HMDB0014693 RDKit 3D Methoxsalen 24 26 0 0 0 0 0 0 0 0999 V2000 -1.0635 2.9003 -1.0544 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7746 1.6032 -1.5157 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4997 0.5218 -0.7195 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5155 -0.2889 -0.2872 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8213 -0.2480 -0.4917 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4142 -1.2402 0.1251 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4479 -1.9878 0.7801 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2278 -1.3916 0.5258 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0785 -1.6371 0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1314 -0.8335 0.4517 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4376 -1.1136 0.8242 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4339 -0.2798 0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0530 0.7783 -0.4211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9763 1.5533 -0.8410 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8080 1.0123 -0.7531 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7947 0.2514 -0.3554 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6848 3.4840 -1.7317 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0739 3.3886 -0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5629 2.7692 -0.0504 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4857 -1.4736 0.1446 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5878 -2.8739 1.3833 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3087 -2.4878 1.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6460 -1.9588 1.4457 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4915 -0.4478 0.6334 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 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 13 15 1 0 15 16 1 0 16 3 1 0 8 4 1 0 16 10 2 0 1 17 1 0 1 18 1 0 1 19 1 0 6 20 1 0 7 21 1 0 9 22 1 0 11 23 1 0 12 24 1 0 M END