Version2.0 2020-07-30T16:07:33Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 04-Jul-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE CC(C)S(=O)(=O)NC[C@@H]1CCC2(O1)CC[NH+](CC2)Cc3nc4ccccc4s3 C12056448 RHF 6-31G(d) (6D,7F) CC(C)S(=O)(=O)NC[C@@H]1CCC2(O1)CC[NH+](CC2)Cc3nc4ccccc4s3 C01[X(C20H30N3O3S2)] 168 C1 488 CC(S(=O)(=O)NC[C@@H]1CCC2(O1)CC[NH+](CC2)Cc1nc2c(s1)cccc2)C CC(S(=O)(=O)NC[C@@H]1CCC2(O1)CC[NH+](CC2)Cc1nc2c(s1)cccc2)C CC(C)[S](=O)(=O)NC[C@@H]1CCC2(CC[NH+](CC2)Cc3sc4ccccc4n3)O1 InChIKey=QGDNUHFXZYHXLJ-INIZCTEOSA-O InChI=1S/C20H29N3O3S2/c1-15(2)28(24,25)21-13-16-7-8-20(26-16)9-11-23(12-10-20)14-19-22-17-5-3-4-6-18(17)27-19/h3-6,15-16,21H,7-14H2,1-2H3/p+1/t16-/m0/s1 InChI=1/C20H29N3O3S2/c1-15(2)28(24,25)21-13-16-7-8-20(26-16)9-11-23(12-10-20)14-19-22-17-5-3-4-6-18(17)27-19/h3-6,15-16,21H,7-14H2,1-2H3/p+1/t16-/m0/s1/fC20H30N3O3S2/h23H/q+1 CC(C)S(=O)(=O)NC[C@@H]1CCC2(O1)CC[NH+](CC2)Cc3nc4ccccc4s3 C01[X(C20H30N3O3S2)] 168 C01 488 CC(S(=O)(=O)NC[C@@H]1CCC2(O1)CC[NH+](CC2)Cc1nc2c(s1)cccc2)C CC([S]([O])([O])NC[C@@H]1CC[C@@]2(O1)CC[NH](CC2)CC1=N[C]2[C]([CH][CH][CH][CH]2)S1)C CC(C)[S]([O])([O])NC[C@@H]1CCC2(CC[NH](CC2)CC3=N[C]4[CH][CH][CH][CH][C]4S3)O1 InChIKey=MYFCBJFUZYQTLU-INIZCTEOSA-N InChI=1S/C20H30N3O3S2/c1-15(2)28(24,25)21-13-16-7-8-20(26-16)9-11-23(12-10-20)14-19-22-17-5-3-4-6-18(17)27-19/h3-6,15-16,21,23H,7-14H2,1-2H3/t16-/m0/s1 InChI=1/C20H30N3O3S2/c1-15(2)28(24,25)21-13-16-7-8-20(26-16)9-11-23(12-10-20)14-19-22-17-5-3-4-6-18(17)27-19/h3-6,15-16,21,23H,7-14H2,1-2H3/t16-/m0/s1 3212.2575000463 -1957.5499481 1-A 15230.6652 113 375 488 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -92.28906 -92.08728 -20.67700 -20.64584 -20.64241 -15.82966 -15.69304 -15.69009 -11.43280 -11.43032 -11.41783 -11.41149 -11.40395 -11.38297 -11.37325 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1571.8746 1575.6472 1578.6906 1591.5091 1598.9031 1612.4209 1622.4024 1623.3527 1625.7962 1631.5464 1634.4731 1635.4909 1637.1456 1638.1530 1640.3346 1644.5839 1645.3272 1659.1691 1659.7395 1661.7816 1754.8302 1783.4691 1808.3045 3212.0975 3222.5361 3226.7020 3231.3171 3232.3361 3243.7874 3260.0082 3260.1061 3263.8510 3273.7205 3277.9961 3280.3052 3282.5178 3285.9940 3295.9219 3298.0853 3301.4038 3311.2096 3317.2811 3317.5598 3320.5518 3354.7809 3358.1813 3379.2538 3389.1210 3390.5436 3400.6090 3407.8943 3683.8801 3820.0035 5.7616 6.0697 4.0554 4.8381 5.1076 4.4887 4.5164 3.3265 2.9936 4.5098 3.2915 5.0784 4.3443 4.3937 3.3831 4.0607 1.0708 1.6558 1.9898 3.2774 2.3259 3.5795 2.9386 3.0357 2.8429 2.9668 3.2504 3.0731 5.2248 2.5726 2.5466 2.3508 3.2012 3.1712 2.9262 5.4513 5.8016 5.1487 3.9475 3.2198 4.6995 3.0682 3.7632 3.8227 4.8997 2.0356 6.3021 3.0212 4.6880 4.2718 6.9406 3.1651 3.3618 1.8916 1.4416 1.6902 2.6883 2.2847 5.0954 2.5406 2.7496 1.3781 2.5541 2.3182 1.5898 1.4094 2.0892 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0.7621 