Version2.2 2021-02-21T18:30:53Z 10.1021/jm300687e Gaussian16 RevisionB.01 SBUNGAY 15-Dec-2020 #N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2) DUDE c1cc(ccc1Cn2ccc(n2)NC(=S)NNC(=O)c3csc4c3CCCC4)Cl C19644160 RHF 6-31G(d) (6D,7F) c1cc(ccc1Cn2ccc(n2)NC(=S)NNC(=O)c3csc4c3CCCC4)Cl C01[X(C20H20Cl1N5O1S2)] 141 C1 487 S=C(Nc1ccn(n1)Cc1ccc(cc1)Cl)NNC(=O)c1csc2c1CCCC2 S=C(Nc1ccn(n1)Cc1ccc(cc1)Cl)NNC(=O)c1csc2c1CCCC2 Clc1ccc(Cn2ccc(NC(=S)NNC(=O)c3csc4CCCCc34)n2)cc1 InChIKey=BVPBBGHGNXLVMT-UHFFFAOYSA-N InChI=1S/C20H20ClN5OS2/c21-14-7-5-13(6-8-14)11-26-10-9-18(25-26)22-20(28)24-23-19(27)16-12-29-17-4-2-1-3-15(16)17/h5-10,12H,1-4,11H2,(H,23,27)(H2,22,24,25,28) InChI=1/C20H20ClN5OS2/c21-14-7-5-13(6-8-14)11-26-10-9-18(25-26)22-20(28)24-23-19(27)16-12-29-17-4-2-1-3-15(16)17/h5-10,12H,1-4,11H2,(H,23,27)(H2,22,24,25,28)/f/h22-24H c1cc(ccc1Cn2ccc(n2)NC(=S)NNC(=O)c3csc4c3CCCC4)Cl C01[X(C20H20Cl1N5O1S2)] 141 C01 487 S=C(Nc1ccn(n1)Cc1ccc(cc1)Cl)NNC(=O)c1csc2c1CCCC2 S[C]([NH][C]1[CH][CH][N]([N]1)C[C]1[CH][CH][C]([CH][CH]1)Cl)NNC(=O)[C]1=[CH]SC2=[C]1CCCC2 S[C](NNC(=O)c1csc2CCCCc12)N[C]3[CH][CH]N(C[C]4[CH][CH][C](Cl)[CH][CH]4)[N]3 InChIKey=YNJMGFKDGNYHGT-UHFFFAOYSA-N InChI=1S/C20H21ClN5OS2/c21-14-7-5-13(6-8-14)11-26-10-9-18(25-26)22-20(28)24-23-19(27)16-12-29-17-4-2-1-3-15(16)17/h5-10,12H,1-4,11H2,(H,23,27)(H3,22,24,25,28) InChI=1/C20H21ClN5OS2/c21-14-7-5-13(6-8-14)11-26-10-9-18(25-26)22-20(28)24-23-19(27)16-12-29-17-4-2-1-3-15(16)17/h5-10,12H,1-4,11H2,(H,23,27)(H3,22,24,25,28)/f/h22-24,28H 2994.0462978249 -2370.5960801 1-A 20510.6338 116 371 487 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| -104.82813 -91.98658 -91.87241 -20.55952 -15.64956 -15.64843 -15.64077 -15.62414 -15.58657 -11.38227 -11.38153 -11.30671 -11.30603 -11.29225 -11.29207 -11.27725 -11.27421 -11.26796 -11.25848 -11.25422 -11.25360 -11.25288 -11.25235 -11.24807 -11.24668 -11.23270 -11.23115 -11.22803 -11.21848 -10.56153 -8.99696 -8.88414 -8.03092 -8.02759 -8.02756 -6.67955 -6.67851 -6.67692 -6.56769 -6.56444 -6.56370 -1.43934 -1.40724 -1.37099 -1.28996 -1.20784 -1.19984 -1.17098 -1.14264 -1.11583 -1.10917 -1.07353 -1.04815 -1.03891 -1.02144 -1.00889 -0.99067 -0.96545 -0.94200 -0.87678 -0.87114 -0.86360 -0.85779 -0.82843 -0.81819 -0.80595 -0.80240 -0.77376 -0.76529 -0.74553 -0.72615 -0.71747 -0.70563 -0.70409 -0.66717 -0.65677 -0.65088 -0.65038 -0.64132 -0.63719 -0.63200 -0.60847 -0.60542 -0.59943 -0.59656 -0.59429 -0.58559 -0.58013 -0.57624 -0.56761 -0.56074 -0.55048 -0.54322 -0.53670 -0.51786 -0.51560 -0.51237 -0.50683 -0.50547 -0.48265 -0.47584 -0.47347 -0.47110 -0.46672 -0.45737 -0.45501 -0.44551 -0.44152 -0.35871 -0.35758 -0.35461 -0.34368 -0.33600 -0.33360 -0.31828 -0.30860 |A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A| 0.09680 0.12057 0.12444 0.13759 0.15887 0.16775 0.17586 0.19631 0.20303 0.22500 0.23862 0.24224 0.24909 0.25588 0.26280 0.26814 0.27064 0.27203 0.27731 0.27972 0.28092 0.28648 0.29582 0.30116 0.31229 0.31496 0.31843 0.32193 0.32423 0.33709 0.33734 0.34645 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1.21548 1.22115 1.22704 1.23196 1.23437 1.24127 1.24995 