HMDB0032457 RDKit 3D 1-Pentanethiol 18 17 0 0 0 0 0 0 0 0999 V2000 -2.5917 -0.3776 -0.1112 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1355 -0.5068 -0.4895 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3926 0.7040 -0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0644 0.6726 -0.3288 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7891 -0.5015 0.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5398 -0.4289 -0.1975 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0345 -1.3867 -0.0325 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1798 0.1923 -0.8701 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7327 0.1734 0.8445 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -1.4578 -0.1037 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0748 -0.5009 -1.6023 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8129 1.5789 -0.5781 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6105 0.9240 1.0573 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5123 1.6281 0.0195 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1586 0.6791 -1.4341 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3787 -1.4360 -0.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6664 -0.5983 1.3441 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1957 0.6421 0.4007 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 5 6 1 0 1 7 1 0 1 8 1 0 1 9 1 0 2 10 1 0 2 11 1 0 3 12 1 0 3 13 1 0 4 14 1 0 4 15 1 0 5 16 1 0 5 17 1 0 6 18 1 0 M END