Version2.0 2020-01-21T00:20:04Z 10.1021/jm300687e Gaussian16 RevisionB.01 PWARBURT 12-Sep-2019 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE Cc1cccc(c1)NC(=O)C2=C3N(C(=O)[C@@H](S3)CC(=O)OC)C(=C([C@H]2c4ccc(cc4)OC)C#N)N C03770092 RHF 6-31G(d) (6D,7F) Cc1cccc(c1)NC(=O)C2=C3N(C(=O)[C@@H](S3)CC(=O)OC)C(=C([C@H]2c4ccc(cc4)OC)C#N)N C01[X(C26H24N4O5S1)] 174 C1 592 COC(=O)C[C@@H]1SC2=C(C(=O)Nc3cccc(c3)C)[C@@H](C(=C(N2C1=O)N)C#N)c1ccc(cc1)OC COC(=O)C[C@@H]1SC2=C(C(=O)Nc3cccc(c3)C)[C@@H](C(=C(N2C1=O)N)C#N)c1ccc(cc1)OC COC(=O)C[C@@H]1SC2=C([C@H](c3ccc(OC)cc3)C(=C(N)N2C1=O)C#N)C(=O)Nc4cccc(C)c4 InChIKey=WHKWPZXBVUJWLV-PZJWPPBQSA-N InChI=1S/C26H24N4O5S/c1-14-5-4-6-16(11-14)29-24(32)22-21(15-7-9-17(34-2)10-8-15)18(13-27)23(28)30-25(33)19(36-26(22)30)12-20(31)35-3/h4-11,19,21H,12,28H2,1-3H3,(H,29,32)/t19-,21+/m0/s1 InChI=1/C26H24N4O5S/c1-14-5-4-6-16(11-14)29-24(32)22-21(15-7-9-17(34-2)10-8-15)18(13-27)23(28)30-25(33)19(36-26(22)30)12-20(31)35-3/h4-11,19,21H,12,28H2,1-3H3,(H,29,32)/t19-,21+/m0/s1/f/h29H Cc1cccc(c1)NC(=O)C2=C3N(C(=O)[C@@H](S3)CC(=O)OC)C(=C([C@H]2c4ccc(cc4)OC)C#N)N C01[X(C26H24N4O5S1)] 174 C01 592 COC(=O)C[C@@H]1SC2=C(C(=O)Nc3cccc(c3)C)[C@@H](C(=C(N2C1=O)N)C#N)c1ccc(cc1)OC COC(=O)C[C@@H]1SC2=C(C(=O)Nc3cccc(c3)C)[C@@H](C(=C(N2C1=O)N)C#N)c1ccc(cc1)OC COC(=O)C[C@@H]1SC2=C([C@H](c3ccc(OC)cc3)C(=C(N)N2C1=O)C#N)C(=O)Nc4cccc(C)c4 InChIKey=WHKWPZXBVUJWLV-PZJWPPBQSA-N InChI=1S/C26H24N4O5S/c1-14-5-4-6-16(11-14)29-24(32)22-21(15-7-9-17(34-2)10-8-15)18(13-27)23(28)30-25(33)19(36-26(22)30)12-20(31)35-3/h4-11,19,21H,12,28H2,1-3H3,(H,29,32)/t19-,21+/m0/s1 InChI=1/C26H24N4O5S/c1-14-5-4-6-16(11-14)29-24(32)22-21(15-7-9-17(34-2)10-8-15)18(13-27)23(28)30-25(33)19(36-26(22)30)12-20(31)35-3/h4-11,19,21H,12,28H2,1-3H3,(H,29,32)/t19-,21+/m0/s1/f/h29H 3982.8995791957 -1988.2018199 1-A 20576.7069 132 460 592 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -91.98014 -20.62544 -20.59903 -20.58936 -20.56914 -20.53680 -15.66959 -15.60289 -15.59421 -15.56562 -11.40999 -11.39791 -11.37238 -11.36769 -11.35174 -11.31081 -11.29967 -11.29566 -11.29077 -11.28100 -11.28096 -11.27268 -11.27130 -11.26261 -11.26174 -11.25136 -11.24981 -11.24753 -11.24198 -11.23998 -11.23673 -11.22789 -11.22489 -11.22177 -11.21759 -11.21577 -8.98863 -6.67076 -6.66973 -6.66738 -1.49295 -1.46270 -1.42895 -1.40806 -1.38723 -1.35465 -1.26187 -1.25749 -1.22151 -1.17825 -1.14877 -1.14221 -1.13157 -1.08469 -1.04601 -1.04313 -1.03592 -1.03256 -1.01410 -0.98531 -0.97410 -0.94612 -0.93563 -0.90797 -0.89387 -0.87500 -0.85075 -0.83767 -0.82874 -0.81166 -0.79293 -0.77415 -0.76227 -0.74334 -0.73825 -0.73439 -0.73322 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8.5623 7.2012 5.7526 5.7555 6.2112 2.5206 4.5301 5.3614 5.7783 5.8024 4.6703 5.5399 4.6334 5.6215 1.4482 4.9543 1.3314 2.2119 3.1823 1.5248 3.7873 4.1789 1.4320 3.9177 2.1632 1.9471 4.9071 2.1864 1.3744 3.5873 2.6235 2.8385 1.3247 3.8300 1.5305 5.6751 2.9444 1.9651 1.7238 3.4786 2.7554 2.7809 3.1399 1.2669 1.2683 1.6105 1.3346 1.9745 1.2198 1.5582 2.4390 1.5190 2.0392 3.3803 1.6942 3.8314 1.9899 2.1346 