Version2.1
2020-12-19T02:38:47Z
10.1021/jm300687e
Gaussian16
RevisionB.01
PWARBURT
19-Nov-2020
#N HF/6-31G(d) OPT=(MaxStep=1) FREQ IOp(6/10=2,6/11=2,6/12=2)
DUDE c1ccn2c(c1)ncc(c2=O)C(=O)NC[C@H](c3ccc(cc3Cl)Cl)N4CCc5c(ccs5)C4 C46847122
RHF
6-31G(d)
(6D,7F)
c1ccn2c(c1)ncc(c2=O)C(=O)NC[C@H](c3ccc(cc3Cl)Cl)N4CCc5c(ccs5)C4
C01[X(C24H22Cl2N4O2S1)]
159
C1
551
Clc1ccc(c(c1)Cl)[C@H](N1CCc2c(C1)ccs2)CNC(=O)c1cnc2n(c1=O)cccc2
Clc1ccc(c(c1)Cl)[C@H](N1CCc2c(C1)ccs2)CNC(=O)c1cnc2n(c1=O)cccc2
Clc1ccc([C@@H](CNC(=O)C2=CN=C3C=CC=CN3C2=O)N4CCc5sccc5C4)c(Cl)c1
InChIKey=BKGGNDGVGBULCZ-HXUWFJFHSA-N
InChI=1S/C24H20Cl2N4O2S/c25-16-4-5-17(19(26)11-16)20(29-9-6-21-15(14-29)7-10-33-21)13-28-23(31)18-12-27-22-3-1-2-8-30(22)24(18)32/h1-5,7-8,10-12,20H,6,9,13-14H2,(H,28,31)/t20-/m1/s1
InChI=1/C24H20Cl2N4O2S/c25-16-4-5-17(19(26)11-16)20(29-9-6-21-15(14-29)7-10-33-21)13-28-23(31)18-12-27-22-3-1-2-8-30(22)24(18)32/h1-5,7-8,10-12,20H,6,9,13-14H2,(H,28,31)/t20-/m1/s1/f/h28H
c1ccn2c(c1)ncc(c2=O)C(=O)NC[C@H](c3ccc(cc3Cl)Cl)N4CCc5c(ccs5)C4
C01[X(C24H22Cl2N4O2S1)]
159
C01
551
Clc1ccc(c(c1)Cl)[C@H](N1CCc2c(C1)ccs2)CNC(=O)c1cnc2n(c1=O)cccc2
Cl[C]1[CH][CH][C]([C]([CH]1)Cl)[C@H](N1CCC2=[C]([CH]=CS2)C1)CNC(=O)[C]1[CH][NH][C]2[CH][CH][CH]=C[NH]2[C]1=O
Cl[C]1[CH][CH][C]([C](Cl)[CH]1)[C@@H](CNC(=O)[C]2[CH]N[C]3[CH][CH]C=C[NH]3C2=O)N4CCc5sccc5C4
InChIKey=BEUWRXDGYLWTHI-HXUWFJFHSA-N
InChI=1S/C24H22Cl2N4O2S/c25-16-4-5-17(19(26)11-16)20(29-9-6-21-15(14-29)7-10-33-21)13-28-23(31)18-12-27-22-3-1-2-8-30(22)24(18)32/h1-5,7-8,10-12,20,30H,6,9,13-14H2,(H,27,32)(H,28,31)/t20-/m1/s1
InChI=1/C24H22Cl2N4O2S/c25-16-4-5-17(19(26)11-16)20(29-9-6-21-15(14-29)7-10-33-21)13-28-23(31)18-12-27-22-3-1-2-8-30(22)24(18)32/h1-5,7-8,10-12,20,30H,6,9,13-14H2,(H,27,32)(H,28,31)/t20-/m1/s1/f/h27-28H
3793.5969766266
-2605.5131738
1-A
21307.3312
130
421
551
|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
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8.93860
2.5770 -1.5985 -0.3798
3.0562
|XX|YY|ZZ|XY|XZ|YZ|
-211.3550 -214.1645 -200.5900 -21.0638 1.2974 -6.4079
|XX|YY|ZZ|XY|XZ|YZ|
-2.6518 -5.4613 8.1132 -21.0638 1.2974 -6.4079
|XXX|YYY|ZZZ|XYY|XXY|XXZ|XZZ|YZZ|YYZ|XYZ|
101.1399 -34.0950 0.3354 101.3041 -98.6940 -32.1615 13.7869 12.9492 -10.6839 20.2618
|XXXX|YYYY|ZZZZ|XXXY|XXXZ|YYYX|YYYZ|ZZZX|ZZZY|XXYY|XXZZ|YYZZ|XXYZ|YYXZ|ZZXY|
-21280.0009 -6709.6847 -1990.1080 -456.2101 -436.7741 -232.9229 -185.4269 72.7416 -28.3738 -4098.9663 -3451.1275 -1384.1136 179.3500 -107.2934 -51.8916
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|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|A|
12.5103 13.4894 23.8105 25.7167 29.8835 39.9148 51.8185 68.3199 76.0072 85.0149 113.0204 135.9292 140.3963 159.1488 166.1285 190.1153 191.9590 210.4073 226.7054 233.0165 256.8310 271.7355 297.2551 304.6552 326.0599 335.5001 355.4998 371.6498 402.7661 408.1802 418.1539 432.4545 448.2560 468.7336 471.4473 493.8732 508.2150 523.2032 526.3904 534.3199 563.9875 578.9666 592.6522 611.2818 619.6499 637.7445 648.1906 658.4641 668.9258 679.0469 704.8256 720.1502 731.4380 737.8483 750.0000 781.7823 796.6304 805.7327 814.6549 824.0940 839.2556 857.5001 863.7619 906.4426 912.2118 923.6140 936.8397 952.0777 988.8886 1002.0634 1013.0858 1027.0010 1041.1663 1063.5084 1075.2253 1081.2477 1089.0470 1094.8247 1103.2623 1111.5415 1129.5913 1136.7327 1142.6050 1146.2332 1170.3262 1182.2562 1195.3317 1204.7056 1207.0739 1213.0417 1226.4221 1235.0876 1260.9864 