.963391|3.057383|4.755157|3.107099|2.664725|2.526711|2.729359|3.203579|3.490779|5.561739|4.662818|6.701120|9.282680|0.123743|0.214116|0.500000| |8.931782|5.644204|4.909093|5.645374|8.877222|17.779226|6.390751|5.520873|0.127515|4.155342|0.098996|3.480770|3.236872|3.943371|5.883798|0.099937|5.486833|4.142954|3.262797|2.790584|2.782891|3.263345|4.122802|7.117805|6.747327|14.146661|5.343792|6.571409|11.008005|5.921502|5.163253|4.121569|3.759081|3.996783|4.926429|6.918269|4.390234|6.279306|5.857235|0.216343|0.124342|0.106797|0.500000| |2.713289|2.427302|2.514785|2.998210|3.606848|3.347660|4.581253|6.798585|0.161926|8.726043|0.178220|17.702549|8.810668|6.592989|8.298026|0.140714|4.507785|3.427488|3.078692|2.533213|2.314994|2.451807|2.944250|4.261201|3.968277|7.505758|5.156839|7.245445|14.567236|5.122014|4.440407|3.444478|3.087402|3.267448|4.084300|5.778310|3.763966|6.731976|4.169571|0.070130|0.059621|0.062784|0.101487|0.500000| |2.375350|2.206367|2.353705|2.812568|3.202559|2.849712|4.171951|5.685344|0.150368|8.803806|0.229953|17.611817|8.723897|5.723878|8.035146|0.155431|4.178026|3.420599|3.280780|2.681861|2.370623|2.420949|2.841563|3.884197|3.434174|6.053431|5.603540|4.915601|8.726983|3.855035|3.309083|2.754393|2.600969|2.824408|3.433894|5.017618|3.823159|7.459949|4.135414|0.060820|0.054615|0.060091|0.082481|0.302605|0.500000| |2.291003|2.064911|2.121624|2.469115|2.896838|2.746007|3.552680|4.232597|0.101411|5.655815|0.130409|8.687091|17.617065|8.822872|7.823031|0.145576|4.077638|3.355918|3.038923|2.575887|2.393097|2.539608|2.991202|4.309216|3.837541|7.177760|5.240588|4.236491|9.019143|3.282605|3.060915|2.528189|2.282058|2.356776|2.773240|4.462317|3.022368|5.486460|3.437730|0.060262|0.051534|0.053684|0.083526|0.221806|0.192943|0.500000| |2.240620|2.070694|2.187197|2.585963|2.955594|2.675772|3.789443|4.334671|0.106001|6.519034|0.165680|8.740593|17.545430|8.825620|9.511632|0.207174|4.511318|3.907052|3.720696|3.076408|2.743881|2.816546|3.300247|4.459246|3.850233|6.615901|6.312502|3.838655|7.424195|2.999234|2.686404|2.265387|2.115793|2.246719|2.656998|4.165226|3.404544|6.507318|3.753469|0.057891|0.051526|0.055904|0.078413|0.174963|0.221259|0.302486|0.500000| |3.116557|2.686629|2.721031|3.256298|4.146549|3.996163|5.185371|5.717281|0.121456|6.798056|0.140396|6.919574|8.807627|17.750272|12.284792|0.182824|6.767079|4.755706|3.793665|3.105610|2.961371|3.355008|4.310044|6.884247|7.262703|14.913828|5.956383|5.897734|13.952443|4.094930|3.692747|2.915555|2.599784|2.712054|3.307238|4.969754|3.839660|6.435715|4.332021|0.080908|0.065297|0.066554|0.128265|0.186554|0.139239|0.215925|0.173416|0.500000| |2.655366|2.386200|2.472124|2.932509|3.500487|3.249527|4.390025|4.396816|0.100235|5.676439|0.133211|5.628089|8.618281|17.628518|12.202668|0.233045|6.344901|5.360048|4.437023|3.663609|3.463210|3.852249|4.834092|6.981364|6.227918|10.373145|6.957506|4.034810|8.220904|3.072238|2.776540|2.312845|2.131682|2.244919|2.663212|4.182392|3.607101|6.340316|4.067232|0.068706|0.058774|0.061889|0.097897|0.134718|0.126198|0.196773|0.214760|0.298329|0.500000| |2.780562|2.784634|3.261215|4.105087|4.120401|3.253943|5.427896|4.413319|0.115630|5.053651|0.164269|3.807030|3.753091|4.231573|8.131339|0.208725|6.347313|8.784951|17.775748|8.992982|5.645378|4.908867|5.617431|5.836082|4.362982|6.253659|16.890182|3.319244|5.522023|2.775027|2.343640|2.055558|2.048582|2.306623|2.736154|4.075028|6.766941|14.592612|7.083015|0.067713|0.067841|0.085606|0.085002|0.089845|0.100617|0.086225|0.109354|0.101315|0.116152|0.500000| |2.388860|2.430016|2.667636|2.919169|2.859639|2.565442|3.015044|2.492652|0.064750|2.590036|0.073651|2.238964|2.364258|2.742180|4.212906|0.093288|3.562087|4.957114|5.636822|8.981533|17.747447|8.869396|5.677850|5.613702|3.382353|5.007537|16.767947|2.185850|3.826184|1.939299|1.748383|1.584650|1.566983|1.694225|1.898