2.6952 2.0135 1.4647 1.3942 2.2059 1.8513 2.5292 2.9218 2.2249 1.2558 2.4601 2.5122 1.0988 1.2016 1.0548 1.3067 1.1702 1.0476 1.0562 1.0477 1.0560 2.1851 2.4040 2.1685 5.3658 5.5228 3.6479 5.1781 4.5921 1.7028 3.5967 9.1959 10.1481 11.6031 12.6853 1.0850 1.0387 1.0344 1.0617 1.0292 1.1006 1.1077 1.1031 1.0968 1.0921 1.1019 1.1093 1.0916 1.0888 1.1093 1.0907 1.0899 1.0958 1.0947 1.0933 1.0937 1.0478 1.0778 1.1034 0.0005 0.0006 0.0008 0.0004 0.0022 0.0049 0.0042 0.0077 0.0083 0.0143 0.0124 0.0206 0.0300 0.0317 0.0466 0.0491 0.0909 0.0233 0.0556 0.0656 0.0556 0.1274 0.1537 0.1840 0.0949 0.2220 0.0632 0.1679 0.1526 0.2248 0.2212 0.2889 0.4116 0.5883 0.5029 0.9199 0.6990 0.4767 0.2679 0.5405 0.5233 0.4435 0.2743 0.4052 0.6045 1.2885 1.5277 0.9726 1.0754 0.3662 0.3498 0.4227 0.9039 1.3105 0.6874 0.7504 0.9145 2.2669 2.0465 1.8200 1.8894 2.1049 0.8806 1.6036 1.9449 2.2546 2.3855 1.9475 2.4091 2.0412 2.5486 0.6774 2.4734 0.6782 1.1696 1.7656 0.8661 2.1875 2.5201 0.8847 2.4438 1.4617 1.3362 3.3931 1.5278 0.9725 2.5909 1.8982 2.0662 0.9717 3.0596 1.2377 4.6694 2.4733 1.6837 1.4814 3.0853 2.5261 2.6067 2.9960 1.2499 1.2587 1.6010 1.3335 1.9990 1.2421 1.6083 2.5501 1.5960 2.1591 3.6711 1.8580 4.4215 2.3310 2.5503 3.2348 2.4694 1.8307 1.7749 2.8577 2.4259 3.3343 4.1986 3.2106 1.8171 3.6203 3.7369 1.6720 1.8846 1.6576 2.0638 1.8534 1.6647 1.6898 1.6835 1.7141 3.5966 4.0733 3.8934 9.8989 10.2647 6.9753 10.0731 8.9535 3.3432 7.3113 20.2649 23.5945 27.5533 49.3063 6.5578 6.2814 6.2795 6.5690 6.4316 6.8842 6.9929 6.9958 6.9603 6.9887 7.2086 7.2957 7.1832 7.2124 7.3724 7.2508 7.2968 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7.4295 22.7380 31.7012 4.6388 40.7867 22.3503 5.1797 6.3446 4.8465 30.2285 210.8673 152.4990 485.7160 146.3217 88.4141 0.9948 67.2662 208.0045 150.5427 704.7066 462.3677 407.2350 258.1551 97.9060 24.3421 36.7997 46.0060 7.1933 38.3959 28.1310 52.3353 23.3759 3.5093 3.7989 43.6591 24.9326 19.4954 10.5022 23.7409 9.8689 12.2282 35.8205 6.5943 11.3992 0.8081 102.6538 117.0931 121.1422 2.8644 1.1778 3.2446 0.9692 1.1370 3.2342 4.7053 2.0020 2.1115 2.0462 0.5321 2.7236 0.1956 1.8444 0.3014 0.4106 1.9620 0.2567 0.2964 0.2266 0.2680 1.4253 1.6143 1.7692 1.7298 1.9560 0.9713 2.7345 1.2108 1.3594 1.2088 0.4189 1.9381 0.6097 1.0304 2.7228 1.7174 3.2240 3.4073 1.2923 2.1420 1.1937 1.3876 0.8636 1.6282 5.4779 2.4718 9.2327 1.3956 2.0964 3.7111 0.9378 1.2424 1.2109 4.5284 2.1523 1.0993 1.4450 5.8276 3.7644 4.8881 4.1312 0.4768 3.7079 2.2996 5.3139 15.6942 10.5689 4.1998 8.9953 10.6301 1.3001 34.6770 2.8374 3.9933 1.7531 1.8722 2.8486 5.2353 2.0396 7.3709 0.7452 2.6343 41.2450 2.9024 0.6750 4.9218 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0.00512 0.99994 -0.00930 -0.00150 0.00930 0.99996 1 0.00536 0.00331 0.00268 0.11166 0.06905 0.05590 17.66 21.50 31.16 34.77 40.61 50.96 60.02 64.83 69.92 87.66 96.08 121.66 131.14 141.92 154.69 173.01 189.48 225.42 238.89 250.18 269.98 283.17 305.49 314.47 329.25 352.40 381.56 396.48 415.63 419.14 447.58 463.10 506.47 530.92 542.70 569.36 593.79 618.79 653.52 