1.25758 1.26076 1.26789 1.28291 1.28782 1.29117 1.29674 1.30083 1.31549 1.32231 1.33772 1.34884 1.36736 1.37413 1.39364 1.39722 1.40341 1.41198 1.41458 1.42217 1.43209 1.44476 1.46013 1.46665 1.48121 1.48526 1.49769 1.50025 1.55330 1.56236 1.56482 1.58931 1.59364 1.59860 1.61491 1.62200 1.62752 1.62958 1.64609 1.66641 1.68250 1.69027 1.69497 1.70131 1.71185 1.71584 1.72957 1.73434 1.74671 1.77266 1.77402 1.79108 1.80344 1.82225 1.83214 1.84465 1.85346 1.87355 1.87871 1.90316 1.90636 1.93325 1.95131 1.96476 1.96828 1.99835 2.03178 2.05160 2.07148 2.08398 2.08877 2.09740 2.11648 2.12197 2.12562 2.12832 2.13736 2.15615 2.16143 2.16389 2.17935 2.20273 2.21577 2.22054 2.23042 2.23238 2.23909 2.25048 2.25577 2.26781 2.27977 2.28015 2.29773 2.30367 2.30780 2.31477 2.33498 2.34249 2.36180 2.36562 2.39533 2.40220 2.43235 2.45076 2.45434 2.45708 2.45981 2.46552 2.48277 2.48546 2.49359 2.51047 2.51272 2.53182 2.55344 2.56995 2.58062 2.58320 2.58905 2.59409 2.60612 2.61536 2.62674 2.63416 2.64755 2.66193 2.68299 2.69017 2.69402 2.72004 2.73518 2.74155 2.75147 2.76027 2.77167 2.78826 2.80005 2.81325 2.83379 2.84569 2.86331 2.89006 2.89225 2.89616 2.92428 2.93040 2.93919 2.95010 2.96033 2.97171 2.99400 2.99951 3.00985 3.04453 3.05062 3.06243 3.09350 3.09704 3.11355 3.12104 3.13045 3.14321 3.15183 3.17374 3.19161 3.23315 3.25816 3.29552 3.34310 3.39549 3.42804 3.45065 3.46664 3.55247 3.59406 3.62087 3.68884 3.78309 4.30526 4.34893 4.36249 4.40840 4.42158 4.48209 4.48916 4.49314 4.52501 4.53547 4.55364 4.59522 4.60352 4.62380 4.65276 4.67355 4.68466 4.72927 4.74555 4.74993 4.78594 4.81001 4.88291 4.89480 4.92372 4.98236 4.99407 5.12256 5.12415 11.03141 -1.5564 -3.2532 -5.9116 6.9248 |XX|YY|ZZ|XY|XZ|YZ| -164.0687 -208.3851 -197.5204 12.0195 -6.8031 -13.0962 |XX|YY|ZZ|XY|XZ|YZ| 25.9227 -18.3937 -7.5290 12.0195 -6.8031 -13.0962 |XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ| 0.0029 -149.5348 -19.5184 -68.3279 104.4019 -106.6266 26.8454 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457.4084 464.8091 482.6941 503.6836 517.9098 539.4344 553.2193 578.1849 598.1512 626.4299 647.8623 666.2266 670.1439 675.9555 694.1169 723.0934 745.9717 761.7618 775.0204 776.1211 798.1905 834.6625 837.6289 851.9557 881.4001 883.3230 909.4910 911.3396 920.5931 932.5602 939.5325 950.8784 969.5676 989.6734 1003.1604 1010.4057 1034.5618 1053.7126 1077.3982 1088.7105 1098.6737 1112.8322 1114.2041 1118.3995 1137.7954 1159.4506 1180.2480 1191.6032 1193.6961 1206.9774 1216.5418 1256.3732 1267.0795 1275.0850 1306.9747 1313.0012 1315.2072 1321.4977 1324.2316 1335.3051 1378.0932 1389.7033 1410.1643 1431.9701 1450.6274 1473.3452 1476.9290 1502.9789 1507.7787 1515.3399 1523.6946 1531.6695 1546.2624 1557.6019 1576.3532 1598.0382 1627.5042 1628.9674 1636.4518 1639.0037 1652.3011 1655.1960 1658.5873 1674.8712 1678.5213 1688.6658 1707.2240 1772.9442 1776.8028 1806.9748 1809.6460 1989.4089 3189.0474 3198.7745 3201.0633 3203.8745 3238.4949 3248.1457 3250.3807 3252.7078 3298.3042 3304.5417 3359.5557 3387.3153 3401.3273 3405.2559 3427.8094 3449.7017 3522.4559 3837.9186 3850.3082 3873.8374 9.0816 