HMDB0014797 RDKit 3D Acamprosate 22 21 0 0 0 0 0 0 0 0999 V2000 -3.4410 0.0675 0.5244 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6964 0.6204 -1.0701 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6807 0.7044 -1.4575 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 0.5073 -0.5479 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7996 0.1064 0.6509 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6949 0.2063 0.6869 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4029 -0.6108 -0.3717 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1415 -0.3024 -0.1256 S 0 0 0 0 0 6 0 0 0 0 0 0 3.4779 -0.8023 1.2394 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3406 1.1902 -0.2380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1167 -1.1236 -1.2056 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4412 0.1169 0.1645 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9489 -0.8579 0.4628 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0843 0.8818 1.0711 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6302 0.8461 -1.2953 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1069 -0.9033 1.0218 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1318 0.8027 1.4806 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0812 -0.2201 1.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0192 1.2651 0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1013 -0.3304 -1.3961 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2137 -1.6889 -0.2828 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7410 -0.5334 -1.6409 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 2 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 2 0 8 11 1 0 1 12 1 0 1 13 1 0 1 14 1 0 4 15 1 0 5 16 1 0 5 17 1 0 6 18 1 0 6 19 1 0 7 20 1 0 7 21 1 0 11 22 1 0 M END