3.0941 2.0916 12.5884 2.3227 2.3262 4.8378 8.1250 0.2677 22.3407 5.9505 1.0275 1.1229 3.9661 5.5204 8.6791 22.3292 1.8877 0.6697 2.9237 1.9392 0.3947 6.0091 32.2126 2.5072 51.2865 0.8806 23.6204 3.4897 129.9397 6.9664 1.4360 11.5023 33.3007 5.8010 7.6078 8.9581 11.9212 64.7543 21.1331 42.8685 84.7839 8.8952 34.1869 37.4247 1.8310 43.0811 18.5512 16.4139 24.7360 12.9706 1.7371 11.3765 23.9054 1.3358 0.7758 11.3921 1.7383 92.3739 0.0057 55.5246 29.9071 36.6546 0.3818 73.6325 22.4307 5.3259 1.0359 122.5602 68.9892 128.8883 3.3892 48.3378 28.3261 18.6022 2.2695 15.9473 19.3545 10.6397 17.4852 2.3453 22.6710 73.0280 55.2696 4.2187 29.7418 8.5620 8.8396 10.1136 20.4939 6.1323 31.6826 1.5107 8.8603 6.2187 12.0905 7.2698 0.5232 1.4761 15.9547 12.1613 0.8301 48.8299 106.9739 18.0986 46.8940 0.5330 12.9112 4.9518 2.9582 0.8192 14.5137 6.8953 1.9696 5.1277 12.0613 1.8843 17.1593 27.0413 11.9349 31.3542 13.2403 4.7058 21.2127 14.2140 16.3760 20.8458 28.4254 6.9607 0.9918 34.5982 7.0242 4.9106 9.2470 12.0971 15.5472 1.9896 30.2313 29.2677 18.2992 6.6009 10.6740 20.7949 1.7705 3.6466 0.5964 5.0810 3.5782 9.6597 8.7767 32.4106 40.2157 3.1083 4.1319 1.5981 1.7256 0.7534 2.1203 0.2828 0.2538 0.1055 0.7474 0.2508 2.0796 0.6737 1.3517 0.7903 1.0551 0.0859 0.3305 0.1452 0.4088 0.5633 2.4546 1.8644 2.0976 0.5310 1.5824 0.7308 0.8447 1.8937 2.2932 0.9073 0.6440 6.9795 0.2625 1.4849 4.1023 2.8563 4.9578 2.1828 5.0183 2.1052 0.7166 1.1017 9.8438 2.4422 3.5743 3.0721 3.3997 2.0392 12.9306 7.8343 2.9122 18.0504 6.6257 0.3786 1.4680 2.1966 0.7661 3.1703 8.9339 2.4816 1.8817 1.0042 3.7007 2.5180 2.4215 6.7187 5.2707 1.2354 0.7936 0.0817 6.3498 4.7233 23.7801 5.4642 0.3752 21.2576 5.8982 1.9637 7.2496 8.1768 1.5610 4.6386 1.0707 1.1261 2.9168 0.8656 35.8360 3.5067 4.7761 6.2745 2.0370 7.0829 13.2996 14.2048 7.3179 46.3340 34.1981 32.5360 12.7808 49.1011 8.8035 4.0977 3.9880 4.2817 5.9498 2.0718 20.9395 5.1992 1.5444 0.6605 0.4328 1.4472 2.5102 0.9558 5.3602 3.0495 4.9865 3.9862 26.0755 24.2710 1.4803 13.4198 18.1967 2.0738 3.5748 2.2750 5.0003 23.7789 19.8520 27.0206 7.7355 4.7901 0.4157 12.3640 166.2243 164.9353 17.1935 14.4554 95.5789 1.9009 204.6063 32.6005 124.4898 93.2779 74.2323 60.0569 39.8288 47.9912 27.1403 46.1997 171.6334 10.0756 74.9783 145.7419 37.4113 100.0292 43.2991 69.6623 6.0100 74.7769 46.0383 41.4240 110.7627 89.6112 236.3700 22.1983 26.3445 0.7493 0.7500 0.7374 0.7336 0.7463 0.7195 0.7227 0.7381 0.7465 0.7171 0.7100 0.7214 0.3212 0.4010 0.7443 0.1077 0.1815 0.2730 0.5521 0.6013 0.3992 0.2385 0.1193 0.3981 0.2980 0.6707 0.5411 0.6468 0.5535 0.4587 0.4934 0.6591 0.2343 0.6748 0.1359 0.3356 0.5769 0.4289 0.6668 0.5655 0.7475 0.2125 0.2737 0.1552 0.7499 0.3746 0.5828 0.4439 0.6525 0.0418 0.1782 0.7179 0.0509 0.2954 0.5907 0.4848 0.5619 0.7101 0.2554 0.7046 0.2521 0.7499 0.0358 0.3708 0.1105 0.1265 0.2406 