5.6388 4.8769 5.5101 6.5335 8.2368 8.3700 6.3832 4.6509 5.8148 4.4978 3.4248 6.9188 5.0467 9.7861 7.5483 8.1235 5.8246 4.8455 6.2272 2.6556 2.0047 5.1518 4.8330 4.7970 5.2484 4.5578 3.9328 3.9849 3.1819 5.4691 3.5926 4.0611 1.8908 5.5159 2.8964 2.7645 2.4798 2.6177 2.2851 3.7336 2.4799 4.2769 6.8195 4.8046 4.3410 2.7913 4.1961 3.7496 3.8636 3.6482 3.9796 2.6093 1.3331 4.3651 2.1793 1.6975 2.3529 1.4863 2.6754 1.2652 3.7895 4.9684 1.5153 1.3725 2.1814 1.8001 4.8361 1.8829 3.3389 3.6930 1.3993 3.4798 2.7158 2.0671 1.3191 2.2547 3.3729 3.0076 1.9116 3.4199 1.1717 2.6905 1.2192 2.6492 2.4512 1.4493 1.5581 1.7580 1.8093 1.2504 1.2542 2.3537 1.3624 2.2926 1.9981 2.7287 1.4574 1.4545 1.8731 1.5170 4.7631 3.0942 2.1435 3.2402 1.1526 1.1720 1.0806 1.1108 1.5782 1.6861 3.3421 2.2856 1.9144 2.1039 2.0952 6.2830 8.0516 3.2935 5.0244 10.9488 1.0760 1.0648 1.0720 1.0625 1.0963 1.0959 1.0636 1.1057 1.0907 1.1042 1.0909 1.0903 1.0950 1.0963 1.0952 1.0986 1.1013 1.0756 1.0792 1.0792 0.0002 0.0003 0.0010 0.0014 0.0021 0.0096 0.0145 0.0121 0.0233 0.0395 0.0352 0.0295 0.0817 0.0704 0.2184 0.1831 0.2495 0.1900 0.2527 0.3296 0.1437 0.1237 0.3337 0.3278 0.3912 0.4442 0.3877 0.4135 0.4278 0.3922 0.6962 0.4932 0.6070 0.2988 0.9457 0.5223 0.5445 0.5227 0.6052 0.5651 0.9764 0.6562 1.1514 1.9358 1.4801 1.4233 0.9543 1.4850 1.3307 1.4503 1.4975 1.6451 1.1159 0.6102 2.0067 1.0621 0.8307 1.1749 0.7616 1.3914 0.6740 2.0989 2.8672 0.8984 0.8256 1.3756 1.1776 3.3075 1.3149 2.3746 2.6946 1.0235 2.5645 2.0715 1.6373 1.0826 1.8863 2.8317 2.5814 1.6669 3.1805 1.1084 2.5773 1.2270 2.6908 2.4981 1.4912 1.6098 1.8468 2.0245 1.4228 1.4695 2.8436 1.6891 2.9322 2.5680 3.6318 1.9521 1.9678 2.5621 2.0969 6.7098 4.4230 3.1382 4.8753 1.7988 1.8323 1.7050 1.7581 2.5385 2.7217 5.4168 3.7776 3.1779 3.5348 3.5979 11.6361 14.9764 6.3360 9.6944 25.5309 6.4471 6.4194 6.4722 6.4261 6.7744 6.8121 6.6205 6.8928 6.9907 7.1044 7.2543 7.3709 7.4640 7.4899 7.5820 7.7031 8.0513 9.3347 9.4262 9.5415 0.4848 0.2823 0.0791 0.7689 0.2759 0.3474 3.3532 1.9811 2.0965 4.6330 1.2683 0.6476 5.7832 3.6993 3.1931 1.0184 0.9797 0.4910 1.8923 10.9365 4.3321 0.7029 16.5221 11.2676 5.4611 3.7743 1.7836 5.9732 4.1903 3.6542 13.2014 8.2859 1.2073 47.9756 30.7856 13.9419 12.5459 16.4971 46.5504 30.3358 36.4809 115.2232 38.6802 3.3727 4.4656 14.8357 54.2589 22.0301 35.0005 25.8036 49.6059 41.0808 23.6268 59.0606 34.4637 11.3296 2.7690 7.5858 33.0812 16.1267 3.4171 20.4073 5.7027 0.2800 0.6480 1.4345 1.7865 8.3170 13.7062 21.4583 24.8462 0.2067 6.9323 20.8505 7.1153 40.8029 8.1830 53.3752 48.3797 2.0796 137.0883 4.1421 4.1016 3.1433 63.0111 6.5559 32.2113 7.8541 264.4718 73.0988 5.1815 22.9895 54.2500 7.3753 218.2555 13.2449 117.4118 5.1002 1.5928 43.8509 3.7303 346.5728 6.4237 2.4619 44.3604 2.4144 24.1185 6.0020 0.5248 4.6258 5.6626 13.5937 59.8508 335.3668 78.0765 163.3105 5.6711 5.3206 505.9316 81.6944 265.9166 26.7700 22.8317 27.4795 35.7614 36.7717 69.2071 32.9787 71.9851 7.5287 5.9381 15.1276 1.9453 7.4456 2.2670 1.8886 1.7797 4.5437 101.0096 78.0314 37.1825 1.4179 0.4814 6.6869 4.9755 2.5280 3.9979 0.5900 2.5128 1.7381 0.3317 