HMDB0031792 RDKit 3D Folpet 20 21 0 0 0 0 0 0 0 0999 V2000 0.7836 -1.9878 1.3531 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 -1.1323 0.4768 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8627 -0.4374 0.5002 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9709 -0.4641 1.3363 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0570 0.3353 1.0703 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1202 1.1866 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0302 1.2175 -0.8453 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9156 0.4138 -0.5886 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3421 0.2676 -1.3233 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 0.8905 -2.3731 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1601 -0.6994 -0.6413 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7645 -1.2064 -1.1683 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0741 -0.4870 -0.1834 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1126 1.2716 -0.4676 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.9096 -0.7791 1.5521 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.6300 -1.2074 -0.7027 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -1.1439 2.1803 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9076 0.2923 1.7448 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0079 1.8047 -0.1992 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0456 1.8649 -1.7098 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 13 16 1 0 11 2 1 0 8 3 1 0 4 17 1 0 5 18 1 0 6 19 1 0 7 20 1 0 M END