HMDB0001859 RDKit 3D Acetaminophen 20 20 0 0 0 0 0 0 0 0999 V2000 3.7382 0.4326 0.6352 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2723 0.6463 0.2952 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0104 1.7737 -0.1813 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3401 -0.3693 0.5185 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0355 -0.2646 0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6706 0.8237 -0.2897 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0494 0.8405 -0.5395 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8326 -0.2426 -0.2661 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1870 -0.2371 -0.5073 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2140 -1.3517 0.2646 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8686 -1.3690 0.5087 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2074 1.3948 0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8406 -0.3083 1.4364 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2486 0.0509 -0.2641 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7108 -1.2625 0.9248 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1261 1.7122 -0.5313 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5331 1.7154 -0.9575 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7103 0.5147 -0.8854 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7774 -2.2641 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3638 -2.2356 0.9272 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 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 4 15 1 0 6 16 1 0 7 17 1 0 9 18 1 0 10 19 1 0 11 20 1 0 M END