0.7489 0.5370 0.6444 0.6444 0.6429 0.7491 0.0940 0.5078 0.7246 0.5055 0.7447 0.6047 0.3766 0.3328 0.4862 0.5622 0.7059 0.2199 0.7487 0.2214 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1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 1 12.00000 12.00000 12.00000 31.97207 15.99491 15.99491 14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 15.99491 12.00000 12.00000 14.00307 1.00783 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 7505.4014 21389.7738 25691.6050 0.99999 -0.00114 0.00418 0.00118 0.99997 -0.00773 -0.00417 0.00773 0.99996 1 0.01154 0.00405 0.00337 0.24046 0.08437 0.07025 18.46 27.97 40.59 53.57 62.86 76.80 89.99 106.27 115.88 190.06 193.66 205.02 287.22 307.63 309.72 315.63 333.61 358.52 370.34 387.48 403.73 419.49 443.84 459.79 486.50 526.61 556.67 567.27 612.95 633.09 655.29 669.05 695.40 701.46 718.95 770.93 777.24 792.24 810.59 826.24 849.82 884.73 895.76 964.55 988.32 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0.559256 0.560201 0.476067 -1957.015730 -1956.990692 -1956.989747 -1957.073881 2.821868D-04 MUNgauss RevisionA2.0 retrievium 30-Jul-2020 DUDE CC(C)S(=O)(=O)NC[C@@H]1CCC2(O1)CC[NH+](CC2)Cc3nc4ccccc4s3 C12056448 RHF 6-31G(d) (6D,10F) C1 424.172861 |X|Y|Z| 103.463273 58.926137 32.460780 58.275281 20 6 7 8 16 16 2 1 1 |36.858105| |12.466646|36.858105| |7.480022|12.437040|36.858105| |6.935079|10.630899|7.038841|388.023441| |4.823536|7.256323|6.193272|94.307326|73.516695| |6.171409|7.225160|5.966638|93.753832|13.656986|73.516695| |6.034107|6.988996|4.680924|82.200965|13.533230|13.582366|53.358707| |4.233500|4.922040|3.713254|49.831139|11.805328|9.216367|17.690287|36.858105| |3.400832|3.965515|3.279086|41.580097|11.362781|8.666951|10.260255|12.409101|36.858105| |3.270092|3.986942|3.423898|41.248945|13.365848|8.332078|8.577862|8.885693|17.602042|0.500000| |2.732681|3.035593|2.598652|28.442816|7.561112|6.382551|6.787958|7.279644|12.464020|0.245170|36.858105| |2.457780|2.704820|2.401592|25.343830|6.752522|6.108417|5.520063|5.015835|7.945781|0.189033|12.333745|36.858105| |2.782649|3.087478|2.747739|30.860310|8.060552|7.895039|6.376306|5.241095|8.280610|0.198441|7.814293|12.297305|36.858105| |3.461557|3.912693|3.296620|43.314654|10.708196|10.520472|9.751041|7.981771|13.505760|0.259555|8.289531|8.108208|13.533018|73.516695| |2.635064|2.793939|2.511513|26.673786|6.482235|7.401822|5.475736|4.130664|5.359174|0.129116|5.294756|7.322258|12.477431|14.468822|36.858105| |2.897171|3.040069|2.777064|29.258176|6.799122|9.049272|5.565954|3.819857|4.545490|0.114290|4.053534|4.852967|7.594868|12.151752|12.490580|36.858105| |2.750511|2.985624|2.861739|28.408361|7.032390|8.772013|4.944552|3.411400|4.096647|0.111421|3.583529|4.295118|6.464286|10.053893|7.607295|12.650836|53.358707| |2.401049|2.585165|2.502003|23.621540|5.965025|6.956384|4.215936|2.995938|3.608705|0.098923|3.325077|4.121655|5.783