1278.5987 1288.4906 1302.3714 1303.9744 1312.2022 1320.6669 1335.2113 1352.4199 1356.7724 1377.3154 1388.5851 1403.9258 1409.4973 1428.8374 1460.6949 1464.8516 1476.2331 1484.3573 1485.2037 1514.1710 1519.0142 1533.6607 1536.8762 1541.8860 1559.0113 1572.1188 1585.0499 1590.2990 1629.7072 1643.5757 1651.7054 1653.6174 1658.6737 1666.0679 1673.8269 1696.7463 1719.2986 1738.5718 1750.7331 1796.0088 1803.8765 1831.5915 1890.9818 1997.6283 3145.8338 3152.0494 3212.3821 3228.2666 3249.2155 3250.5901 3292.7390 3298.2219 3318.5463 3355.0090 3366.7638 3382.8717 3396.6987 3413.4496 3413.4656 3420.7943 3423.4774 3440.9814 3454.4073 3654.1740 3857.2408 3858.4605
6.6771 5.9979 8.8247 4.9241 12.1248 5.9834 7.4939 8.5260 7.4375 6.2321 5.4604 6.9634 5.6731 5.3610 7.6641 6.2800 6.1133 4.4729 4.5434 9.3683 3.3980 3.4584 4.3007 2.5211 6.5510 4.6853 6.9687 3.5784 5.4566 5.1748 3.6693 7.9012 4.9074 4.8614 5.3424 4.3833 3.3729 4.0064 4.3117 5.0106 5.2622 4.5374 4.2712 3.4914 1.9425 3.8034 3.4932 3.0704 2.1719 3.7216 1.7485 5.2266 1.3619 5.5081 1.2951 4.9566 4.4413 4.8757 1.3285 4.5014 4.1844 7.2169 3.4370 4.1054 4.9893 6.4423 2.7834 1.9385 2.5407 4.4691 1.4292 1.2917 2.8570 3.7725 1.3598 2.2717 1.4951 2.3294 1.3698 1.8531 2.4128 1.4509 2.9041 3.4272 3.6695 2.2753 3.1317 1.7582 2.0146 3.5509 2.8589 2.1093 1.4913 2.2091 2.1924 2.3781 2.3070 2.1869 1.2843 1.5845 1.4352 2.1521 1.1798 1.5272 1.3761 1.4713 1.8761 1.4141 2.1456 1.4459 1.5980 1.6122 1.3899 1.4669 1.7138 2.0216 1.8278 1.6056 1.4034 2.8802 1.8950 1.1124 2.1158 1.5714 1.7434 3.2824 1.1058 1.1003 2.1561 2.2333 4.7214 6.3200 5.8240 7.1556 4.9269 8.6172 12.0834 1.0724 1.0738 1.0603 1.0745 1.1048 1.0849 1.0909 1.0949 1.0874 1.0907 1.0905 1.0920 1.0898 1.0957 1.0951 1.0943 1.0950 1.0986 1.0962 1.0774 1.0793 1.0793
0.0006 0.0006 0.0029 0.0019 0.0064 0.0056 0.0119 0.0234 0.0253 0.0265 0.0411 0.0758 0.0659 0.0800 0.1246 0.1337 0.1327 0.1167 0.1376 0.2997 0.1321 0.1505 0.2239 0.1379 0.4103 0.3107 0.5189 0.2912 0.5215 0.5080 0.3780 0.8706 0.5810 0.6293 0.6996 0.6299 0.5133 0.6462 0.7039 0.8428 0.9862 0.8961 0.8839 0.7687 0.4394 0.9114 0.8647 0.7843 0.5726 1.0111 0.5118 1.5970 0.4293 1.7668 0.4292 1.7849 1.6607 1.8649 0.5195 1.8012 1.7365 3.1266 1.5108 1.9874 2.4461 3.2380 1.4393 1.0353 1.4639 2.6440 0.8642 0.8027 1.8247 2.5140 0.9262 1.5648 1.0448 1.6451 0.9824 1.3490 1.8139 1.1046 2.2338 2.6530 2.9612 1.8737 2.6364 1.5034 1.7294 3.0785 2.5335 1.8958 1.3971 2.1278 2.1445 2.3765 2.3112 2.2186 1.3197 1.6644 1.5466 2.3342 1.3186 1.7349 1.5981 1.7221 2.2567 1.7777 2.7127 1.8565 2.0744 2.0953 1.8775 1.9942 2.3750 2.8133 2.5602 2.2992 2.0436 4.2634 2.8237 1.7408 3.3674 2.5258 2.8088 5.3206 1.8085 1.8163 3.6573 3.8895 8.4082 11.4132 11.0685 13.7187 9.7382 18.1547 28.4099 6.2526 6.2860 6.4466 6.5980 6.8720 6.7539 6.9685 7.0177 7.0557 7.2333 7.2830 7.3628 7.4082 7.5222 7.5180 7.5445 7.5614 7.6639 7.7069 8.4764 9.4612 9.4669
0.3144 0.4023 0.5233 0.0313 0.0085 1.1493 0.6552 3.3547 2.8648 0.6579 0.8382 2.4596 0.6063 2.3304 1.3346 7.7624 1.9101 2.3711 4.5616 4.3510 9.8440 5.5271 22.2172 2.9587 8.0683 20.0745 3.3101 1.6978 20.1617 5.2804 43.7635 4.2516 5.2760 19.1851 3.7434 24.8521 3.9127 23.9180 2.2809 3.1822 34.5253 33.6811 17.7111 19.4805 62.3753 4.0715 48.3739 8.7942 29.3821 1.9717 80.5403 6.6168 13.1785 3.4200 49.3624 4.0016 4.9944 18.4384 44.8543 21.4811 11.8936 20.5448 35.5866 41.7518 82.4758 16.7087 28.7233 7.9812 17.0901 4.6838 13.8898 0.8047 