661.09 669.26 670.25 708.80 712.92 731.61 788.84 804.74 809.70 839.07 854.69 858.58 861.87 889.50 906.73 917.10 920.79 932.30 964.46 999.24 1054.33 1073.97 1091.19 1107.94 1115.22 1128.94 1170.86 1201.87 1210.42 1236.09 1244.11 1262.11 1281.93 1324.42 1337.78 1363.03 1396.18 1412.69 1424.53 1455.62 1473.30 1480.41 1540.82 1552.82 1558.67 1566.89 1576.73 1592.97 1594.38 1599.22 1605.38 1675.31 1685.60 1700.25 1717.93 1735.04 1737.68 1765.28 1794.75 1814.77 1830.96 1861.80 1867.31 1868.87 1873.63 1885.98 1891.49 1904.28 1916.62 1921.35 1928.73 1953.40 1962.94 2013.61 2028.75 2048.84 2053.52 2075.83 2095.57 2114.90 2133.44 2145.69 2152.17 2246.97 2251.70 2254.70 2273.85 2286.09 2312.14 2347.46 2349.74 2355.69 2358.95 2362.92 2370.95 2376.03 2388.06 2404.79 2439.90 2511.64 2545.92 2555.42 2591.98 2614.36 2617.33 2626.45 2672.48 2782.56 2858.13 2888.47 3695.47 4608.28 4609.48 4618.31 4662.57 4685.66 4687.98 4709.71 4720.45 4721.90 4741.70 4794.31 4807.08 4808.45 4824.19 4832.29 4832.83 4849.94 4855.69 4888.24 4901.56 4983.00 5491.90 5597.03 5656.67 0.502759 0.534877 0.535821 0.433220 -1987.699061 -1987.666943 -1987.665998 -1987.768600 3.441288D-04 MUNgauss RevisionA2.0 retrievium 21-Jan-2020 DUDE Cc1cccc(c1)NC(=O)C2=C3N(C(=O)[C@@H](S3)CC(=O)OC)C(=C([C@H]2c4ccc(cc4)OC)C#N)N C03770092 RHF 6-31G(d) (6D,10F) C1 504.146742 |X|Y|Z| 78.272376 107.452455 53.889566 76.814495 23 6 7 16 20 2 1 |36.858105| |12.606303|36.858105| |7.551324|13.690273|36.858105| |5.026229|7.934618|13.795084|36.858105| |4.415246|6.794960|7.883713|13.733601|36.858105| |5.000972|7.860438|6.859486|7.982104|13.733639|36.858105| |7.566005|13.766374|7.985058|6.944638|7.922737|13.665668|36.858105| |3.889657|5.184012|4.551040|5.132640|7.710090|13.494032|7.990836|53.358707| |3.080490|3.899195|3.677977|4.310999|6.257087|7.655121|5.190273|19.114804|36.858105| |2.857688|3.628991|3.639550|4.509893|6.595976|6.586797|4.500523|11.492890|15.824611|73.516695| |2.629798|3.131003|2.907349|3.238884|4.220083|5.030666|4.001039|10.714843|12.732428|14.415127|36.858105| |2.253029|2.629875|2.509001|2.807018|3.522568|3.894986|3.195771|7.178311|7.862673|12.352110|14.297312|36.858105| |1.983854|2.248473|2.136845|2.335107|2.811331|3.087611|2.666860|5.379130|5.075994|8.167025|7.922976|13.483642|53.358707| |1.774877|1.991738|1.920013|2.096967|2.468428|2.631243|2.303485|4.353949|3.985065|6.883927|5.287472|8.040949|18.780961|36.858105| |1.619269|1.789296|1.722397|1.857632|2.144016|2.280466|2.042116|3.685455|3.221197|5.544935|4.096452|5.445128|11.342076|15.959500|73.516695| |1.782443|2.022286|1.985946|2.206292|2.601649|2.690297|2.315621|4.346945|4.078327|7.610219|4.892221|7.381895|10.798225|12.614615|14.248366|36.858105| |1.661204|1.877467|1.863298|2.075377|2.416947|2.452396|2.120396|3.874315|3.556328|6.767003|4.104185|5.722561|8.436424|9.097293|12.629610|17.618094|0.500000| |2.089443|2.448588|2.425875|2.782439|3.434982|3.510907|2.862697|5.839612|6.138607|12.661224|6.837525|10.766190|9.889529|7.085347|8.809421|10.504718|0.221282|388.023441| |1.699775|1.904972|1.869550|2.050489|2.366