0.6211 0.8677 1.0151 0.4513 1.2747 0.5258 1.2263 1.7267 0.5049 1.3173 1.2616 0.7179 1.4771 3.1761 2.2962 0.4422 2.2970 1.5293 2.7401 0.9845 6.7022 0.4325 3.6652 5.2228 0.7308 0.4847 2.0618 6.6185 2.2436 1.1467 6.7145 7.7939 1.0971 6.1782 1.3471 7.3771 6.3626 2.6906 1.0591 2.7414 1.0377 2.7941 1.1629 0.5409 28.6141 4.1743 2.7384 1.9496 1.2198 1.5761 1.9868 1.3686 5.4252 0.6563 0.1065 6.6854 0.7449 4.1543 3.3243 15.0704 1.9192 0.8675 4.0432 5.2082 5.5289 1.4974 2.9616 10.8566 15.1329 4.0841 5.2902 1.4538 3.4606 2.0411 4.3098 6.1347 3.4898 14.4830 14.9451 1.1296 3.0892 14.3764 10.7718 1.6463 22.6504 10.3557 6.3995 1.0778 8.5754 8.2289 0.2697 13.2110 14.0281 4.1735 62.5638 36.1558 31.4716 9.8844 10.6028 29.8521 15.2779 47.4936 0.9642 29.6584 11.4096 7.3994 5.7252 8.5879 57.2450 40.3470 27.7331 106.2173 76.2412 158.6149 36.2669 98.0540 164.9136 99.1165 84.4123 56.8849 62.2993 75.8124 55.6402 103.9826 126.1585 82.4115 68.1953 42.7576 61.6528 60.6948 46.2268 0.7483 0.7085 0.7500 0.7488 0.7361 0.7372 0.7498 0.7322 0.7237 0.7247 0.6356 0.7477 0.6908 0.6168 0.3725 0.6604 0.1429 0.5399 0.7317 0.3273 0.7337 0.4617 0.7351 0.1804 0.2763 0.4122 0.7499 0.4862 0.6678 0.6191 0.6578 0.7020 0.6090 0.1176 0.4886 0.6721 0.0628 0.4704 0.6346 0.7008 0.2738 0.3217 0.6516 0.6992 0.2703 0.1202 0.2174 0.2552 0.2616 0.6683 0.2482 0.5633 0.7487 0.6638 0.1224 0.2072 0.1309 0.2748 0.2394 0.7081 0.7477 0.6285 0.3872 0.7460 0.6215 0.7334 0.6759 0.2344 0.2099 0.1831 0.2012 0.3312 0.6307 0.6827 0.5291 0.6504 0.2329 0.3559 0.1060 0.1262 0.4071 0.7109 0.4401 0.4299 0.7443 0.1684 0.7484 0.2274 0.6112 0.2518 0.7499 0.7500 0.7175 0.4447 0.3466 0.6425 0.5011 0.7310 0.4112 0.6886 0.1054 0.7407 0.6510 0.2509 0.2168 0.5791 0.6040 0.7001 0.7418 0.1710 0.2867 0.3768 0.4952 0.2754 0.7185 0.7481 0.7040 0.7499 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0.2731 0.4282 0.4304 0.2817 0.7356 0.5840 0.4057 0.1047 0.8439 0.5287 0.7298 0.5624 0.7587 0.4271 0.2546 0.5069 0.5108 0.2944 0.2222 0.2171 0.3146 298.150 1.00000 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 31 32 33 34 35 36 37 38 39 40 41 42 43 44 45 46 47 48 49 6 6 6 6 6 6 6 7 6 6 6 7 7 6 16 7 7 6 8 6 6 16 6 6 6 6 6 6 17 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 12.00000 12.00000 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 14.00307 14.00307 12.00000 31.97207 14.00307 14.00307 12.00000 15.99491 12.00000 12.00000 31.97207 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 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 12474.4146 27744.1425 36623.9630 0.99966 0.02503 -0.00679 -0.02505 0.99968 -0.00415 0.00668 0.00432 0.99997 1 0.00694 0.00312 0.00236 0.14468 0.06505 0.04928 9.31 12.96 26.37 29.43 33.80 64.02 78.01 81.70 132.58 154.54 165.93 174.03 203.72 221.32 280.00 291.97 328.48 338.53 428.08 431.23 436.09 465.59 477.07 488.16 535.31 545.33 546.67 607.79 614.15 658.11 668.76 694.49 724.69 745.16 776.13 795.96 831.88 860.61 901.29 932.13 958.55 964.19 972.55 998.68 1040.37 1073.29 1096.01 1115.08 1116.67 1148.42 1200.89 1205.16 1225.77 1268.14 1270.90 1308.55 1311.21 1324.53 1341.75 1351.78 1368.10 