28.0449 43.3922 0.5214 8.9586 5.4663 29.3987 0.7303 12.3757 22.3991 13.8142 77.3377 7.8402 29.0764 16.4822 3.1572 1.5769 3.7009 0.7081 63.3387 30.8342 18.9308 3.1778 33.3262 64.2772 63.6273 22.2369 5.3957 6.9079 3.0756 97.9213 8.7407 164.8938 22.5621 20.3751 86.9204 6.4030 85.5611 46.6104 45.7063 35.4336 23.4474 17.6123 51.1960 139.5916 12.7118 46.9190 2.6075 91.5458 33.2979 4.5650 209.6959 24.1321 48.8764 5.3372 4.9714 29.3711 10.5357 1255.9574 155.5559 11.5525 55.1164 0.7091 50.7596 331.8288 611.8878 26.3493 93.2662 31.4971 42.9524 37.4500 25.8818 24.0263 7.1065 25.3938 11.1551 19.7825 9.4918 5.8275 4.8683 14.4521 0.2159 3.1358 2.8912 2.1182 37.0054 117.7810 106.7761
1.7346 2.1576 2.4765 1.9073 3.4749 10.7451 4.3589 3.9628 2.2867 3.4304 2.2406 2.3490 1.5025 1.7019 2.0547 5.2059 2.0123 1.6915 0.8575 3.1965 0.4159 3.3560 0.9777 1.3425 0.7645 1.3844 2.5053 1.7762 4.9922 1.7870 2.2328 5.3126 2.7867 2.0113 3.8873 4.8122 0.7212 3.5397 1.8782 1.6559 3.3108 1.1898 3.0298 15.6894 29.1922 2.1939 14.2294 3.7253 10.8178 1.5525 5.0076 4.3254 9.0889 17.2238 1.3155 7.5501 2.5091 6.1626 2.9092 4.6873 1.4872 6.1968 14.2129 4.7787 8.1586 5.1079 11.8394 4.2429 2.2532 4.6496 1.0673 0.8909 9.0126 2.2899 1.9652 4.8048 11.4129 8.4055 0.1391 2.1782 1.1588 10.3518 2.0819 3.8921 11.3213 6.8807 2.5270 6.9394 3.4424 10.9802 10.3006 14.7341 12.4159 5.5847 6.4672 9.0165 1.5393 5.5496 8.6389 5.0836 7.5080 14.3098 4.7639 39.9215 1.6642 2.7129 34.7015 18.7299 26.8868 13.6790 11.3151 11.3551 7.5544 7.6068 8.7479 4.7109 3.4894 3.1503 5.1688 34.2160 4.4216 16.1676 17.5413 4.8223 11.2598 64.5250 4.0317 11.7686 81.7465 19.9116 35.9208 6.8739 56.7886 2.4719 23.7943 13.4855 30.0657 46.9108 109.7231 126.6031 44.0211 70.8136 80.1793 45.8556 36.5063 45.6777 79.8747 102.1663 73.7711 44.5583 75.5024 182.3906 83.9918 71.8481 152.7431 75.0630 46.7226 9.2262 201.6715
0.7145 0.7495 0.7472 0.7429 0.7491 0.6209 0.6997 0.4347 0.7325 0.5218 0.7424 0.6271 0.7402 0.7279 0.4777 0.3816 0.3802 0.4253 0.4517 0.3935 0.4521 0.6018 0.7327 0.7477 0.4097 0.7431 0.7482 0.6628 0.5846 0.4082 0.1704 0.1423 0.6845 0.7178 0.1904 0.7403 0.7326 0.3420 0.7126 0.6037 0.6445 0.7324 0.3905 0.2644 0.5491 0.2199 0.5468 0.2012 0.2023 0.6345 0.4136 0.6713 0.6238 0.1050 0.3027 0.2451 0.1963 0.0247 0.7299 0.3675 0.1713 0.2461 0.0910 0.5573 0.6085 0.6827 0.1780 0.0882 0.5484 0.6540 0.7451 0.7493 0.6350 0.4754 0.6620 0.2313 0.3945 0.4075 0.7383 0.3617 0.1657 0.6883 0.7107 0.5256 0.0461 0.6814 0.2008 0.7406 0.7295 0.6006 0.2232 0.4371 0.3450 0.2081 0.3001 0.7065 0.7397 0.2068 0.5696 0.7237 0.7495 0.6129 0.7396 0.3367 0.2683 0.5953 0.4034 0.5924 0.3139 0.7093 0.2521 0.1216 0.5975 0.2687 0.6087 0.5117 0.6573 0.6165 0.5964 0.4663 0.7008 0.6784 0.1883 0.5324 0.2397 0.3010 0.7404 0.7384 0.2708 0.6719 0.3175 0.5686 0.5221 0.4888 0.2747 0.2583 0.2131 0.3008 0.2105 0.1055 0.3372 0.7425 0.1872 0.2883 0.7115 0.1404 0.4593 0.5006 0.4250 0.7352 0.1920 0.1827 0.2649 0.4185 0.2668 0.2175 0.3658 0.2053 0.2066