992|8.380490|7.042353|9.306418|25.691834|0.500000| |2.876713|3.297773|3.181102|32.885504|9.009034|9.387816|5.472104|3.900487|4.970565|0.145643|4.105073|4.871739|7.545563|11.860225|6.508356|7.607666|17.145481|0.257642|36.858105| |2.626507|2.996845|2.802414|29.433849|8.322909|7.613232|5.409759|4.250518|6.127617|0.181236|5.431297|7.413472|12.406710|14.112741|7.687482|6.541060|10.365886|0.195231|12.525492|36.858105| |2.842347|3.031382|3.015500|27.409642|6.546332|9.021650|4.531717|2.985937|3.339853|0.091836|2.893422|3.250622|4.399836|7.632486|4.961786|7.686146|17.212379|0.258083|7.635249|4.956116|36.858105| |2.450137|2.639320|2.730993|22.667644|5.678621|6.929656|3.730139|2.524004|2.816089|0.079788|2.497616|2.805063|3.574048|6.044280|3.830501|5.023139|10.422457|0.206785|6.149027|4.262059|12.688166|36.858105| |2.461314|2.713807|2.912480|22.831407|5.909513|6.771256|3.637589|2.464974|2.724574|0.079221|2.387437|2.624275|3.261214|5.643017|3.295229|4.061681|7.854238|0.152161|5.654391|3.985172|7.840808|15.049518|53.358707| |2.105115|2.296644|2.476549|18.650986|4.869414|5.311495|3.056699|2.110978|2.320930|0.067629|2.089324|2.297288|2.740845|4.669522|2.772252|3.250929|5.862590|0.121671|4.241603|3.306269|5.244832|8.690309|18.683929|36.858105| |1.985187|2.182469|2.404036|17.217491|4.571479|4.746781|2.813492|1.956089|2.125432|0.062668|1.917866|2.072503|2.405800|4.152149|2.374025|2.692017|4.615842|0.094636|3.516398|2.876131|3.905824|5.412618|10.518666|13.667277|36.858105| |1.738402|1.886736|2.057551|14.665575|3.872049|3.986980|2.453847|1.724010|1.866064|0.054703|1.716008|1.855249|2.105831|3.604624|2.094171|2.325813|3.858350|0.080821|2.888606|2.471174|3.169178|4.177365|7.034474|8.007546|13.853312|36.858105| |1.620862|1.735327|1.857677|13.557998|3.534548|3.707883|2.312667|1.631967|1.772906|0.051386|1.653973|1.807790|2.043030|3.448656|2.074092|2.297439|3.777761|0.081199|2.728741|2.369845|3.082612|4.071759|6.261437|6.906840|7.890036|13.603237|36.858105| |1.680487|1.786954|1.886202|14.185736|3.656777|3.945865|2.435973|1.714624|1.876692|0.053873|1.755911|1.945798|2.228857|3.716526|2.315370|2.604645|4.350086|0.095796|3.013396|2.583317|3.601337|4.980689|7.112975|7.844863|6.752308|7.868563|13.827124|36.858105| |1.905087|2.037790|2.148789|16.511967|4.243424|4.697199|2.794647|1.947536|2.147517|0.061621|1.979055|2.207339|2.604069|4.341194|2.722557|3.169590|5.580179|0.122679|3.774772|3.072037|4.866841|7.814881|11.058654|13.681717|7.886788|6.928877|8.045061|13.705037|36.858105| |2.022316|2.131360|2.185293|17.702321|4.431964|5.188685|3.050787|2.113174|2.349567|0.065927|2.174624|2.472401|3.000196|4.918330|3.321452|4.065836|7.338092|0.170033|4.331912|3.458364|6.714647|10.857810|10.051838|7.426897|4.877787|4.255579|4.696607|6.708209|10.904863|388.023441| |17.577663|8.913404|6.888253|36.658515|7.134231|8.263060|6.294100|3.546798|2.908566|0.078781|2.407307|2