HMDB0060427 RDKit 3D Acetone cyanohydrin 13 12 0 0 0 0 0 0 0 0999 V2000 1.2206 -0.3747 -0.4054 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0546 0.2296 0.1133 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 -0.8153 0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2995 1.0951 1.1586 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6722 1.0108 -0.9757 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1764 1.6288 -1.8241 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5136 -1.2440 0.2336 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1846 -0.6512 -1.4698 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0548 0.3719 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0533 -0.6006 0.1442 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1947 -0.7204 1.6897 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7488 -1.8426 0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6673 1.9126 0.6928 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 2 5 1 0 5 6 3 0 1 7 1 0 1 8 1 0 1 9 1 0 3 10 1 0 3 11 1 0 3 12 1 0 4 13 1 0 M END