0.8335 0.8568 0.8553 0.8525 0.8566 0.7661 0.8233 0.6060 0.8456 0.6858 0.8522 0.7709 0.8507 0.8426 0.6465 0.5524 0.5509 0.5968 0.6223 0.5648 0.6227 0.7514 0.8457 0.8556 0.5813 0.8526 0.8559 0.7972 0.7379 0.5797 0.2912 0.2492 0.8127 0.8357 0.3199 0.8508 0.8457 0.5097 0.8322 0.7529 0.7838 0.8455 0.5617 0.4183 0.7089 0.3606 0.7070 0.3350 0.3365 0.7764 0.5851 0.8034 0.7683 0.1901 0.4647 0.3937 0.3281 0.0483 0.8438 0.5375 0.2924 0.3950 0.1669 0.7157 0.7566 0.8114 0.3022 0.1621 0.7084 0.7908 0.8539 0.8567 0.7768 0.6444 0.7966 0.3757 0.5658 0.5791 0.8495 0.5313 0.2843 0.8154 0.8309 0.6891 0.0882 0.8105 0.3345 0.8510 0.8436 0.7505 0.3649 0.6083 0.5131 0.3445 0.4616 0.8280 0.8504 0.3427 0.7258 0.8397 0.8568 0.7600 0.8503 0.5037 0.4231 0.7463 0.5748 0.7440 0.4779 0.8299 0.4027 0.2168 0.7480 0.4236 0.7567 0.6770 0.7932 0.7628 0.7472 0.6361 0.8241 0.8084 0.3170 0.6949 0.3867 0.4627 0.8508 0.8495 0.4262 0.8038 0.4820 0.7250 0.6860 0.6567 0.4310 0.4105 0.3513 0.4625 0.3478 0.1909 0.5043 0.8522 0.3154 0.4476 0.8315 0.2463 0.6295 0.6672 0.5965 0.8474 0.3221 0.3090 0.4189 0.5900 0.4212 0.3573 0.5356 0.3407 0.3424
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 50 51 52 53 54 55
6 6 6 7 6 6 7 6 6 6 8 6 8 7 6 6 1 6 6 6 6 6 6 17 17 7 6 6 6 6 6 6 16 6 1 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 14.00307 12.00000 12.00000 14.00307 12.00000 12.00000 12.00000 15.99491 12.00000 15.99491 14.00307 12.00000 12.00000 1.00783 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 34.96885 34.96885 14.00307 12.00000 12.00000 12.00000 12.00000 12.00000 12.00000 31.97207 12.00000 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783 1.00783
11810.9515 30918.8263 37461.5862
0.99998 -0.00672 0.00198 0.00671 0.99997 0.00270 -0.00200 -0.00269 0.99999
1
0.00733 0.00280 0.00231
0.15280 0.05837 0.04818
18.00 19.41 34.26 37.00 43.00 57.43 74.56 98.30 109.36 122.32 162.61 195.57 202.00 228.98 239.02 273.53 276.19 302.73 326.18 335.26 369.52 390.97 427.68 438.33 469.13 482.71 511.48 534.72 579.49 587.28 601.63 622.21 644.94 674.40 678.31 710.57 731.21 752.77 757.36 768.77 811.45 833.00 852.69 879.50 891.54 917.57 932.60 947.38 962.43 977.00 1014.09 1036.14 1052.38 1061.60 1079.08 1124.81 1146.17 1159.27 1172.11 1185.69 1207.50 1233.75 1242.76 1304.17 1312.47 1328.87 1347.90 1369.83 1422.79 1441.75 1457.60 1477.63 1498.01 1530.15 1547.01 1555.67 1566.90 1575.21 1587.35 1599.26 1625.23 1635.50 1643.95 1649.17 1683.84 1701.00 1719.82 1733.30 1736.71 1745.30 1764.55 1777.02 1814.28 1839.62 1853.85 1873.82 1876.13 1887.97 1900.15 1921.07 1945.83 1952.09 1981.65 1997.86 2019.94 2027.95 2055.78 2101.61 2107.59 2123.97 2135.66 2136.88 2178.55 2185.52 2206.60 2211.22 2218.43 2243.07 2261.93 2280.53 2288.09 2344.79 2364.74 2376.44 2379.19 2386.46 2397.10 2408.26 2441.24 2473.69 2501.42 2518.91 2584.06 2595.38 2635.25 2720.70 2874.14 4526.15 4535.10 4621.90 4644.76 4674.90 4676.87 4737.52 4745.41 4774.65 4827.11 4844.02 4867.20 4887.09 4911.19 4911.22 4921.76 4925.62 4950.80 4970.12 5257.54 5549.71 5551.46
0.460596
0.487800
0.488744
0.397894
-2605.052578
-2605.025374
-2605.024429
-2605.115280
3.047157D-04
MUNgauss
RevisionA2.0
retrievium
19-Dec-2020
DUDE c1ccn2c(c1)ncc(c2=O)C(=O)NC[C@H](c3ccc(cc3Cl)Cl)N4CCc5c(ccs5)C4 C46847122
RHF
6-31G(d)
(6D,10F)
C1
500.084053
|X|Y|Z|
70.379618 121.535325 39.789749
69.818987
29
|36.858105|
|13.355845|36.858105|
|7.828832|14.264584|36.858105|
|6.662128|7.832500|12.886893|53.358707|
|7.864703|6.942350|7.848849|17.573821|36.858105|
|13.950397|8.056888|6.892450|10.592854|13.691747|36.858105|
|5.121381|4.601035|5.189054|10.977897|13.427339|7.702912|53.358707|
|4.191321|3.962119|4.585497|9.599551|7.999635|5.564162|19.699282|36.858105|
|4.191937|4.196416|5.045462|10.584293|6.805515|5.095419|10.950856|13.830332|36.858105|
|5.151669|5.664799|7.545300|16.989712|7.670955|5.804169|9.197898|7.827039|13.248438|36.858105|
