HMDB0240280 RDKit 3D Mesylate 9 8 0 0 0 0 0 0 0 0999 V2000 -1.0387 0.0023 0.0862 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6601 -0.4972 -0.0139 S 0 0 0 0 0 6 0 0 0 0 0 0 1.1184 -1.0832 1.3009 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8551 -1.4866 -1.1334 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5683 0.8857 -0.3343 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1090 0.9620 0.6554 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4057 0.2292 -0.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6835 -0.7298 0.5748 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0351 1.7176 -0.2063 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 2 0 2 5 1 0 1 6 1 0 1 7 1 0 1 8 1 0 5 9 1 0 M END