HMDB0248977 RDKit 3D Benzene oxide 13 14 0 0 0 0 0 0 0 0999 V2000 1.2370 0.6711 -0.0627 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1026 1.3513 -0.0403 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1412 0.7575 -0.0928 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2098 0.0681 0.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1698 -0.6803 0.2268 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0108 -1.3630 0.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1957 -0.7819 -0.0757 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2024 1.2071 -0.0714 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2260 2.4932 0.0276 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3844 0.9675 -1.3513 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2821 -0.8440 1.5102 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0885 -2.5019 -0.0451 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1243 -1.3447 -0.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 1 1 0 5 3 1 0 1 8 1 0 2 9 1 0 3 10 1 0 5 11 1 0 6 12 1 0 7 13 1 0 M END