HMDB0036106 RDKit 3D Thiogeraniol 29 28 0 0 0 0 0 0 0 0999 V2000 -3.6058 1.6171 0.2076 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5903 0.5992 -0.1826 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -0.8220 -0.3497 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3495 1.0214 -0.3716 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3153 0.0285 -0.7615 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7462 0.0802 0.3623 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7677 -0.8840 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2474 -2.3214 -0.1211 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0326 -0.6443 -0.2227 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7876 0.5999 -0.1828 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9649 2.1178 0.2068 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6194 1.1772 0.2717 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2849 2.0092 1.2041 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5307 2.4438 -0.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3643 -1.5030 0.2885 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7640 -1.1153 -1.4179 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0309 -1.0041 -0.1443 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0455 2.0531 -0.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7376 -0.9893 -0.8302 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1699 0.2942 -1.7398 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9752 1.0901 0.5941 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1534 -0.3239 1.2632 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1038 -3.0200 -0.0644 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6882 -2.4276 -1.0648 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -2.4707 0.7418 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6114 -1.5811 -0.4901 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2245 0.7319 -1.2358 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7447 0.4788 0.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4088 2.7645 -0.9175 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 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 1 0 1 12 1 0 1 13 1 0 1 14 1 0 3 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 5 19 1 0 5 20 1 0 6 21 1 0 6 22 1 0 8 23 1 0 8 24 1 0 8 25 1 0 9 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 M END