1394.99 1423.92 1443.32 1453.75 1488.50 1516.06 1550.14 1566.41 1580.75 1601.12 1603.09 1609.13 1637.03 1668.19 1698.11 1714.45 1717.46 1736.57 1750.33 1807.64 1823.04 1834.56 1880.45 1889.12 1892.29 1901.34 1905.27 1921.21 1982.77 1999.47 2028.91 2060.29 2087.13 2119.82 2124.97 2162.45 2169.36 2180.24 2192.26 2203.73 2224.73 2241.04 2268.02 2299.22 2341.62 2343.72 2354.49 2358.16 2377.29 2381.46 2386.34 2409.77 2415.02 2429.61 2456.31 2550.87 2556.42 2599.83 2603.68 2862.32 4588.33 4602.32 4605.62 4609.66 4659.47 4673.36 4676.57 4679.92 4745.52 4754.50 4833.65 4873.59 4893.75 4899.40 4931.85 4963.35 5068.03 5521.91 5539.73 5573.59 0.411568 0.436258 0.437202 0.349304 -2370.184512 -2370.159822 -2370.158878 -2370.246776 2.948113D-04 MUNgauss RevisionA2.1 retrievium 21-Feb-2021 DUDE c1cc(ccc1Cn2ccc(n2)NC(=S)NNC(=O)c3csc4c3CCCC4)Cl C19644160 RHF 6-31G(d) (6D,10F) C1 445.079782 |X|Y|Z| 116.608577 76.143427 33.395113 66.683022 26 6 7 16 20 5 1 |36.858105| |13.736963|36.858105| |7.987958|13.806292|36.858105| |6.890184|7.921875|13.756867|36.858105| |7.972350|6.873369|7.974122|13.782731|36.858105| |13.745709|7.890290|6.868718|7.902520|13.697877|36.858105| |7.569157|5.011561|4.439997|5.004993|7.520401|12.553757|36.858105| |5.202592|3.948775|3.754532|4.413935|6.403366|7.660236|13.175600|53.358707| |4.479920|3.574231|3.408838|3.887156|5.128489|5.805089|7.599619|19.391195|36.858105| |3.475956|2.940662|2.913589|3.371011|4.243207|4.355768|5.287374|11.848613|13.957142|36.858105| |3.392633|2.877241|2.902830|3.458728|4.466772|4.404982|5.481495|12.345095|8.774664|13.511586|36.858105| |4.079638|3.322862|3.310570|4.006615|5.577132|5.693118|7.902527|19.396670|8.624060|8.462493|14.616233|53.358707| |2.787609|2.449157|2.514022|2.977860|3.644303|3.471436|4.070960|7.606102|5.354831|7.412067|13.616173|11.341407|53.358707| |2.380744|2.142676|2.211224|2.573390|3.011154|2.854883|3.215709|5.658732|4.274312|5.908520|7.670270|7.255531|19.475874|36.858105| |2.221676|2.022532|2.078607|2.371836|2.705460|2.592998|2.855867|4.950774|4.076142|5.752820|5.806767|5.680434|9.599447|11.383123|388.023441| |2.107492|1.923263|1.993479|2.300260|2.630248|2.482433|2.751257|4.566999|3.326752|4.184815|5.241287|5.742896|11.429972|13.926227|51.888805|53.358707| |2.113991|1.933935|2.014072|2.335742|2.668709|2.497570|2.756523|4.431366|3.072795|3.652088|4.728557|5.691614|9.738671|7.948001|34.751331|18.921329|53.358707| |2.078403|1.935500|2.053936|2.405437|2.690683|2.445426|2.604218|4.070171|2.798489|3.224659|4.053254|5.103142|7.510230|5.821307|29.067383|10.880439|18.775790|36.858105| |2.106938|1.984985|2.137692|2.528892|2.788543|2.477686|2.574309|4.039361|2.828882|3.278671|4.008588|4.958501|7.146687|5.724791|30.478773|9.571940|11.550224|15.981086|73.516695| |1.948892|1.828034|1.936333|2.239700|2.468385|2.259658|2.388855|3.588481|2.423938|2.683760|3.291386|4.385693|5.614207|4.108150|22.188391|7.033393|10.715633|12.781248|14.282475|36.858105| |1.770442|1.658167|1.733575|1.967123|2.158966|2.022375|2.160258|3.210396|2.184278|2.401342|2.881513|3.845267|4.817835|3.578049|19.970791|6.173649|8.846701|7.608255|9.611898