HMDB0039459 RDKit 3D Di-2-propenyl pentasulfide 21 20 0 0 0 0 0 0 0 0999 V2000 -4.5191 1.2261 -0.5018 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2359 0.0086 -0.9634 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6096 -1.1932 -0.1666 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1307 -2.1665 0.2546 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8648 -1.0632 1.5831 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.4631 0.1013 0.4647 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2817 -1.0906 0.1555 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5986 -0.7428 1.7877 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6786 0.6503 1.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5645 0.2656 0.2072 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8652 0.3030 0.3814 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0106 1.4069 0.4284 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2421 2.1001 -1.0921 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7417 -0.1151 -1.9031 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1227 -0.8747 0.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2425 -1.8571 -0.7984 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0227 1.4807 1.0067 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2735 0.9604 2.2257 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0969 -0.0330 -0.7246 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2813 0.6051 1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5199 0.0280 -0.4255 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 2 3 1 12 1 0 1 13 1 0 2 14 1 0 3 15 1 0 3 16 1 0 9 17 1 0 9 18 1 0 10 19 1 0 11 20 1 0 11 21 1 0 M END