HMDB0304180 RDKit 3D 4-hydroxybenzoate 15 15 0 0 0 0 0 0 0 0999 V2000 3.3122 0.9776 0.3547 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6149 -0.0526 0.1896 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2887 -1.2615 0.1416 O 0 0 0 0 0 1 0 0 0 0 0 0 1.1601 0.0001 0.0526 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4611 1.1844 0.0959 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9161 1.2137 -0.0358 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6454 0.0559 -0.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0359 0.0799 -0.3495 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9511 -1.1352 -0.2604 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4236 -1.1510 -0.1277 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9897 2.1194 0.2355 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4786 2.1345 -0.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6121 0.0042 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5245 -2.0453 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9133 -2.1241 -0.1715 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 2 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 4 1 0 5 11 1 0 6 12 1 0 8 13 1 0 9 14 1 0 10 15 1 0 M CHG 1 3 -1 M END