HMDB0033611 RDKit 3D Licocoumarin A 56 58 0 0 0 0 0 0 0 0999 V2000 4.9414 -0.2608 1.7689 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7625 0.8276 1.1712 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7373 1.5316 2.1356 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7596 1.2508 -0.0527 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9885 0.8216 -1.1949 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0132 -0.2509 -1.0793 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4883 -1.5587 -1.0333 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8392 -1.7959 -1.0627 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6477 -2.6329 -0.9582 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3059 -2.3846 -0.9289 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7591 -1.1243 -0.9703 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3305 -0.8528 -0.9393 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2851 0.0461 -1.8044 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6418 0.2856 -1.7532 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3063 1.1619 -2.5807 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6586 1.3918 -2.5191 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3702 0.6761 -1.5465 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7202 0.9035 -1.4828 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7431 -0.1980 -0.7126 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4987 -0.9526 0.3169 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8103 -0.0358 1.4382 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0479 0.1335 1.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1564 -0.5942 1.2267 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3240 1.0740 3.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3615 -0.4050 -0.8069 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7883 -1.2640 0.0233 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4947 -1.4853 -0.0334 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0711 -2.3064 0.7561 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6582 -0.0530 -1.0469 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0942 1.1973 -1.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9046 -0.1830 1.4307 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8698 -0.0702 2.8984 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4022 -1.2498 1.6176 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1133 1.8114 3.0158 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0744 2.4641 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5351 0.8219 2.3941 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4867 2.1001 -0.2496 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7630 0.5600 -2.0132 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4625 1.6977 -1.6716 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5454 -1.0797 -1.1148 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 -3.6374 -0.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6294 -3.2269 -0.8701 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3072 0.5732 -2.5373 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6946 1.6864 -3.3148 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1729 2.0893 -3.1809 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1558 1.5549 -2.1115 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8982 -1.8192 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4265 -1.2984 -0.1699 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9967 0.5286 1.9429 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4747 -0.2138 0.2424 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8892 -1.6746 1.1718 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0576 -0.5044 1.8787 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6929 0.7780 3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3747 1.0024 3.3284 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1281 2.1245 2.6988 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6258 2.0187 -1.1286 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 2 3 22 23 1 0 22 24 1 0 19 25 2 0 25 26 1 0 26 27 1 0 27 28 2 0 11 29 2 0 29 30 1 0 29 6 1 0 27 12 1 0 25 14 1 0 1 31 1 0 1 32 1 0 1 33 1 0 3 34 1 0 3 35 1 0 3 36 1 0 4 37 1 0 5 38 1 0 5 39 1 0 8 40 1 0 9 41 1 0 10 42 1 0 13 43 1 0 15 44 1 0 16 45 1 0 18 46 1 0 20 47 1 0 20 48 1 0 21 49 1 0 23 50 1 0 23 51 1 0 23 52 1 0 24 53 1 0 24 54 1 0 24 55 1 0 30 56 1 0 M END