RDKit 3D 72 75 0 0 0 0 0 0 0 0999 V2000 5.9090 -1.1601 5.2598 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4903 -1.5352 4.0149 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7403 -1.3384 2.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4762 -0.7450 2.8514 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7889 -0.6066 1.6347 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3755 -1.0342 0.4334 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6365 -1.6299 0.4464 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3135 -1.7669 1.6738 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5433 -2.3904 1.6892 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5795 -1.4230 1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2946 -2.0935 -0.6626 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6177 -2.0443 -1.9117 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 0.0321 1.6609 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1148 0.7671 2.5842 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5952 -0.2652 0.6144 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2024 0.1799 0.6036 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0880 1.6698 0.2458 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6315 2.0069 -1.1451 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1922 3.5167 -1.7819 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8245 3.7568 -3.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5525 -0.7244 -0.4053 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0966 -1.4447 -1.1712 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 -0.6720 -0.4652 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6176 -1.4776 -1.4842 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8164 -0.7160 -2.0302 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8533 -0.4065 -0.9215 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2295 -0.5318 0.4968 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7910 -0.0235 0.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4255 0.9800 -1.1193 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7754 1.2721 -1.0512 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8930 2.6313 -1.2612 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6862 3.1829 -1.4539 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7892 2.1888 -1.3649 N 0 0 0 0 0 4 0 0 0 0 0 0 -7.8491 0.2832 -0.8266 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2075 -1.0230 -0.2946 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9675 -1.4110 -1.0071 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6134 -1.4243 6.0519 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9775 -1.7076 5.4425 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7438 -0.0781 5.3042 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9982 -0.3885 3.7598 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8553 -0.8796 -0.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3944 -0.7509 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5136 -1.9584 1.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7057 -0.8434 2.4586 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4133 -1.0095 -2.2026 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6938 -2.6345 -1.8867 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2762 -2.4795 -2.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -1.0823 0.0402 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1972 -0.0017 1.6049 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9573 1.9795 0.3286 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6299 2.2708 0.9875 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4358 1.2108 -1.8666 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7129 2.1711 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8687 3.9373 -2.9889 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7618 2.8741 -3.9072 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4515 4.6262 -3.8116 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9199 -2.4206 -1.0196 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9319 -1.7148 -2.3022 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4513 0.2096 -2.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2659 -1.2892 -2.8513 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2199 -1.5868 0.8126 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8235 0.0046 1.2475 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7913 1.0476 0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 -0.1779 1.5286 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7685 3.1532 -1.2789 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4760 4.2291 -1.6495 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7842 2.3261 -1.4753 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5816 0.6740 -0.1097 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3525 0.0962 -1.7827 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9898 -0.9160 0.7751 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9359 -1.8366 -0.3796 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1951 -1.6344 -1.9805 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 7 11 1 0 11 12 1 0 5 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 16 21 1 0 21 22 2 0 21 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 26 29 1 0 29 30 2 0 30 31 1 0 31 32 1 0 32 33 2 0 30 34 1 0 34 35 1 0 35 36 1 0 8 3 1 0 28 23 1 0 36 26 1 0 33 29 1 0 1 37 1 0 1 38 1 0 1 39 1 0 4 40 1 0 6 41 1 0 10 42 1 0 10 43 1 0 10 44 1 0 12 45 1 0 12 46 1 0 12 47 1 0 15 48 1 0 16 49 1 1 17 50 1 0 17 51 1 0 18 52 1 0 18 53 1 0 20 54 1 0 20 55 1 0 20 56 1 0 24 57 1 0 24 58 1 0 25 59 1 0 25 60 1 0 27 61 1 0 27 62 1 0 28 63 1 0 28 64 1 0 31 65 1 0 32 66 1 0 33 67 1 0 34 68 1 0 34 69 1 0 35 70 1 0 35 71 1 0 36 72 1 0 M CHG 1 33 1 M END