811|2.444243|2.152349|3.837901|3.434185|6.385464|3.909750|5.183900|7.391384|7.634209|11.514986|12.463263|0.247599|48.159574|36.858105| |1.634444|1.834157|1.832849|2.026036|2.304533|2.311123|2.034700|3.506677|3.088000|5.994716|3.279580|4.080387|5.418764|4.966679|7.846777|7.579881|0.196688|40.878541|12.617529|36.858105| |1.620483|1.830478|1.854397|2.076456|2.359558|2.314963|2.017108|3.471792|3.075086|6.166995|3.178313|3.915854|5.057437|4.473669|6.988021|6.843306|0.202810|41.566782|7.965893|16.025737|73.516695| |1.567079|1.738426|1.733988|1.892008|2.114648|2.125978|1.907830|3.169849|2.702157|5.158968|2.827894|3.352495|4.483041|3.942909|6.551126|5.183423|0.134041|30.532457|8.147906|14.454401|15.278110|73.516695| |1.486393|1.643076|1.659391|1.811561|1.990320|1.965141|1.774167|2.860099|2.394280|4.630569|2.431329|2.790759|3.674296|3.109119|5.214884|3.930201|0.106897|25.122431|5.192907|8.152832|12.785876|23.837762|36.858105| |1.961057|2.187738|2.048577|2.196644|2.607745|2.919373|2.595567|5.063694|4.412084|6.802804|6.714718|7.814767|18.398777|7.716660|11.772459|5.078511|0.122876|34.289943|3.972121|3.100521|5.200954|4.772241|2.265824|36.858105| |2.193228|2.449091|2.245022|2.380876|2.849521|3.311861|2.972961|5.944189|4.913402|7.075534|7.661363|6.886277|10.951598|5.215363|8.101972|4.006890|0.098178|30.043605|3.299385|2.695711|4.568475|4.241239|2.055071|14.183901|36.858105| |2.639915|3.033939|2.721483|2.899528|3.605223|4.459493|3.884589|8.975972|7.257174|9.133178|12.530915|7.658405|9.012513|4.499145|6.719200|3.845824|0.092800|32.361284|3.228834|2.711197|4.624444|4.287109|2.094998|7.529092|12.576665|36.858105| |2.798818|3.235978|2.886234|3.066144|3.817928|4.776939|4.174420|9.469936|6.866013|8.764848|9.006623|5.916558|6.990644|3.745574|5.734124|3.312975|0.082715|28.152320|2.797044|2.423483|4.211510|3.851648|1.917969|5.855065|9.044896|17.534850|0.500000| |2.859636|3.194403|2.757252|2.826493|3.409031|4.373919|4.135993|8.264267|5.745857|7.575512|7.440392|5.409660|6.696071|3.739616|5.840676|3.281747|0.078979|26.561766|2.957002|2.509634|4.203433|4.099361|2.011643|5.404575|7.567045|12.425074|0.249597|36.858105| |3.083588|3.313007|2.772570|2.742180|3.194696|4.122589|4.238141|7.078964|4.485857|6.220052|5.085749|3.944405|5.024525|2.967432|4.793830|2.652868|0.065735|21.112197|2.431368|2.122130|3.592012|3.517992|1.760675|4.141686|5.606600|7.508835|0.204917|13.659629|36.858105| |3.113163|3.182565|2.631859|2.531088|2.844836|3.585322|3.900758|5.665899|3.604132|5.253788|3.889421|3.215562|4.163094|2.577878|4.251834|2.342962|0.058349|18.245123|2.217499|1.959476|3.295968|3.312588|1.670371|3.337939|4.143907|4.990478|0.133867|7.874261|13.811846|36.858105| |2.907454|2.968379|2.495557|2.410542|2.692390|3.320411|3.561696|5.176539|3.419062|5.099774|3.686298|3.165826|4.121481|2.616413|4.338027|2.398621|0.059101|18.395134|2.335766|2.057716|3.410494|3.529421|1.770110|3.196692|3.754606|4.391979|0.111172|6.792213|7.935052|13.695314|36.858105| |2.719098|2.882633|2.483765|2.465783|2.814863|3.446082|3.501289|5.586868|3.884680|5.764396|4.340256|3.784924