HMDB0248289 RDKit 3D Amfenac 32 33 0 0 0 0 0 0 0 0999 V2000 1.4307 1.0840 -1.4649 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3429 0.2951 -0.2769 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5141 -0.1679 0.2815 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8364 0.1142 -0.2956 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1402 -0.6852 -1.4836 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3099 -1.5096 -1.9118 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3420 -0.5339 -2.1362 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4311 -0.9264 1.4271 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1967 -1.1973 1.9739 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0226 -0.7100 1.3784 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0779 0.0519 0.2331 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 0.5452 -0.4488 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8774 1.1295 -1.5826 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4616 0.4767 -0.0441 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4195 0.2779 -1.0484 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7485 0.2507 -0.6966 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2072 0.4079 0.5925 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2597 0.6034 1.5718 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8936 0.6375 1.2497 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6747 2.1095 -1.4021 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2670 0.7139 -2.4196 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8999 1.2112 -0.4819 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6080 -0.1236 0.4647 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0309 -1.2807 -1.9889 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3201 -1.3085 1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1221 -1.7866 2.8652 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9394 -0.9689 1.8289 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0847 0.1494 -2.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 0.0963 -1.4849 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2758 0.3793 0.8308 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6111 0.7275 2.5841 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2267 0.8245 2.0735 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 1 0 5 6 2 0 5 7 1 0 3 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 12 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 11 2 1 0 19 14 1 0 1 20 1 0 1 21 1 0 4 22 1 0 4 23 1 0 7 24 1 0 8 25 1 0 9 26 1 0 10 27 1 0 15 28 1 0 16 29 1 0 17 30 1 0 18 31 1 0 19 32 1 0 M END