.173933|2.412268|5.173891|2.291923|2.491798|3.261157|0.059059|2.502020|2.304909|2.489993|2.201955|3.038653|1.944245|1.858666|1.642728|1.529737|1.573309|1.763871|13.143727|0.500000| |17.595972|8.750284|5.452726|45.776700|8.015284|10.007951|9.392429|4.718892|3.604141|0.093164|2.920180|2.572195|2.870555|6.442404|2.727108|2.935719|3.674473|0.065755|2.797645|2.623146|2.720454|2.321887|3.124404|1.974186|1.850960|1.633728|1.537681|1.602724|1.810550|13.824523|0.302239|0.500000| |17.589255|8.791069|6.795990|45.443689|7.913074|12.159895|7.271493|3.802178|3.212350|0.085463|2.609522|2.413153|2.790018|6.079761|2.716468|3.090378|3.994101|0.070605|2.982980|2.649856|3.131765|2.662902|3.609765|2.245360|2.094820|1.825223|1.705892|1.780031|2.032892|15.493458|0.301427|0.299902|0.500000| |8.830783|17.574993|8.838883|58.850466|12.250447|9.721249|9.183836|5.213869|4.017565|0.113587|3.100281|2.683245|2.958966|6.622948|2.625673|2.759374|3.674149|0.065987|3.020718|2.853525|2.673550|2.366231|3.316139|2.099563|2.015790|1.762100|1.623747|1.663118|1.876068|13.857338|0.212213|0.212589|0.172964|0.500000| |6.804955|8.779915|17.580033|45.972556|9.761661|11.640487|5.866439|3.399596|3.103538|0.089016|2.487052|2.356644|2.751446|5.783342|2.576101|2.939576|4.181681|0.074005|3.335029|2.834034|3.373161|3.046826|4.445338|2.731244|2.626667|2.220226|1.998797|2.038531|2.347419|17.013115|0.169737|0.139143|0.201942|0.173022|0.500000| |5.457738|8.751837|17.609160|47.003769|12.497490|9.588254|5.988037|3.698876|3.376223|0.101708|2.664028|2.470174|2.812675|5.917768|2.511932|2.738951|3.938119|0.070686|3.337285|2.951561|3.000818|2.777750|4.122473|2.586155|2.547441|2.166502|1.932728|1.945010|2.213555|15.739802|0.140974|0.122256|0.139251|0.212847|0.300201|0.500000| |6.878008|8.901052|17.580057|36.958947|8.365815|8.100029|5.342697|3.225171|2.832221|0.081550|2.314878|2.135173|2.389626|4.996575|2.209168|2.413705|3.358982|0.060967|2.694272|2.421161|2.602825|2.398041|3.472853|2.224412|2.187810|1.903211|1.723380|1.737657|1.951219|14.005788|0.207799|0.140914|0.169114|0.212575|0.301390|0.301414|0.500000| |5.730128|5.819739|4.146237|61.986860|10.434980|13.856371|25.947306|9.213631|6.604772|0.147473|4.773932|4.057271|4.815228|12.988014|4.422904|4.595337|5.233413|0.090380|4.018550|3.921288|3.528018|2.823141|3.658402|2.250559|2.044340|1.787741|1.700980|1.809536|2.083122|16.507678|0.121693|0.188575|0.151441|0.147963|0.111328|0.106114|0.098331|0.500000| |3.881240|4.172701|3.202813|37.886631|8.627035|7.719709|12.762216|17.600646|8.786690|0.176359|7.093001|4.780509|4.705478|11.645073|3.939878|3.561632|4.198730|0.076582|3.369469|3.699346|2.714975|2.301715|3.025217|1.927510|1.785336|1.590834|1.519759|1.601023|1.803994|14.015273|0.092116|0.125120|0.097542|0.122567|0.082543|0.087022|0.079548|0.233166|0.500000| |4.107408|4.985603|3.802189|44.997529|11.867630|7.989142|12.425378|17.636104|8.836511