HMDB0002215 RDKit 3D 4a-Carbinolamine tetrahydrobiopterin 30 31 0 0 0 0 0 0 0 0999 V2000 -3.6864 0.8308 0.5723 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2350 0.5263 0.3068 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6836 1.5944 -0.3522 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1565 -0.7579 -0.4845 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.7574 -1.7538 0.3104 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -1.1576 -0.8448 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1858 -0.2968 -1.9155 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1211 0.2401 -1.5971 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7620 0.0186 -0.5211 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9781 0.6065 -0.3953 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6599 0.3749 0.7395 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9479 0.9894 0.8880 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1792 -0.3998 1.7185 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9797 -1.0003 1.6346 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4940 -1.7309 2.5250 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2387 -0.7855 0.4721 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0856 -1.3248 0.3199 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2501 0.9960 -0.3851 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7321 1.7886 1.1606 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1856 0.0254 1.1453 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7612 0.3459 1.2978 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1075 2.0960 0.2496 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7666 -0.6527 -1.3959 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7306 -1.6951 0.1482 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8519 -2.2063 -1.2685 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0349 -0.8767 -2.8775 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8314 0.5458 -2.2123 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3904 1.2185 -1.1356 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4377 1.4251 0.0848 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4312 1.0159 1.8118 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 2 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 2 0 17 6 1 0 16 9 1 0 1 18 1 0 1 19 1 0 1 20 1 0 2 21 1 1 3 22 1 0 4 23 1 6 5 24 1 0 6 25 1 6 7 26 1 0 7 27 1 0 10 28 1 0 12 29 1 0 12 30 1 0 M END