HMDB0013636 RDKit 3D Pyrroloquinoline quinone 30 32 0 0 0 0 0 0 0 0999 V2000 5.1896 -1.2544 1.4257 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6756 -0.6262 0.4659 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4988 -0.0839 -0.5284 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2269 -0.4387 0.3491 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6722 0.2485 -0.7017 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2671 0.3988 -0.7639 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7479 1.0957 -1.9176 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 2.3485 -1.8981 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3057 0.4450 -3.0574 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5266 -0.1518 0.2358 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0865 -0.8443 1.2936 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4474 -0.9609 1.3047 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 -1.4493 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8934 -2.0641 3.3197 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0905 -1.3079 2.3623 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8600 -1.7763 3.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6891 -0.5825 1.2598 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0099 -0.2661 0.9495 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0561 0.4539 -0.2104 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2641 0.9556 -0.8381 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1606 1.6024 -1.9024 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.5316 0.7597 -0.3259 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7620 0.5914 -0.6318 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9363 -0.0215 0.2331 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5235 0.9324 -0.6696 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3140 0.6608 -1.4596 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 0.9286 -3.9417 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8513 -0.5665 1.5652 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8348 -0.1528 -0.0385 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6009 1.1261 -1.5073 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 1 0 7 8 2 0 7 9 1 0 6 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 0 13 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 20 22 1 0 19 23 1 0 23 24 1 0 12 4 1 0 24 17 2 0 24 10 1 0 3 25 1 0 5 26 1 0 9 27 1 0 18 28 1 0 22 29 1 0 23 30 1 0 M END