|0.228405|6.063463|4.288264|4.305274|10.370363|3.428940|3.211804|4.070327|0.074093|3.472153|3.761820|2.673324|2.326175|3.152373|2.008841|1.892033|1.674117|1.574319|1.636169|1.842276|13.939517|0.098680|0.124448|0.099405|0.159165|0.093427|0.107743|0.093098|0.181056|0.303609|0.500000| |2.723046|2.923233|2.467609|26.550365|6.654780|6.054169|6.693074|6.978856|8.834448|0.174312|17.564310|8.762155|6.332570|12.414707|5.006628|3.866567|4.469456|0.084856|3.560433|4.407980|2.711595|2.324678|2.997488|1.936415|1.776036|1.599177|1.550753|1.650273|1.851064|14.578682|0.066739|0.082686|0.072229|0.082913|0.065775|0.068946|0.061731|0.136818|0.223908|0.156692|0.500000| |2.514634|2.814340|2.446700|25.198804|6.930672|5.552229|5.791450|6.129456|8.687872|0.217450|17.597023|8.652728|5.738332|10.431765|4.161283|3.340112|4.190792|0.080728|3.561643|4.623379|2.551080|2.264189|2.992455|1.954332|1.820403|1.641276|1.577775|1.658955|1.848823|14.181442|0.062619|0.074118|0.066041|0.081576|0.064351|0.070517|0.061271|0.109993|0.166176|0.160851|0.301804|0.500000| |2.264242|2.427423|2.162880|21.996861|5.661616|5.428376|4.832563|4.229809|5.827899|0.138255|8.701173|17.586557|8.675710|11.036813|7.226193|4.611999|5.343702|0.107635|4.123060|5.702211|3.024202|2.618488|3.288510|2.142557|1.928499|1.746189|1.722080|1.864387|2.096726|16.902802|0.056047|0.066294|0.062198|0.066703|0.059357|0.061094|0.054036|0.101685|0.118437|0.101197|0.224966|0.188172|0.500000| |2.250863|2.504257|2.276712|22.889699|6.337572|5.480836|4.756427|4.248667|6.349230|0.174377|8.707977|17.580280|8.725192|10.846462|5.746562|4.160534|5.414443|0.109344|4.684680|7.427283|3.051909|2.732824|3.535686|2.310604|2.105051|1.894731|1.844090|1.972273|2.219110|17.333282|0.055986|0.064548|0.061293|0.069466|0.061943|0.066022|0.056512|0.094925|0.110484|0.106937|0.176092|0.221765|0.303543|0.500000| |2.645742|2.733367|2.409266|25.493993|5.989960|6.966782|5.560656|4.215177|5.165862|0.118672|5.364670|6.768974|8.844249|13.039800|17.578455|8.978309|7.579966|0.143903|4.876270|5.551904|4.145071|3.255598|3.867369|2.430468|2.113508|1.885317|1.871518|2.074187|2.398181|20.554255|0.063941|0.077745|0.075484|0.071836|0.068194|0.066022|0.059473|0.129325|0.117578|0.095574|0.153927|0.115442|0.206024|0.141928|0.500000| |2.297335|2.429003|2.231719|22.262768|5.542169|6.098166|4.474350|3.416766|4.342322|0.109637|4.549029|6.586940|8.813322|10.272475|17.528479|8.808278|9.261010|0.204460|5.723247|6.947960|4.551558|3.735386|4.339396|2.758557|2.355780|2.106894|2.118589|2.388027|2.780904|24.386655|0.056450|0.065579|0.065754|0.063926|0.063666|0.062444|0.055175|0.098151|0.091517|0.081720|0.119295|0.104610|0.195942|0.157410|0.302510|0.500000| |3.449944|3.590743|3.187055|36.142558|7.820404|12.102186|6.859279|4.386768|4.956025|0.121782|4.130690|4.548270|6.887034|13.721480|8.806049|17.659035|12.447289|0.182239|6.925836|5.762348|7.207302|4.646072