|4.901541|3.098695|5.065739|2.831296|0.068110|21.651077|2.789132|2.404197|3.917966|4.117511|2.025584|3.678887|4.201880|4.962529|0.116827|7.866626|6.895651|7.944323|13.726804|36.858105| |2.702499|2.982325|2.603635|2.662253|3.156094|3.921437|3.745685|6.943480|5.073086|7.127161|6.256537|5.173821|6.517325|3.852879|6.060644|3.432535|0.080714|26.971928|3.249189|2.721007|4.440316|4.524793|2.189541|4.859382|5.769389|7.450432|0.156372|13.754106|8.010074|6.909993|7.936842|13.732794|36.858105| |2.771944|2.720471|2.301428|2.185844|2.371377|2.839671|3.114591|4.212224|2.798315|4.319595|2.935627|2.602385|3.422664|2.240837|3.776218|2.083490|0.052000|15.750505|2.063585|1.849741|3.071180|3.220174|1.635597|2.631501|2.988030|3.354142|0.087342|4.592945|5.299950|8.206617|14.156858|7.868540|5.200979|73.516695| |2.486300|2.446059|2.118342|2.025162|2.177716|2.540164|2.736237|3.718920|2.540434|4.019130|2.652808|2.426802|3.213875|2.160380|3.673014|2.032635|0.050700|15.119087|2.064003|1.861578|3.062743|3.295772|1.677034|2.417608|2.646592|2.904912|0.074669|3.774933|3.989087|5.260563|8.014265|6.721174|4.514422|24.187920|36.858105| |2.080707|2.265606|2.064689|2.146810|2.497746|2.883321|2.693608|4.897828|3.767413|5.607846|5.021134|4.550046|7.061654|3.934988|6.589587|3.137873|0.079754|22.891062|2.691196|2.262395|3.856765|3.633079|1.791426|8.012703|13.323156|7.566437|0.198297|6.081897|5.473754|4.150783|3.603803|3.761173|4.675449|5.223984|2.561830|36.858105| |1.969306|2.105306|1.918079|1.970086|2.246387|2.566857|2.455566|4.196137|3.134844|4.778162|3.898105|3.579535|5.446617|3.249580|5.612843|2.664855|0.068993|19.226675|2.338586|2.002615|3.427301|3.255593|1.623984|5.587387|7.415193|5.385675|0.151379|4.831648|4.831200|3.888002|3.331730|3.331536|3.879893|4.985661|2.437415|16.721850|53.358707| |1.729794|1.899290|1.793131|1.908848|2.212614|2.424801|2.199211|4.016371|3.378410|5.438237|4.562551|5.249113|11.004949|6.746547|12.612597|4.455056|0.114680|27.657945|3.614719|2.861908|4.813690|4.456330|2.133259|14.023529|7.969859|5.016206|0.120219|4.050111|3.374083|2.848059|2.745483|3.072751|3.769419|4.153555|2.175481|6.833714|7.394817|53.358707| |17.534964|8.848862|6.500452|4.537034|3.966452|4.358339|6.059521|4.759602|2.819063|4.666324|2.444209|2.105851|2.549883|1.677610|2.734854|1.676290|0.043726|13.860331|1.589489|1.528682|2.706270|2.599128|1.389958|1.870078|2.094382|2.484145|0.074285|2.645125|2.888878|2.892292|2.649232|2.458252|2.459470|4.509328|2.266000|2.016381|2.625430|2.264555|0.500000| |17.577000|8.826935|5.582362|4.185020|3.953578|4.731655|7.223276|5.325792|3.081523|4.966338|2.695161|2.294761|2.772490|1.814027|2.951968|1.802008|0.046369|14.869818|1.725085|1.642281|2.869134|2.807566|1.487581|2.032132|2.294210|2.771453|0.081064|3.110516|3.452359|3.610270|3.355912|3.043087|2.950329|5.748236|2.841739|2.190675|2.828992|2.434846|0.301875|0.500000| |17.558911|8.842297|6.918328|4.659851|3.952188|4.231540|5.755725|4.577122|2.767034|4.668289|2.378642|2.079272|2.505611|1.668926|2.718217|1.690119|0.043872|13.984212|1.629754|1.582418|2.789918|2.719452|1.462