HMDB0004327 RDKit 3D 1-Butanol 15 14 0 0 0 0 0 0 0 0999 V2000 -1.5192 -0.3178 0.8754 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9588 -0.1222 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.4929 -0.6766 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4344 0.2620 0.1888 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4162 1.6179 -0.0028 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6395 -0.3839 0.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2262 -1.2713 1.3526 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3705 0.5433 1.5581 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5632 -0.7271 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1232 0.9361 -0.7793 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6415 -1.5787 -0.5357 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7324 -0.2721 -1.7326 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 0.0802 1.2657 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4635 -0.1405 0.1004 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1015 1.8670 -0.6860 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 1 6 1 0 1 7 1 0 1 8 1 0 2 9 1 0 2 10 1 0 3 11 1 0 3 12 1 0 4 13 1 0 4 14 1 0 5 15 1 0 M END