|5.342130|3.099953|2.613782|2.242520|2.181862|2.431674|2.941425|25.782851|0.080278|0.097470|0.103599|0.088506|0.094234|0.085636|0.075820|0.164872|0.112133|0.099948|0.110949|0.093886|0.117327|0.106957|0.214939|0.172848|0.500000| |2.656851|2.708595|2.504275|24.644938|5.668315|7.592396|4.720223|3.225052|3.669971|0.092981|3.407164|4.008236|5.507664|8.936130|8.786345|17.617240|12.391792|0.226954|5.586051|4.915656|7.158683|4.856795|5.181287|3.133820|2.579105|2.262972|2.276897|2.619834|3.165065|30.155020|0.064357|0.074894|0.079674|0.068385|0.074228|0.067951|0.061474|0.109003|0.085867|0.076783|0.092903|0.079969|0.111079|0.097644|0.212712|0.213244|0.299934|0.500000| |3.412325|4.047237|3.864858|43.908692|12.072979|12.949976|6.667236|4.502522|5.520678|0.163136|4.177385|4.554438|6.827176|13.239813|5.716360|6.911026|12.418522|0.181985|17.689850|8.835463|7.174803|5.528315|7.299942|3.954990|3.376473|2.751855|2.553828|2.765978|3.423370|27.163306|0.080690|0.090896|0.098316|0.100485|0.112942|0.112701|0.088013|0.133233|0.104175|0.110516|0.101270|0.100256|0.106244|0.118273|0.127878|0.132466|0.206390|0.142310|0.500000| |2.630405|3.025706|3.042013|28.393783|8.007480|7.928951|4.625940|3.307313|4.049768|0.122577|3.460186|4.028938|5.482009|8.747884|4.905339|5.591447|12.363361|0.226304|17.666741|8.776418|7.092125|6.999851|9.599780|5.216306|4.258844|3.392267|3.147390|3.459498|4.433280|34.059223|0.064731|0.070073|0.075775|0.077412|0.089169|0.090317|0.072270|0.093004|0.080184|0.084720|0.084017|0.086743|0.096932|0.112950|0.107787|0.129096|0.142578|0.126766|0.301361|0.500000| |2.290497|2.562213|2.433711|23.836227|6.606895|6.210957|4.438422|3.490107|4.745968|0.138028|4.653590|6.692145|8.815727|10.150703|6.949224|5.722067|9.219322|0.202691|8.801939|17.517875|4.528838|4.129650|5.187332|3.294119|2.857016|2.502212|2.443713|2.689569|3.160901|25.406843|0.056687|0.063609|0.064436|0.068198|0.068655|0.071010|0.059448|0.090398|0.087500|0.087643|0.108291|0.114569|0.155811|0.205181|0.141560|0.207010|0.132804|0.128801|0.173005|0.212808|0.500000| |2.629628|3.085888|2.905757|30.061752|9.234482|7.275738|5.435814|4.434409|6.524096|0.222705|5.600497|6.872481|8.774034|12.562189|5.545726|4.896643|7.594267|0.143789|9.032403|17.582937|4.143017|3.738555|5.024933|3.126536|2.818037|2.425425|2.287163|2.434544|2.844521|21.707657|0.064551|0.072547|0.072345|0.083274|0.079950|0.087150|0.069673|0.104746|0.104251|0.113548|0.120907|0.140339|0.141807|0.210390|0.123562|0.141352|0.128855|0.108009|0.216621|0.213164|0.303771|0.500000| |3.335514|3.602025|3.615682|33.220778|7.672449|11.941863|5.154272|3.256241|3.538337|0.097770|2.946642|3.183290|4.289158|8.034071|4.553475|6.743299|12.366967|0.182079|7.322836|4.730278|17.652490|8.935798|10.001548|4.830585|3.802416|3.041835|2.869405|3.223313|4.210914|36.421221|0.079820|0.086844|0.103978|0.085724|0.115646|0.098799|0.084589|0.110813|0.080850|