|14.116965|36.858105| |1.649077|1.561150|1.632969|1.830640|1.974219|1.854040|1.951204|2.812947|1.902758|2.035859|2.385332|3.275650|3.777256|2.739171|16.021816|4.400771|5.656709|4.767041|6.952242|7.465825|11.097229|388.023441| |1.798146|1.717781|1.827015|2.077485|2.220697|2.035333|2.097425|2.999886|2.006465|2.128342|2.509753|3.502984|3.921651|2.781863|16.217981|4.330124|5.534615|5.106300|7.855846|8.220100|7.709874|78.016823|36.858105| |1.968813|1.872906|2.009885|2.331833|2.519762|2.268085|2.335768|3.407820|2.274718|2.448178|2.948544|4.072903|4.730127|3.345611|18.926330|5.259518|6.998319|7.347550|11.145733|13.133008|8.172406|52.780301|14.138129|36.858105| |2.141020|2.065455|2.269787|2.688526|2.854518|2.479866|2.473861|3.576903|2.376710|2.526048|3.016803|4.226187|4.667568|3.238100|18.720991|4.797985|5.921311|6.017461|10.919010|7.216679|5.043022|33.639569|7.604574|12.596644|36.858105| |1.977827|1.945272|2.148042|2.490262|2.554517|2.233254|2.184949|3.070994|2.052862|2.136702|2.469603|3.497144|3.681104|2.571735|15.517559|3.744783|4.413886|4.105287|7.468891|4.885208|3.963257|29.828180|6.760814|7.583840|12.430293|36.858105| |1.894208|1.853806|2.012660|2.286973|2.360445|2.116394|2.094936|2.893128|1.916937|1.972017|2.275100|3.273347|3.361493|2.325413|14.034047|3.393730|4.029322|3.560560|6.108257|4.444228|3.917960|32.818237|7.654859|6.666836|7.513755|12.456560|36.858105| |1.727989|1.673155|1.787391|2.010385|2.104617|1.926595|1.949644|2.725783|1.822159|1.897153|2.191909|3.104023|3.306845|2.328293|13.988995|3.498952|4.236645|3.728592|6.121151|5.047331|4.822578|47.659843|12.648913|7.501977|6.283795|7.553420|12.429606|36.858105| |4.771560|7.040950|10.926341|7.033204|4.770612|4.217463|3.157112|3.827004|2.642950|2.354738|2.340763|3.504355|2.856018|1.898190|12.875980|2.371616|2.397577|1.818184|3.386726|1.733360|1.562130|10.607024|1.671914|1.818061|2.060728|2.005987|1.878752|1.662029|448.794386| |17.701333|8.957289|5.677789|4.959744|5.653827|8.910066|7.021899|6.566800|4.262585|3.290330|3.164244|5.110963|3.553862|2.246409|15.023320|2.715996|2.714168|1.937926|3.460289|1.825195|1.678975|11.148220|1.686633|1.829442|1.957127|1.813018|1.754956|1.620103|31.647347|0.500000| |8.888710|17.747734|8.932262|5.642150|4.954574|5.623841|4.088746|4.513674|3.082376|2.579508|2.503447|3.855843|2.945655|1.921538|13.036066|2.367754|2.376768|1.745490|3.174409|1.659765|1.519836|10.249861|1.575133|1.700277|1.860021|1.771518|1.701036|1.543818|53.782244|0.215638|0.500000| |4.963316|5.645741|8.922500|17.747723|8.910738|5.628140|4.079625|5.205577|3.451174|3.139021|3.264794|4.981560|3.960029|2.559128|16.778117|3.151204|3.215114|2.486958|4.730982|2.317398|2.013616|13.361235|2.165266|2.448385|2.899211|2.709426|2.433401|2.107352|53.794849|0.107680|0.124262|0.500000| |5.660687|4.953375|5.667820|8.955723|17.732251|8.908809|6.970302|9.517379|5.433414|4.784091|5.408873|9.398175|6.008581|3.534466|21.817408|4.156649|4.248311|3.168549|5.879152|2.849326|2.438401|15.575317|2.488860|2.893444|3.318807|2.868447|2.602682|2.317375|31.625186|0.124173|0.107571|0.215466|0.500000| |7.310309|4.777549|3.996863|4.190782|5