HMDB0258870 RDKit 3D Tetrachlorobisphenol A 33 34 0 0 0 0 0 0 0 0999 V2000 -0.0548 -2.2385 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -1.2690 0.0499 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0564 -2.0555 1.3194 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1917 -0.3799 0.0053 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4437 0.3618 -1.1223 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5549 1.2099 -1.1957 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8813 2.1576 -2.6301 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -3.4064 1.3047 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5023 2.1208 -0.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1416 0.5566 0.9929 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1913 0.6389 2.3779 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.0403 -0.2868 1.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1977 -0.3950 -0.0245 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3826 0.4963 1.0266 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4645 1.3594 1.0687 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7361 2.4962 2.3704 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.3682 1.3216 0.0389 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4738 2.1344 -0.0153 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 0.4240 -1.0164 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3333 0.3703 -2.3394 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0947 -0.4261 -1.0376 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0255 -2.7464 -1.0804 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0397 -1.7272 -2.0876 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7307 -2.9945 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8631 -2.6357 1.5228 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9068 -2.7891 1.2032 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3396 -1.4160 2.1783 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7785 0.2927 -1.9658 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8033 2.7069 -0.9005 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8267 -0.8778 1.9508 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6969 0.5634 1.8609 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7269 2.8165 0.6685 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9837 -1.0946 -1.8559 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 6 8 2 0 8 9 1 0 8 10 1 0 10 11 1 0 10 12 2 0 2 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 15 17 2 0 17 18 1 0 17 19 1 0 19 20 1 0 19 21 2 0 12 4 1 0 21 13 1 0 1 22 1 0 1 23 1 0 1 24 1 0 3 25 1 0 3 26 1 0 3 27 1 0 5 28 1 0 9 29 1 0 12 30 1 0 14 31 1 0 18 32 1 0 21 33 1 0 M END