281|3.215607|3.156594|5.494447|4.228926|0.060676|0.062259|0.072252|0.067682|0.057039|0.058599|0.059320|0.067360|0.071076|0.082357|0.124942|0.500000| |2.943570|2.868009|2.995676|3.257566|3.382315|3.186581|3.401082|2.737877|0.068665|2.757377|0.074504|2.382867|2.550707|3.134357|4.657908|0.096905|4.224947|5.608105|4.904702|5.655129|8.886542|17.739415|8.889854|9.257295|4.648624|6.708553|9.590937|2.488355|4.452519|2.183389|1.988809|1.781353|1.730948|1.847986|2.082609|3.523296|3.224211|5.269017|4.338713|0.075503|0.072658|0.077617|0.085545|0.061967|0.060380|0.064733|0.069911|0.084698|0.095273|0.106804|0.212688|0.500000| |3.972482|3.463353|3.385425|3.788656|4.504375|4.644889|4.374778|3.497018|0.082906|3.382294|0.085197|2.916719|3.139739|4.186191|5.916475|0.110980|5.758279|5.895757|4.257739|3.954715|4.550572|6.718691|8.925238|26.013904|9.292375|13.188494|6.986378|3.365965|6.281298|2.849492|2.614291|2.263697|2.130221|2.241966|2.581848|4.239652|3.562072|5.531758|4.641448|0.103188|0.084591|0.082078|0.134803|0.078039|0.070584|0.080403|0.080985|0.123550|0.124068|0.098196|0.106615|0.191708|0.500000| |3.582734|2.959189|2.781710|3.069559|3.776810|4.238506|3.746170|4.587555|0.116557|3.782783|0.089103|3.839386|3.326797|3.451779|4.586876|0.079827|3.330184|2.635789|2.295383|1.993889|1.926930|2.113832|2.488448|3.862800|3.482727|7.351000|4.038515|7.260882|14.043028|8.924169|17.763921|8.955945|5.689332|4.949982|5.651571|9.640070|2.993774|4.833065|3.775763|0.099395|0.073583|0.067628|0.140580|0.130514|0.092970|0.092846|0.078079|0.113165|0.082206|0.063614|0.048378|0.055751|0.075043|0.500000| |3.116221|2.707920|2.502753|2.601860|2.948358|3.294904|2.782898|3.182990|0.087824|2.682499|0.067438|2.676930|2.358178|2.399048|3.284142|0.059814|2.442154|2.059535|1.855210|1.655002|1.607600|1.733807|1.969940|2.965435|2.507071|4.984200|3.420986|4.132742|7.075417|5.604690|8.871449|17.751357|8.948384|5.634275|4.946030|16.742088|2.415094|3.944891|3.201243|0.089397|0.070362|0.062621|0.099754|0.085412|0.069000|0.065627|0.058188|0.074202|0.059593|0.051705|0.041075|0.046277|0.058563|0.213382|0.500000| |3.576024|3.519198|3.545304|3.642587|3.688763|3.661305|3.384902|3.753356|0.118868|2.951938|0.079386|2.674440|2.250871|2.291955|3.456683|0.064495|2.667536|2.308432|2.152577|1.900255|1.793748|1.878389|2.121815|3.022140|2.501728|4.561203|3.984153|4.059229|5.920999|5.608994|4.949574|5.633783|8.958634|17.753933|8.862750|16.771136|3.264814|5.269424|4.589518|0.092423|0.090125|0.091232|0.095816|0.079447|0.071547|0.059145|0.057475|0.066924|0.057011|0.061656|0.045688|0.049030|0.057725|0.107528|0.124509|0.500000| |4.333149|4.135649|4.515675|5.430090|5.879081|5.095079|5.773030|6.998748|0.255921|4.632698|0.123236|3.800504|3.023483|3.131353|5.055644|0.091507|3.953125|3.213061|2.935134|2.465805|2.268267|2.385260|2.805585|3.971300|3.446173|6.123498|5.058640|6.783729|8.482870|8.831198|5.623645|4.946705|5.713482|9.046808|17.758325|9.689649|5.394517|8.241466|7.047950|0.103513|0.097382|0.109497|0.129379|0.110806|0.098800|0.076292|0.075923|0.090714|0.075339|0.085333|0.056321|0.060586|0.072993|0.123780|0.107476|0.216512|0.500000| |3.934121|4.553711|6.731091|8.905073|5.883169|4.257158|5.758961|4.404152|0.131472|3.750864|0.112780|2.891832|2.585962|2.834655|4.938277|0.099210|4.402813|4.511032|4.621508|3.939202|3.438605|3.378861|3.789608|4.647097|3.539840|5.481128|8.109040|3.469476|5.261939|3.284639|2.675479|2.441767|2.601397|3.136512|3.674630|5.177561|9.289109|13.108486|26.007980|0.089527|0.107086|0.192510|0.098459|0.075452|0.076691|0.063345|0.069670|0.076570|0.073548|0.134515|0.084057|0.081954|0.082747|0.068296|0.059851|0.088160|0.125079|0.500000| 1657.690722 -12062.497077 4861.526597 -218.192252 -5761.472010 4101.703450 -1659.768560 2.001253 4121760000000004 45719B59E77A480E 44F1D0CC4C5F6641 42CE6DB2505C27FE B7EB38FB80ADAC7F 44E351EAE476031E