HMDB0030578 RDKit 3D Apigravin 35 36 0 0 0 0 0 0 0 0999 V2000 -4.1207 -1.9061 0.4922 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2313 -1.0060 1.1325 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1275 -0.4735 0.4343 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8968 -1.1088 0.4343 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7311 -2.2768 1.1219 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1553 -0.5697 -0.2528 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5095 -1.1622 -0.3177 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3161 -0.9604 0.8901 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4596 -0.3421 0.8257 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9424 0.1583 -0.4811 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3352 -0.0987 2.0194 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0527 0.6075 -0.9318 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2817 1.2530 -0.9382 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5015 2.4382 -1.6177 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7381 3.0656 -1.6101 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7402 2.4400 -0.8849 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8903 2.9460 -0.8289 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5121 1.3145 -0.2460 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3469 0.7113 -0.2454 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5864 -2.8162 0.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5889 -1.4585 -0.4079 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8919 -2.1781 1.2387 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1428 -2.7586 1.1394 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0304 -0.8378 -1.2563 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -2.2744 -0.4242 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9606 -1.3248 1.8332 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2026 0.8749 -0.8859 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9614 0.5966 -0.4134 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0553 -0.7293 -1.1695 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2940 -0.6542 1.9111 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5435 0.9981 2.1316 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8351 -0.4345 2.9413 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7501 1.0929 -1.5038 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6858 2.8852 -2.1678 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9262 3.9884 -2.1329 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 4 6 1 0 6 7 1 0 7 8 1 0 8 9 2 3 9 10 1 0 9 11 1 0 6 12 2 0 12 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 3 1 0 19 13 2 0 1 20 1 0 1 21 1 0 1 22 1 0 5 23 1 0 7 24 1 0 7 25 1 0 8 26 1 0 10 27 1 0 10 28 1 0 10 29 1 0 11 30 1 0 11 31 1 0 11 32 1 0 12 33 1 0 14 34 1 0 15 35 1 0 M END