HMDB0246378 RDKit 3D Felbinac 28 29 0 0 0 0 0 0 0 0999 V2000 -4.6760 -0.3191 1.7621 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4712 0.3456 0.7124 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8896 1.6533 0.6542 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7808 -0.3126 -0.3982 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2892 -0.3093 -0.2062 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6754 -0.8186 0.8977 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2851 -0.7916 1.0075 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5029 -0.2614 0.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9492 -0.1506 0.0639 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7079 -0.2273 -1.1007 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0841 -0.0885 -1.1011 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7446 0.1318 0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0196 0.2113 1.2468 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6486 0.0710 1.2237 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1563 0.2524 -1.0888 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5131 0.2314 -1.2075 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3521 2.4261 1.0579 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1810 -1.3517 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0308 0.2547 -1.3119 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2872 -1.2553 1.7072 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2132 -1.1948 1.9030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2124 -0.3950 -2.0425 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5977 -0.1606 -2.0341 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8525 0.2371 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5715 0.3856 2.1783 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 0.1347 2.1599 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4404 0.6705 -1.8701 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0197 0.6307 -2.1031 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 8 15 1 0 15 16 2 0 16 5 1 0 14 9 1 0 3 17 1 0 4 18 1 0 4 19 1 0 6 20 1 0 7 21 1 0 10 22 1 0 11 23 1 0 12 24 1 0 13 25 1 0 14 26 1 0 15 27 1 0 16 28 1 0 M END