.599142|8.891993|17.592079|12.571739|6.952311|4.781086|4.628174|8.108214|4.813753|2.892622|18.819751|3.393883|3.362519|2.314964|4.055550|2.138212|1.966573|12.718403|1.894660|2.080937|2.175601|1.947203|1.883252|1.770446|23.599153|0.223964|0.113529|0.096297|0.141045|0.500000| |6.118571|4.393968|3.997282|4.518337|6.452644|8.857361|17.621691|12.771131|5.779133|4.559869|5.139504|10.551691|5.522023|3.169974|19.389901|3.789045|3.907422|2.711213|4.669059|2.537166|2.304169|14.900259|2.253601|2.493760|2.615681|2.307128|2.248778|2.094270|23.608718|0.161242|0.102108|0.105664|0.176556|0.303043|0.500000| |4.722297|3.753255|3.463867|3.771990|4.747494|5.634025|6.791937|12.321234|17.799017|8.606065|5.898724|8.064732|5.633710|3.513096|24.936187|3.854792|3.574001|2.425490|4.380729|2.136369|1.945686|12.236285|1.810506|2.026784|2.122669|1.868962|1.753522|1.664794|21.641181|0.128888|0.091248|0.091805|0.130218|0.195665|0.140602|0.500000| |3.007613|2.621024|2.609998|2.961965|3.547831|3.592340|4.135067|8.040657|8.690087|17.902314|8.529684|7.916348|8.578815|5.870622|48.562681|5.628964|4.708024|3.050450|5.584629|2.523453|2.279179|13.717590|1.997361|2.286070|2.343887|1.997549|1.837582|1.781470|17.436001|0.079907|0.065018|0.078020|0.108742|0.108080|0.101220|0.194476|0.500000| |2.757975|2.429042|2.502621|2.976200|3.641430|3.441589|4.029361|7.086431|4.615249|5.663462|9.496648|10.998985|25.988141|9.582719|37.940285|10.945657|11.768570|6.514642|10.156232|4.918026|4.128000|22.550293|3.312256|4.062574|3.916107|3.005171|2.767898|2.734835|16.791113|0.071593|0.059585|0.081119|0.123712|0.095993|0.116967|0.101815|0.133766|0.500000| |1.935887|1.788234|1.860356|2.129152|2.386722|2.245558|2.442277|3.979498|2.955167|3.664573|4.292649|4.797800|8.272917|9.546564|51.134968|26.008231|12.802338|7.035641|12.052433|4.740279|4.254700|21.917016|3.010291|3.607490|3.304913|2.630259|2.365780|2.454141|13.243239|0.050990|0.045228|0.060012|0.075940|0.062148|0.068059|0.071477|0.104044|0.158959|0.500000| |2.013331|1.836384|1.892764|2.165597|2.468464|2.354121|2.628063|4.146403|2.854746|3.317428|4.207085|5.237685|8.071213|6.247196|29.887045|12.932186|26.059373|9.231303|10.857298|7.450454|7.315550|32.041918|4.090812|4.864920|3.932976|3.038069|2.878974|3.111763|13.328804|0.053285|0.046344|0.060342|0.078796|0.066230|0.077077|0.068457|0.087234|0.199943|0.202127|0.500000| |1.696713|1.582043|1.640026|1.846523|2.033085|1.929736|2.084184|3.123474|2.152724|2.389708|2.840605|3.720518|4.793755|3.668104|20.632843|6.545632|9.080930|6.657617|8.612711|8.742055|17.777001|55.639063|5.419827|5.652906|3.996496|3.251833|3.212946|3.835308|11.858712|0.045027|0.040430|0.052120|0.063341|0.053233|0.061412|0.053363|0.063678|0.111837|0.127092|0.231425|0.500000| |2.428116|2.323249|2.565944|3.107036|3.362014|2.869234|2.853953|4.105189|2.658946|2.792755|3.406968|4.931957|5.175653|3.426296|19.463202|4.896931|6.013401|5.746674|10.251072|6.325689|4.556214|29.788041|6.110094|8.933032|17.499875|8.819676|6.548424|5.268474|18.292078|0.061035|0.057404|0.092832|0.111271|0.068422|0.084789|0.065308|0.070542|0.123169|0.091074|0.110497|0.103431|0.500000| |