|4.684605|5.468393|7.012484|11.133777|5.496234|4.748611|6.509658|5.338400|7.984567|16.067467|73.516695|
|3.224967|3.243049|3.745460|6.727343|4.454158|3.703810|7.057760|7.830504|12.815301|7.381114|11.043171|36.858105|
|2.811605|2.772055|3.126487|5.457668|3.856357|3.258173|6.442072|7.025516|8.132701|5.207277|7.944200|15.716715|73.516695|
|2.997238|3.100898|3.553997|5.900941|3.736013|3.260917|5.428781|5.231469|7.871227|6.536858|11.873733|14.183868|15.120382|53.358707|
|2.458991|2.524001|2.812077|4.445971|2.926211|2.634534|4.266780|3.920236|5.049897|4.374020|8.087117|7.844184|12.317539|17.965623|36.858105|
|2.275883|2.392040|2.656134|3.999785|2.576885|2.360662|3.610885|3.148522|3.957362|3.801563|7.529370|5.169870|8.057905|10.688804|12.412698|36.858105|
|2.289394|2.453515|2.784076|4.183864|2.628447|2.368243|3.659383|3.175866|4.006380|3.945777|7.876555|5.060602|7.783139|10.012477|9.110624|17.669889|0.500000|
|1.928374|2.005919|2.189029|3.247122|2.150852|1.995857|3.035172|2.592628|3.074924|2.923744|5.613575|3.868935|6.551170|6.840595|7.515176|12.409963|0.249206|36.858105|
|1.820777|1.859502|1.993702|2.958021|2.011145|1.892363|2.861933|2.431836|2.810700|2.624963|4.940063|3.514378|6.179844|5.875124|6.290007|7.468006|0.156082|13.647091|36.858105|
|1.609037|1.638953|1.744064|2.561027|1.760162|1.666763|2.502868|2.091204|2.351289|2.209341|4.117599|2.840030|5.096114|4.503064|4.385264|4.961378|0.116262|7.811191|13.796290|36.858105|
|1.506455|1.548827|1.655562|2.410539|1.645625|1.552548|2.327124|1.926450|2.153413|2.050524|3.831112|2.550168|4.554336|4.001976|3.739421|4.387195|0.110491|6.785762|8.006767|13.791766|36.858105|
|1.559487|1.623702|1.754923|2.548525|1.712799|1.601918|2.408440|1.995707|2.255342|2.173339|4.099309|2.664063|4.679432|4.247019|3.934126|4.937107|0.131713|7.818046|6.928465|7.951725|13.826843|36.858105|
|1.751557|1.838491|2.010809|2.940660|1.943154|1.800965|2.726094|2.288040|2.654447|2.567554|4.912346|3.201933|5.486652|5.348248|5.152998|7.395614|0.200569|13.677565|8.058702|6.912462|7.990451|13.741708|36.858105|
|1.776983|1.903949|2.116416|3.058914|1.977326|1.813387|2.739045|2.273710|2.643084|2.632367|5.089299|3.074015|5.152059|5.050982|4.366199|6.019344|0.204515|6.917687|4.749179|4.230091|4.814848|7.159967|10.882503|448.794386|
|1.325774|1.357095|1.438311|2.077247|1.434372|1.362956|2.025825|1.652517|1.808814|1.728882|3.201230|2.087129|3.763660|3.167246|2.809130|3.132398|0.081412|4.189798|4.778797|7.033721|10.951870|7.059103|4.778801|28.639424|448.794386|
|2.440862|2.584154|2.821661|4.111882|2.627721|2.469111|3.559416|3.020432|3.827822|3.931497|8.312661|4.592445|6.871862|9.212177|7.717107|13.042169|0.260820|7.490228|5.766727|4.167769|3.697329|4.024568|5.413551|38.498797|22.333363|53.358707|
|2.297475|2.491369|2.716907|3.797974|2.397026|2.268985|3.174215|2.610673|3.214977|3.460474|7.465649|3.602693|5.500078|6.531842|5.065430|7.726757|0.209499|5.904344|4.551472|3.626646|3.443198|3.904589|5.136155|41.292052|21.414664|17.804938|36.858105|
|2.520731|2.777565|2.969088|3.975035|2.491506|2.413869|3.194784|2.558258|3.130516|3.553664|7.988519|3.292834|4.968154|5.659799|4.002451|5.087754|0.139628|4.065310|3.452923|2.880599|2.728831|2.985151|3.637223|29.892254|17.875684|10.596909|12.456317|36.858105|
|2.546044|2.713372|2.794275|3.759350|2.440284|2.430639|3.136458|2.498621|3.013680|3.345233|7.283288|3.166758|4.836423|5.323020|3.805674|4.512960|0.114871|3.749593|3.423037|2.865993|2.628666|2.753031|3.239244|24.877152|17.433219|9.391036|7.740040|12.700229|36.858105|