631|1.805569|1.989312|2.355405|0.068264|2.544539|2.695116|2.755013|2.649516|2.507729|2.464277|4.580424|2.371664|1.884037|2.431486|2.184443|0.302262|0.301652|0.500000| |6.992965|8.892570|17.702994|8.927050|5.624898|4.943939|5.661580|4.927762|3.052641|5.432720|2.498248|2.202274|2.597615|1.736373|2.795362|1.797686|0.047202|15.317374|1.706811|1.686616|3.039180|2.858564|1.553243|1.836247|1.994192|2.361327|0.069209|2.398526|2.429923|2.344641|2.239624|2.214523|2.287928|3.742033|1.957654|1.855511|2.369477|2.216642|0.179015|0.140869|0.201809|0.500000| |4.096385|5.645956|8.946672|17.710379|8.964571|5.674187|4.988528|5.651508|3.736169|7.235631|2.892894|2.585861|2.960108|1.984471|3.139637|2.112437|0.055866|18.790540|1.970000|1.977847|3.646327|3.287948|1.793732|2.034579|2.169267|2.574344|0.075080|2.479774|2.393137|2.220387|2.132230|2.191339|2.358723|3.471654|1.830843|1.963762|2.464755|2.435787|0.106286|0.096242|0.110138|0.215790|0.500000| |3.538972|4.920129|5.631933|8.905012|17.831281|8.904978|5.639188|9.489934|6.783369|14.878700|4.460004|3.840578|4.084876|2.651429|4.045537|2.858079|0.074272|27.892228|2.556242|2.514226|4.656903|4.034935|2.137962|2.719503|2.907370|3.614814|0.104956|3.276508|2.984231|2.628841|2.508633|2.672248|3.051195|3.919557|2.045084|2.508146|3.046548|3.136879|0.090436|0.090171|0.090181|0.124070|0.216073|0.500000| |7.030832|8.943401|5.664094|4.986322|5.643540|8.913790|17.682093|10.103472|4.894125|7.221212|4.058658|3.200905|3.706740|2.330451|3.698269|2.294198|0.057983|19.704373|2.141248|1.993727|3.472685|3.337572|1.731479|2.707529|3.171234|4.197253|0.124995|4.797476|5.229368|4.909067|4.327003|4.077072|4.264363|6.598055|3.139880|2.912064|3.624800|3.112651|0.159439|0.221688|0.147633|0.124287|0.108080|0.124105|0.500000| |3.944682|4.956252|4.107825|4.313969|5.758878|9.376985|7.736825|26.097526|9.476303|10.911420|7.584835|5.002187|5.376401|3.152816|4.815433|3.038834|0.074902|27.465283|2.713200|2.437657|4.227613|3.958014|1.997513|3.890376|4.807548|7.771687|0.230023|8.107721|7.070258|5.296183|4.618514|4.875575|6.174929|6.405341|3.072835|4.020481|4.670715|4.172229|0.098651|0.115212|0.093365|0.092945|0.098483|0.143085|0.239786|0.500000| |1.801967|2.017320|1.959383|2.132800|2.468033|2.591776|2.296300|4.096322|3.633163|6.602534|4.142436|5.319633|7.321614|6.756496|10.187760|8.759327|0.173554|45.287609|17.577624|8.972223|10.847748|13.390974|4.884681|3.999243|3.415354|3.428905|0.081053|3.251331|2.633969|2.422995|2.605995|3.200214|3.730535|4.068826|2.310694|2.766509|3.258770|4.806728|0.046434|0.051152|0.048014|0.049498|0.056363|0.073053|0.063948|0.081220|0.500000| |1.570366|1.738173|1.700136|1.844245|2.100854|2.177107|1.949255|3.390839|2.951785|5.379173|3.390745|4.339841|6.663120|7.163536|12.872151|8.862387|0.211849|36.089878|17.557144|9.013755|11.206733|12.833181|4.799184|3.799260|3.111445|2.942004|0.071307|2.724687|2.276756|2.095648|2.209943|2.612056|2.985236|3.505808|1.983316|2.603247|3.116524|4.962283|0.041011|0.044420|0.041883|0.043412|0.049313|0.062375|0.054278|0.067570|0.303067|0.500000| |1.397463|1.541149|1.561