RDKit 3D 98100 0 0 0 0 0 0 0 0999 V2000 -8.9834 1.3399 -1.7598 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8068 0.4701 -1.7486 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7414 0.6965 -0.9365 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8703 1.9110 -0.0656 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0615 2.3489 0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4010 3.6637 1.5433 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4649 4.4010 0.8211 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5138 4.0712 2.3578 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5544 4.5228 3.2412 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5338 3.8583 3.7155 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2078 2.5449 3.4038 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4607 3.1274 3.1404 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 1.4078 3.1547 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6594 0.8489 2.7706 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3144 -0.4556 2.5755 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0405 -0.6823 2.1795 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5904 -1.8302 1.8608 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2410 -3.0384 1.8902 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0096 -1.8040 1.5421 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 -2.7824 1.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1780 -2.3874 0.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1178 -3.1236 0.3798 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8128 -4.4834 -0.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4599 -2.4816 0.2582 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8886 -2.3201 -1.1507 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4622 -1.1646 -1.3411 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4884 -0.3717 -0.0202 C 0 0 2 0 0 0 0 0 0 0 0 0 8.8871 -0.5240 0.4484 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8510 -0.0751 -0.6374 C 0 0 2 0 0 0 0 0 0 0 0 0 10.6084 0.9599 -0.0563 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1799 0.5102 -1.8506 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0919 -0.3871 -2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0134 0.5757 -2.9621 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5335 -1.1912 -3.6033 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4180 -1.0421 0.7320 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6325 -0.2099 -1.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7094 0.1676 -2.2365 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7047 -0.2206 0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0072 -1.6718 -1.3263 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2945 -1.8566 -2.0315 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.1319 -2.8742 -3.0212 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7683 -0.6344 -2.7472 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7373 0.9858 -2.5156 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7543 2.3961 -1.9918 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5130 1.2989 -0.7947 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8233 2.4936 -0.2049 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0685 2.0342 1.0626 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4684 4.0153 1.0041 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4458 5.4709 1.1615 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2200 4.4556 -0.2727 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9893 5.3725 2.1228 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5696 5.5836 3.6701 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9404 4.4218 4.4853 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0571 2.4773 3.8561 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5498 2.9496 2.1258 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6102 4.1300 3.4928 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7402 0.6117 3.2603 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7752 1.4850 2.5177 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0881 -1.1417 2.7377 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7507 0.1803 2.1203 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1867 -2.9296 2.4152 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3748 -3.8982 2.3067 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3972 -3.3164 0.7971 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5402 -0.8419 1.6771 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3584 -3.7312 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 -1.4028 1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -4.6978 -0.0499 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1263 -4.5543 -1.1602 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3448 -5.2330 0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1974 -3.0239 0.8452 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7218 -3.1039 -1.9161 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2521 0.7044 -0.2547 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0705 -1.6173 0.5932 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1056 -0.0328 1.4166 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5810 -0.8767 -0.8787 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9704 1.4581 0.5302 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7672 1.5081 -1.6307 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9395 0.6401 -2.6351 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5090 1.3491 -3.5967 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6156 1.1284 -2.0842 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2157 0.0310 -3.5118 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1020 -2.0975 -3.3709 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5851 -1.5706 -4.1011 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9967 -0.5010 -4.3366 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3537 -0.9177 1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4646 -0.6350 0.1917 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6250 0.0561 -1.9318 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8412 -0.5107 -3.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8901 1.2018 -2.5636 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2030 -0.1826 1.1169 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9268 0.5253 0.0304 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1505 -1.2281 0.1287 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9923 -2.2083 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1666 -2.1470 -1.9189 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0613 -2.2638 -1.3232 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9442 -2.8428 -3.5638 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0904 -0.4101 -3.5873 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8045 -0.8613 -3.1178 H 0 0 0 0 0 0 0 0 0 0 0 0 12 11 1 0 11 10 1 0 10 9 2 0 9 8 1 0 8 6 2 0 6 7 1 0 6 5 1 0 5 4 2 0 4 3 1 0 3 2 2 0 2 1 1 0 2 42 1 0 42 40 1 0 40 41 1 0 40 39 1 0 39 36 1 0 36 37 1 0 36 38 1 0 11 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 22 24 1 0 24 35 1 0 35 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 29 31 1 0 31 32 1 0 32 33 1 0 32 34 1 0 32 26 1 0 26 25 2 0 36 3 1 0 25 24 1 0 26 27 1 0 12 54 1 0 12 55 1 0 12 56 1 0 10 53 1 0 9 52 1 0 8 51 1 0 7 48 1 0 7 49 1 0 7 50 1 0 5 47 1 0 4 46 1 0 1 43 1 0 1 44 1 0 1 45 1 0 42 97 1 0 42 98 1 0 40 95 1 1 41 96 1 0 39 93 1 0 39 94 1 0 37 87 1 0 37 88 1 0 37 89 1 0 38 90 1 0 38 91 1 0 38 92 1 0 13 57 1 0 14 58 1 0 15 59 1 0 16 60 1 0 18 61 1 0 18 62 1 0 18 63 1 0 19 64 1 0 20 65 1 0 21 66 1 0 23 67 1 0 23 68 1 0 23 69 1 0 24 70 1 1 35 85 1 0 35 86 1 0 27 72 1 6 28 73 1 0 28 74 1 0 29 75 1 6 30 76 1 0 31 77 1 0 31 78 1 0 33 79 1 0 33 80 1 0 33 81 1 0 34 82 1 0 34 83 1 0 34 84 1 0 25 71 1 0 M END