|2.464742|2.547409|2.617752|3.644933|2.423883|2.412321|3.191811|2.587152|3.116709|3.298354|6.906709|3.404291|5.262280|5.801322|4.347342|5.026820|0.118615|4.223572|4.051621|3.295466|2.896575|2.941412|3.449773|24.853642|18.916500|10.649088|6.860460|7.605006|14.185473|36.858105|
|2.379036|2.396247|2.390294|3.301547|2.265895|2.315084|2.980972|2.372692|2.762916|2.888108|5.826984|2.946400|4.678368|4.717763|3.503607|3.763716|0.090885|3.361031|3.412101|2.910907|2.549242|2.516108|2.825954|20.335050|17.264564|6.816961|4.534032|5.073878|8.214934|13.220281|36.858105|
|2.392872|2.425733|2.371889|3.179916|2.183342|2.269130|2.815325|2.190628|2.515281|2.700023|5.474071|2.588968|4.111824|4.036835|2.910770|3.125456|0.078659|2.806723|2.791697|2.451328|2.211487|2.209289|2.453283|18.287382|15.327550|5.492682|3.960136|4.811067|7.693906|8.225816|14.192016|36.858105|
|2.503925|2.644136|2.610952|3.395166|2.257585|2.323042|2.852533|2.204618|2.564885|2.866953|6.043396|2.591828|4.043588|4.090541|2.879904|3.206938|0.083755|2.811373|2.664726|2.333835|2.165707|2.231842|2.518662|19.600316|14.942428|5.787545|4.626869|6.636969|10.985953|7.459311|7.459565|11.012354|388.023441|
|2.351782|2.422151|2.555397|3.692950|2.451535|2.371658|3.327342|2.784629|3.407215|3.433039|7.012466|4.006338|6.233323|7.307590|6.164357|7.657043|0.157861|6.142526|5.851885|4.298904|3.607519|3.651061|4.482137|29.996911|22.278174|17.831878|7.874916|6.410919|7.635080|12.645420|7.283114|5.077458|33.782535|36.858105|
|17.785083|8.714798|5.611940|6.602789|5.604805|8.899576|5.627893|3.492068|3.476859|4.078467|6.852783|2.807099|4.434542|3.604998|2.230203|2.083520|0.057752|1.791623|1.708615|1.521877|1.424538|1.465953|1.632223|13.210596|10.138365|3.060241|2.130577|2.353464|2.420413|2.346936|2.316452|2.366390|17.422520|2.207239|0.500000|
|8.767004|17.703015|9.266298|7.638536|5.001396|5.700765|4.975681|3.249093|3.457822|4.493181|8.194555|2.809075|4.325010|3.750285|2.300970|2.230577|0.063657|1.892997|1.755317|1.558698|1.481812|1.555588|1.751745|14.648320|10.482772|3.313155|2.403174|2.730424|2.663110|2.453188|2.323241|2.400803|18.983185|2.292554|0.209711|0.500000|
|5.550000|8.881820|17.835681|12.085247|5.676557|4.975810|5.804308|3.972073|4.474059|6.486565|11.872951|3.515443|5.238085|4.692398|2.770274|2.689586|0.079933|2.217933|1.992133|1.746865|1.675305|1.795387|2.065116|17.837959|11.674597|3.887566|2.829162|3.104742|2.823432|2.590615|2.329868|2.320813|18.614256|2.532213|0.122496|0.216270|0.500000|
|8.958798|5.667299|4.960593|7.638487|9.057573|17.684516|9.671068|5.183938|4.503620|4.677946|6.960772|3.438032|5.568993|4.082648|2.482424|2.205070|0.060781|1.892981|1.820682|1.614244|1.497567|1.531368|1.706264|13.630970|10.621399|3.115346|2.088973|2.200178|2.248061|2.267742|2.214566|2.163129|15.396187|2.238515|0.212647|0.124173|0.107916|0.500000|
|3.439653|3.245666|3.658322|6.931295|5.692882|4.388222|12.625552|17.749514|9.006362|5.607889|7.569680|7.368768|14.406962|6.613720|3.877120|3.048319|0.084751|2.573902|2.448213|2.121253|1.949312|2.003998|2.275777|17.928700|13.479053|3.867583|2.443088|2.347531|2.301384|2.415219|2.229359|2.042625|14.434186|2.644941|0.082619|0.076369|0.091083|0.119849|0.500000|
