HMDB0033942 RDKit 3D Dambonitol 30 30 0 0 0 0 0 0 0 0999 V2000 3.1186 -1.1146 1.1518 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4531 -0.9233 -0.0483 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2199 -0.3321 0.0884 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0953 -1.1601 -0.4935 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2130 -1.1026 -1.8814 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1965 -0.4552 -0.1306 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.2504 -1.2873 -0.3317 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9537 -1.6602 0.7903 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2275 0.8495 -0.8422 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3891 1.5786 -0.6409 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0857 1.6882 -0.2744 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1461 2.9958 -0.6813 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2029 0.9920 -0.6462 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3231 1.7616 -0.3554 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0950 -1.5963 0.9085 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3633 -0.1689 1.6703 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5599 -1.8284 1.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9738 -0.1097 1.1581 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0473 -2.1760 -0.0956 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5365 -1.5572 -2.3345 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1214 -0.2381 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7760 -2.3368 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3471 -2.2870 1.4919 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4591 -0.8199 1.3045 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0425 0.7671 -1.9294 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5456 1.8162 0.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1576 1.6627 0.8406 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2238 3.5656 0.0396 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1891 0.7617 -1.7269 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1567 2.7148 -0.5306 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 1 0 6 9 1 0 9 10 1 0 9 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 13 3 1 0 1 15 1 0 1 16 1 0 1 17 1 0 3 18 1 1 4 19 1 1 5 20 1 0 6 21 1 1 8 22 1 0 8 23 1 0 8 24 1 0 9 25 1 6 10 26 1 0 11 27 1 1 12 28 1 0 13 29 1 6 14 30 1 0 M END