701|1.706271|1.867808|1.835352|1.657986|2.667463|2.230340|4.314889|2.275900|2.618815|3.498616|2.988532|5.091110|3.752385|0.106898|23.456083|4.728008|7.205830|12.725942|16.422841|17.639023|2.175708|1.962082|1.976153|0.050624|1.878043|1.654294|1.564378|1.642752|1.860764|2.015006|2.702880|1.550286|1.723264|2.136180|2.830118|0.036527|0.038760|0.038149|0.040746|0.047176|0.055922|0.044915|0.051769|0.117553|0.126527|0.500000| |1.563255|1.741011|1.774937|1.954778|2.144980|2.089137|1.872809|3.007660|2.521165|4.973742|2.495368|2.830843|3.615827|2.978134|4.882335|3.796942|0.102744|26.088161|4.723733|7.221244|12.758876|16.428707|17.641729|2.225940|2.045406|2.121859|0.054280|2.034274|1.782962|1.688599|1.783499|2.034747|2.203100|2.926245|1.681215|1.777722|2.190530|2.815155|0.040483|0.043203|0.042854|0.046132|0.054092|0.064459|0.050289|0.057697|0.126214|0.115784|0.300055|0.500000| |1.436856|1.573556|1.582647|1.708881|1.859318|1.847007|1.689778|2.670949|2.197793|4.186357|2.232368|2.516344|3.340640|2.788880|4.759996|3.365450|0.090403|21.680600|4.393462|5.953898|9.174813|16.912108|17.669921|2.100120|1.921692|1.958312|0.049865|1.911733|1.687331|1.619189|1.729961|1.974681|2.098548|2.869911|1.673002|1.692616|2.101855|2.706034|0.037292|0.040079|0.039452|0.041349|0.046916|0.054809|0.046041|0.052266|0.120587|0.117254|0.298527|0.298465|0.500000| |3.084443|3.305836|2.778221|2.744375|3.178268|4.055173|4.176543|6.801411|4.259386|5.976647|4.722856|3.676642|4.704289|2.783310|4.516671|2.493332|0.062835|19.901880|2.253084|1.986814|3.405896|3.276520|1.653820|3.956755|5.445924|6.992915|0.225788|8.889731|17.696714|8.985863|5.654689|4.962318|5.671314|7.626657|3.336153|5.746428|7.196269|4.477461|0.082387|0.094683|0.073961|0.067795|0.066654|0.082424|0.140658|0.182793|0.066558|0.058830|0.043507|0.046596|0.043896|0.500000| |3.136612|3.085448|2.541034|2.399320|2.632282|3.254370|3.647340|4.910402|3.109053|4.644249|3.270929|2.758852|3.598746|2.268466|3.783087|2.078055|0.052462|16.079393|1.972247|1.765775|2.990740|2.998899|1.528320|2.890150|3.519501|4.072072|0.114225|5.609504|8.894474|17.739816|8.956538|5.662146|4.973041|13.482223|4.870542|3.667557|4.887480|3.452983|0.082496|0.102538|0.076890|0.063708|0.058735|0.067175|0.127067|0.123142|0.059218|0.052120|0.039959|0.042940|0.041279|0.215615|0.500000| |2.512731|2.645195|2.321235|2.309051|2.599612|3.085788|3.118961|4.843508|3.461718|5.337993|3.794812|3.480475|4.558705|3.002457|4.968977|2.791658|0.067032|20.870891|2.850326|2.468508|3.967920|4.314120|2.117007|3.321252|3.600116|4.068162|0.096820|5.634960|4.967624|5.636602|8.866552|17.762473|8.959004|12.475366|7.441348|3.224452|3.936622|3.871755|0.062953|0.077373|0.065696|0.058120|0.057664|0.069130|0.097838|0.111840|0.092567|0.074546|0.053563|0.058795|0.057957|0.107746|0.124163|0.500000| |2.489391|2.782547|2.498703|2.610420|3.117209|3.738084|3.432652|6.605152|5.300554|7.689552|6.840270|6.216949|7.775100|4.630377|7.075802|4.131777|0.093644|32.119114|3.957824|3.200568|5.112773|5.275656|2.488921|5.297626|5.697999|6.893324|0.140996|8.923843|5.669129|4.971391