HMDB0249252 RDKit 3D Bis(4-chlorophenyl)acetic acid 28 29 0 0 0 0 0 0 0 0999 V2000 -0.1458 -0.9314 3.3549 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0723 -0.1600 2.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0396 1.1871 2.5813 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0250 -0.7225 0.9995 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2340 -0.2871 0.2937 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0538 -1.2513 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1907 -0.8900 -0.9535 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5526 0.4353 -1.0364 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0262 0.9019 -1.8807 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.7568 1.3914 -0.4562 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 1.0162 0.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2203 -0.3980 0.1919 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7997 0.8369 0.2043 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9278 1.1551 -0.5503 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4554 0.1506 -1.3339 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8877 0.4596 -2.3275 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.8960 -1.1108 -1.3718 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7813 -1.3901 -0.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2934 1.6434 3.4419 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0185 -1.8580 1.0604 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7526 -2.2839 -0.2258 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8009 -1.6691 -1.4032 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0293 2.4489 -0.5125 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9916 1.8119 0.6486 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3933 1.6119 0.8035 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3559 2.1464 -0.5116 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3621 -1.8607 -2.0128 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3473 -2.3837 -0.6480 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 2 0 6 7 1 0 7 8 2 0 8 9 1 0 8 10 1 0 10 11 2 0 4 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 15 17 1 0 17 18 2 0 11 5 1 0 18 12 1 0 3 19 1 0 4 20 1 0 6 21 1 0 7 22 1 0 10 23 1 0 11 24 1 0 13 25 1 0 14 26 1 0 17 27 1 0 18 28 1 0 M END