|3.253543|3.446653|3.969270|6.382163|3.870230|3.437011|5.309745|4.847892|7.396356|7.471621|15.922774|9.361802|10.846198|26.012418|9.064703|7.514977|0.201074|4.713636|3.997843|3.103370|2.791393|2.986794|3.763432|29.387134|17.870351|10.744859|5.613648|5.077013|4.679422|4.934888|3.858704|3.326370|24.702733|5.933408|0.079453|0.085293|0.107760|0.085965|0.119278|0.500000|
|2.386554|2.395955|2.602761|4.079221|2.779927|2.562833|4.076383|3.699440|4.560395|3.911324|7.127771|6.722125|11.452256|12.421585|17.568415|8.695542|0.175097|6.741523|6.804074|4.669557|3.752624|3.724979|4.592573|29.819886|22.862438|9.171224|4.480701|3.685921|3.730631|4.504860|3.767021|3.040143|20.463740|6.547905|0.060886|0.060811|0.070175|0.068275|0.103258|0.196801|0.500000|
|2.280049|2.336941|2.618586|4.173008|2.778717|2.467858|4.147589|3.832631|4.690845|3.939799|6.999593|7.256640|13.284211|12.537770|17.625404|8.879094|0.220667|6.989514|5.930415|4.377941|3.831539|4.062475|5.220353|35.820785|23.220822|7.654000|4.192596|3.365449|3.159763|3.507492|2.935261|2.501226|17.672164|4.662755|0.057473|0.059235|0.072007|0.065040|0.109477|0.182011|0.304872|0.500000|
|1.918668|1.935640|2.059303|3.077835|2.116771|2.005146|3.027867|2.589084|2.996810|2.758034|5.153195|3.794898|6.699924|6.318736|6.807913|6.960836|0.141559|8.915654|17.761368|9.042486|5.703833|4.984658|5.695619|31.308812|31.760653|7.912462|4.321459|3.428551|3.550098|4.404288|3.787525|3.007361|19.737385|6.579619|0.050096|0.050466|0.056458|0.053912|0.072527|0.118177|0.239608|0.167701|0.500000|
|1.541735|1.555951|1.640671|2.406001|1.675353|1.599206|2.388456|1.983043|2.197526|2.055719|3.797958|2.623026|4.764239|4.051774|3.813722|4.063458|0.096373|5.592652|8.913188|17.753180|8.920784|5.654936|4.975301|27.425366|53.587513|4.874786|3.128259|2.587897|2.641224|3.064169|2.811566|2.371365|15.704783|3.861294|0.040749|0.041134|0.045357|0.043363|0.056173|0.077665|0.116940|0.105477|0.217955|0.500000|
|1.467018|1.533601|1.657607|2.388859|1.605222|1.501614|2.248505|1.844840|2.063959|2.005959|3.774704|2.389127|4.198862|3.734585|3.314492|4.043509|0.112891|5.602738|4.985398|5.653612|8.928698|17.775600|8.918499|55.454770|53.800816|4.661658|3.460183|2.727348|2.489617|2.597968|2.250855|2.015941|14.656970|3.098980|0.038375|0.041019|0.047383|0.039854|0.051421|0.073607|0.086604|0.095741|0.108140|0.124274|0.500000|
|2.043287|2.190894|2.354366|3.275907|2.112849|2.017945|2.817409|2.297920|2.749358|2.896746|6.026418|3.082618|4.871298|5.357737|4.359415|6.474528|0.169345|5.988834|4.759846|3.928721|3.804339|4.327159|5.515601|42.175805|23.539570|12.233477|17.447918|8.830660|6.757569|6.306194|4.403231|3.853001|31.155397|7.154639|0.053263|0.059188|0.067847|0.052205|0.060590|0.121178|0.111703|0.104023|0.121274|0.093335|0.106312|0.500000|
|2.267528|2.495807|2.783248|3.898111|2.417721|2.248488|3.206257|2.639715|3.250371|3.519857|7.557144|3.623894|5.536324|6.485660|4.931880|7.484968|0.247274|5.715268|4.200358|3.421196|3.368994|3.990588|5.401742|50.234745|21.053904|12.500890|17.625678|8.888383|5.619436|4.996272|3.630935|3.276413|27.248459|5.705410|0.057917|0.066835|0.082166|0.057137|0.068642|0.151949|0.115530|0.118668|0.107816|0.081326|0.100562|0.302344|0.500000|
|2.305305|2.555122|2.709229|3.555090|2.246020|2.187473|2.870425|2.264339|2.699995|3.052830|6.660988|2.802040|4.323417|4.634649|3.325928|4.159869|0.117233|3.562060|3.062719|2.647641|2.571135|2.831274|3.355000|28.452093|17.202318|7.676822|8.847981|17.540854|8.877316|5.769497|4.322609|4.342755|44.581131|4.914941|0.060377|0.071122|0.079779|0.055583|0.058101|0.110891|0.085740|0.080518|0.083045|0.066409|0.073454|0.219968|0.208474|0.500000|