|5.662160|8.980946|17.717314|7.468257|3.921421|4.353122|4.860708|5.483841|0.062979|0.073974|0.063946|0.061204|0.065063|0.085931|0.103776|0.150471|0.131194|0.099036|0.063012|0.069256|0.065837|0.124235|0.107869|0.218651|0.500000| |2.629801|2.605350|2.257830|2.157315|2.316697|2.698966|2.909205|3.907609|2.666308|4.248951|2.727639|2.497426|3.246660|2.193550|3.691960|2.100549|0.052156|15.813551|2.153854|1.958756|3.215570|3.489138|1.779024|2.386101|2.587225|2.895012|0.074089|3.721812|3.790888|4.755835|7.023525|6.721164|4.574438|16.435503|17.560894|2.445124|3.124163|2.895294|0.065456|0.083310|0.070416|0.057832|0.054057|0.060231|0.091918|0.088625|0.067629|0.056930|0.045327|0.049831|0.049413|0.088141|0.119657|0.224148|0.113349|0.500000| |2.376294|2.287845|1.990985|1.886115|1.996998|2.297750|2.499506|3.297812|2.247819|3.599471|2.321966|2.137824|2.840931|1.927165|3.299739|1.822921|0.045952|13.509345|1.851661|1.689438|2.796805|3.003077|1.544465|2.142695|2.332674|2.529649|0.066203|3.172871|3.415658|4.419491|5.885142|4.902022|3.618748|17.004043|17.650272|2.293576|3.017479|2.663356|0.060698|0.075491|0.063583|0.051717|0.047650|0.052025|0.078972|0.074818|0.056943|0.049695|0.039848|0.043019|0.042956|0.082292|0.121351|0.145628|0.089185|0.300025|0.500000| |2.222508|2.221102|1.954842|1.896797|2.054270|2.371675|2.491196|3.529251|2.473305|3.928726|2.646867|2.469830|3.342500|2.268295|3.902830|2.109058|0.052443|15.342646|2.161095|1.926813|3.141078|3.423809|1.727361|2.525086|2.722557|2.903418|0.073430|3.729047|3.802132|4.773329|7.046383|6.726703|4.580141|16.438439|17.562265|2.637348|3.412604|3.122575|0.056770|0.069253|0.058937|0.050218|0.047992|0.054307|0.078138|0.080388|0.067521|0.058276|0.044362|0.047668|0.048004|0.088443|0.120169|0.223145|0.113332|0.298801|0.300006|0.500000| |1.626910|1.780674|1.692402|1.802953|2.074132|2.245891|2.041575|3.659709|3.089421|5.098338|4.038559|4.834409|10.203598|7.655197|17.242143|4.804355|0.124888|27.409456|3.970105|3.073596|5.098610|4.780490|2.261868|9.412202|5.893294|4.195683|0.100831|3.556304|2.981544|2.590805|2.557983|2.892648|3.470460|3.927676|2.095758|5.114061|5.875176|26.063688|0.043364|0.046647|0.042254|0.042914|0.047262|0.060237|0.058650|0.076766|0.105680|0.115615|0.061531|0.060109|0.058529|0.079725|0.064387|0.076221|0.105646|0.057187|0.052495|0.061885|0.500000| |1.695652|1.841410|1.727767|1.819512|2.087734|2.300168|2.122263|3.765400|3.062186|4.891504|4.003402|4.306608|7.998912|5.015317|9.473689|3.619975|0.094367|23.290893|3.067019|2.499109|4.219061|3.970690|1.928610|9.509346|7.416003|4.669978|0.115875|3.926254|3.409276|2.895620|2.751241|3.000980|3.588411|4.188624|2.175282|7.884339|9.100999|26.032766|0.045555|0.048937|0.043617|0.043754|0.047312|0.059721|0.061857|0.081039|0.084375|0.086367|0.052266|0.052037|0.050405|0.093743|0.072462|0.076599|0.102585|0.058324|0.054656|0.063834|0.313579|0.500000| 1985.844220 -12632.533717 4912.264776 -236.677043 -5971.101764 3982.899866 -1988.201898 2.001187 408B000000000010 4579166D9DCA1243 44F853CF24A4EAEC 41E3F53AE0000003 37D7F4B45CC1CAFF 43B3B3B4EF24C34D