HMDB0032572 RDKit 3D Methylparaben 19 19 0 0 0 0 0 0 0 0999 V2000 3.6298 0.6320 0.8349 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2588 0.3093 0.7626 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4755 0.4737 -0.3427 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9734 0.9441 -1.3940 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0616 0.1241 -0.3659 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5225 -0.3969 0.7734 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8596 -0.7365 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6664 -0.5724 -0.3432 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0099 -0.9202 -0.3176 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0683 -0.0530 -1.4668 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7191 0.2950 -1.4889 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7317 1.7150 1.0395 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1349 0.0050 1.6025 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0924 0.3448 -0.1378 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1052 -0.5308 1.6653 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3253 -1.1481 1.6757 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4154 -1.2943 0.5113 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6411 0.1050 -2.3903 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2358 0.7041 -2.3646 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 2 0 11 5 1 0 1 12 1 0 1 13 1 0 1 14 1 0 6 15 1 0 7 16 1 0 9 17 1 0 10 18 1 0 11 19 1 0 M END