2.114260|2.049128|2.267754|2.700809|2.847464|2.449637|2.427509|3.572165|2.421407|2.613970|3.090289|4.201768|4.826772|3.449321|20.194982|5.105895|6.088378|6.448229|13.534387|6.661880|4.632453|29.193263|5.801762|8.914001|17.620809|8.811508|5.502715|4.863184|16.613412|0.053533|0.051232|0.081896|0.092515|0.059405|0.069909|0.060076|0.068163|0.109314|0.099808|0.108071|0.105942|0.304667|0.500000| |2.082770|2.077227|2.332969|2.721400|2.728208|2.342392|2.240106|3.111673|2.077188|2.135738|2.441290|3.490054|3.551341|2.458188|15.053972|3.486168|3.996110|3.606112|6.747660|4.009832|3.304556|24.247812|4.938317|5.544928|8.850984|17.551707|8.817383|5.497536|17.676606|0.052545|0.052416|0.083937|0.084565|0.055258|0.065290|0.052830|0.055313|0.079441|0.067988|0.075900|0.077788|0.220293|0.206923|0.500000| |1.800725|1.778983|1.958017|2.242663|2.282477|2.012853|1.972156|2.789231|1.895490|1.986949|2.264045|3.147017|3.391313|2.428702|14.923895|3.575336|4.148511|3.865604|7.172881|4.556845|3.808163|28.957381|6.206451|6.613966|8.850754|17.515967|8.869255|6.960600|14.876239|0.046110|0.045338|0.067789|0.070516|0.049318|0.057261|0.048233|0.052259|0.075677|0.071208|0.079407|0.087900|0.174224|0.220022|0.303407|0.500000| |2.059699|2.003413|2.168448|2.473359|2.577634|2.314700|2.295400|3.129433|2.038576|2.074532|2.414640|3.552534|3.526513|2.384106|14.248954|3.431695|4.088450|3.521507|5.947307|4.315634|3.804940|30.977511|6.691220|6.151905|6.911388|8.852915|17.521365|8.848983|16.034531|0.052899|0.050817|0.072435|0.078990|0.056935|0.069483|0.051635|0.053097|0.081597|0.065417|0.081618|0.087526|0.194997|0.139756|0.210684|0.173804|0.500000| |1.787582|1.769226|1.922911|2.153963|2.184477|1.967402|1.927646|2.634483|1.757566|1.794103|2.035804|2.926743|2.963769|2.062142|12.693692|2.979699|3.452514|2.978117|5.191962|3.571082|3.251773|27.270363|5.572683|4.886232|5.478815|8.804014|17.551115|8.846989|14.665085|0.046119|0.045454|0.063831|0.065784|0.048539|0.057157|0.045103|0.046675|0.066730|0.058217|0.068755|0.076480|0.137597|0.123188|0.214631|0.211105|0.302999|0.500000| |1.591580|1.551178|1.658345|1.851373|1.918648|1.759297|1.771939|2.483530|1.681648|1.755919|2.001101|2.798244|3.013508|2.159579|13.213434|3.254115|3.857849|3.385077|5.687156|4.422562|4.329425|42.303661|8.937081|6.065568|5.295430|6.600051|8.814656|17.516710|12.526971|0.041550|0.039978|0.054115|0.058273|0.045015|0.052324|0.042947|0.046242|0.068087|0.064513|0.078442|0.098645|0.121034|0.123217|0.138340|0.197555|0.174068|0.219571|0.500000| |1.684994|1.626693|1.720930|1.915084|2.009807|1.865949|1.900354|2.629594|1.751343|1.808992|2.081695|2.973868|3.109207|2.174050|13.117181|3.244864|3.898454|3.287479|5.326487|4.334147|4.391749|45.470250|8.896722|5.738532|4.847371|5.510544|8.800254|17.547256|12.838673|0.044183|0.041883|0.055168|0.060837|0.048248|0.057148|0.044614|0.047105|0.071411|0.062917|0.081231|0.100293|0.122165|0.108244|0.123265|0.140313|0.219445|0.206954|0.303659|0.500000| 2368.698513 -11579.991234 4076.911868 -230.261797 -5364.642650 2994.046513 -2370.596136 2.000801 40B3080000000005 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