0.081010|0.076684|0.072179|0.080971|0.082400|0.109045|0.111392|0.206222|0.165363|0.229267|0.184591|0.114436|0.114652|0.500000| |2.727608|2.805670|2.753782|24.577052|5.689749|8.051301|4.232005|2.777401|3.040330|0.081681|2.699466|3.018318|3.963776|6.891153|4.770281|7.541353|12.366517|0.214689|5.612709|4.158029|17.627296|8.901432|7.996570|4.437306|3.400006|2.868907|2.865972|3.387561|4.415102|46.130291|0.066716|0.073376|0.084485|0.068919|0.085473|0.074681|0.067181|0.093789|0.071809|0.068772|0.071909|0.066040|0.080216|0.077817|0.115643|0.123207|0.194843|0.233569|0.149016|0.142980|0.108460|0.097248|0.299955|0.500000| |2.101915|2.346822|2.645107|18.311705|4.933023|4.981943|2.934672|2.031988|2.190204|0.065280|1.950762|2.076857|2.404988|4.226535|2.325673|2.622962|4.442702|0.088706|3.516357|2.875101|3.720260|4.821872|9.509055|8.899912|17.742093|8.882627|5.606604|4.891030|5.626583|28.829813|0.054830|0.053907|0.061306|0.060179|0.080337|0.079127|0.066709|0.058577|0.051109|0.055078|0.049994|0.051651|0.053202|0.058595|0.057742|0.063232|0.072054|0.068800|0.096738|0.117860|0.077740|0.079927|0.105039|0.089052|0.500000| |1.655099|1.798775|1.975264|13.766443|3.652628|3.685282|2.308601|1.627955|1.748926|0.051452|1.612111|1.725370|1.931736|3.330764|1.902533|2.085037|3.386264|0.070356|2.572590|2.246023|2.735179|3.432685|5.663633|5.673455|8.968024|17.735665|8.893803|5.630748|4.982616|24.411322|0.043790|0.043150|0.047971|0.046988|0.058753|0.058054|0.051244|0.046462|0.041784|0.044275|0.041778|0.043157|0.045107|0.049100|0.047974|0.053016|0.056313|0.056200|0.068958|0.082726|0.062936|0.062098|0.074218|0.069320|0.213851|0.500000| |1.487136|1.583753|1.689982|12.252083|3.189002|3.317821|2.111804|1.497934|1.619707|0.046843|1.524588|1.659818|1.848599|3.121866|1.876378|2.049545|3.291943|0.070796|2.380878|2.116306|2.638943|3.330804|4.971745|4.970844|5.638714|8.890080|17.731924|8.976543|5.692810|27.362791|0.039212|0.039325|0.043305|0.041422|0.050164|0.048748|0.043919|0.043131|0.038966|0.040289|0.039866|0.040619|0.044174|0.047141|0.047462|0.053442|0.054171|0.056688|0.062187|0.074951|0.060856|0.057037|0.068694|0.069228|0.123724|0.215678|0.500000| |1.573314|1.657170|1.730733|13.121351|3.356966|3.639949|2.288598|1.618127|1.769060|0.050377|1.675693|1.863875|2.113267|3.500739|2.226292|2.479153|4.035654|0.090134|2.742577|2.407019|3.276650|4.292708|5.763834|5.594502|4.890752|5.606511|8.906900|17.739736|8.843950|43.869476|0.040989|0.041967|0.046254|0.043007|0.051700|0.049264|0.044517|0.047477|0.042311|0.042801|0.044024|0.043995|0.050159|0.052416|0.055837|0.064533|0.063812|0.070409|0.069716|0.085304|0.070337|0.062625|0.080798|0.088272|0.106499|0.123869|0.215346|0.500000| 1955.672761 -11007.157983 4091.154890 -209.477394 -5169.807727 3212.257731 -1957.549996 2.000960 40AAD0000000000B 4419619BB2E70A81 439C9FB2F91F9F95 41CA4F7E18000001 C052000000000000 43413F809E8F8CA3