HMDB0034453 RDKit 3D 4-[2,2'-Bithiophen-5-yl]-3-butyn-1-ol 25 26 0 0 0 0 0 0 0 0999 V2000 5.2761 1.1607 -0.4047 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3748 -0.0381 0.2627 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5073 -1.1154 -0.3979 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1006 -0.7133 -0.3983 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9206 -0.3925 -0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5372 0.0072 -0.3884 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0551 1.1364 -0.8801 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3846 1.2511 -0.7423 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0343 0.2184 -0.1162 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4901 0.1144 0.1525 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 -0.9191 0.7782 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4630 -0.8112 0.9193 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0615 0.3175 0.4288 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7491 1.1943 -0.2152 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.7743 -0.8644 0.2529 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8587 1.8758 0.1321 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3858 -0.3939 0.4527 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8991 0.1174 1.2755 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5689 -2.0658 0.1668 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 -1.3074 -1.4227 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5824 1.9103 -1.3715 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9413 2.1457 -1.1189 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5719 -1.8103 1.1521 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0997 -1.5865 1.4113 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1375 0.5686 0.4592 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 3 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 9 15 1 0 15 6 1 0 14 10 1 0 1 16 1 0 2 17 1 0 2 18 1 0 3 19 1 0 3 20 1 0 7 21 1 0 8 22 1 0 11 23 1 0 12 24 1 0 13 25 1 0 M END