|2.870749|3.255184|3.548660|4.669909|2.830025|2.720488|3.555169|2.833174|3.536440|4.234288|10.153863|3.588710|5.270093|6.119336|4.027094|4.832517|0.138581|3.712510|3.147111|2.628528|2.493928|2.732739|3.330508|28.215843|16.485734|9.307399|8.850770|17.544815|8.932478|6.140571|4.441653|4.303979|41.538134|5.420002|0.073275|0.088630|0.104673|0.067580|0.070800|0.159814|0.100812|0.094443|0.087629|0.065977|0.069918|0.174013|0.220831|0.301861|0.500000|
|2.254823|2.229881|2.219031|3.111170|2.177495|2.228261|2.910967|2.325439|2.664421|2.704279|5.295154|2.878821|4.674464|4.516512|3.431572|3.553566|0.084748|3.273097|3.475228|2.997529|2.569238|2.473996|2.730513|19.210231|17.542496|6.039271|3.868570|4.054840|5.720190|8.556038|17.725642|8.929122|37.699011|6.511221|0.061261|0.059624|0.059584|0.060106|0.061504|0.099113|0.106415|0.080687|0.110552|0.082385|0.061178|0.106015|0.088688|0.098023|0.101318|0.500000|
|2.281055|2.281608|2.196701|2.928785|2.044991|2.153500|2.635529|2.025888|2.279692|2.430602|4.824931|2.320614|3.737719|3.526593|2.540400|2.674380|0.068005|2.448199|2.466606|2.211524|2.005594|1.987849|2.170839|16.238794|14.167080|4.492982|3.241693|3.822669|5.410719|5.679818|8.778549|17.788614|55.238384|4.021087|0.063695|0.063175|0.059390|0.057640|0.052715|0.079303|0.074054|0.061750|0.073738|0.060221|0.050798|0.088588|0.076929|0.099208|0.097838|0.204103|0.500000|
|2.453457|2.472919|2.597154|3.843395|2.602866|2.520259|3.595000|3.057440|3.744833|3.621853|7.148014|4.542478|7.118916|8.193052|6.973983|7.030197|0.144227|5.627913|5.790289|4.216701|3.427762|3.374730|4.051794|26.952020|21.442874|12.472459|5.705038|4.964205|5.848081|8.969462|6.735579|4.677067|29.399904|17.570012|0.063860|0.064097|0.070147|0.066767|0.081274|0.175476|0.235909|0.141637|0.202074|0.108411|0.079646|0.143135|0.127854|0.109764|0.126670|0.187036|0.106762|0.500000|
|2.073572|2.127682|2.234325|3.212353|2.159976|2.093217|2.954776|2.453063|2.912241|2.893427|5.759333|3.419467|5.545533|5.945062|5.301773|6.755970|0.141408|6.676248|7.005388|5.182204|4.209769|4.115248|4.886640|30.592749|25.474915|12.223104|6.764670|5.315621|6.105597|8.961966|6.405359|4.595843|29.884035|17.450427|0.054529|0.056392|0.061812|0.055405|0.065817|0.127187|0.159878|0.119034|0.213537|0.128485|0.095031|0.201371|0.141958|0.122936|0.122556|0.170656|0.104480|0.302324|0.500000|
|5.119846|5.993244|9.415182|25.712897|9.419625|5.897624|10.204308|6.788568|7.086960|9.362945|11.924174|4.779361|7.096925|5.645646|3.185250|2.875986|0.085287|2.356724|2.129660|1.854604|1.762202|1.876846|2.164243|18.363911|12.216453|3.913319|2.682098|2.745584|2.546827|2.468498|2.222765|2.133702|16.242305|2.543015|0.110475|0.130784|0.228618|0.128870|0.142556|0.120780|0.079951|0.085259|0.060868|0.048223|0.049158|0.064637|0.078026|0.068995|0.088740|0.058407|0.054659|0.072976|0.062240|0.500000|
|4.464466|3.957172|4.302538|8.070504|9.087679|6.455913|26.037443|9.514965|5.847829|5.006585|6.809971|4.296151|7.404691|4.609434|2.776979|2.370590|0.066640|2.037676|1.939795|1.718169|1.603670|1.652052|1.848031|14.882015|11.324216|3.156805|2.086530|2.091548|2.060389|2.101446|1.984584|1.881958|13.476474|2.189416|0.104551|0.090243|0.101250|0.183299|0.228771|0.091007|0.074484|0.076238|0.056852|0.045821|0.043052|0.052102|0.058590|0.052774|0.063851|0.054240|0.049372|0.065551|0.054770|0.162869|0.500000|
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