HMDB0031322 RDKit 3D 1-Butanethiol 15 14 0 0 0 0 0 0 0 0999 V2000 2.0191 -0.1889 -0.0954 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6338 0.2260 -0.5071 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4330 -0.6568 0.0737 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8235 -0.2412 -0.3388 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1798 1.4429 0.2022 S 0 0 0 0 0 0 0 0 0 0 0 0 2.2306 -1.2379 -0.3078 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7385 0.4484 -0.6521 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2042 0.0020 0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4915 1.2953 -0.2309 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6007 0.1952 -1.6158 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2683 -1.6806 -0.3431 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4217 -0.7043 1.1647 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5722 -0.9051 0.1393 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9776 -0.3683 -1.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2423 2.3733 -0.2462 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