HMDB0259082 RDKit 3D Ticrynafen 28 29 0 0 0 0 0 0 0 0999 V2000 4.8885 2.5358 0.1463 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0705 1.3381 0.4852 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3267 0.9799 0.9281 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9747 0.3229 0.4176 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8243 0.9798 -0.0641 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6149 0.3843 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4308 -0.9481 -0.0045 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1836 -1.5276 -0.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8836 -0.8204 -0.6894 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1952 -1.3804 -0.9262 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3448 -2.3493 -1.7007 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4194 -0.8541 -0.2805 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5055 -0.1829 0.9118 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7291 0.2091 1.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7806 -0.0957 0.4921 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0401 -0.9149 -0.8029 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6753 0.5300 -0.9486 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9724 1.5248 -1.5531 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.5475 1.1314 -0.7442 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7598 2.8290 -1.0849 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.8196 0.1467 0.7159 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8206 -0.1265 1.4278 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3114 -0.5034 -0.2452 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2420 -1.5593 0.3698 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0599 -2.5777 -0.0089 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5809 0.0122 1.5023 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9064 0.7608 2.2653 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8417 0.1554 0.6743 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 1 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 10 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 9 17 1 0 17 18 1 0 17 19 2 0 19 20 1 0 19 6 1 0 16 12 1 0 3 21 1 0 4 22 1 0 4 23 1 0 7 24 1 0 8 25 1 0 13 26 1 0 14 27 1 0 15 28 1 0 M END