HMDB0000448 RDKit 3D Adipic acid 20 19 0 0 0 0 0 0 0 0999 V2000 -3.0335 1.3275 0.5309 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0504 0.1883 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2656 -0.3841 -0.3318 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7636 -0.5141 -0.2519 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5946 0.3125 0.1969 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6835 -0.4262 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8712 0.3976 0.3746 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1484 -0.2869 0.1287 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1586 -1.4241 -0.3981 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3398 0.3241 0.4789 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9643 -0.4374 0.4122 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8112 -1.4952 0.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7172 -0.6935 -1.3545 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7363 0.5570 1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6307 1.2758 -0.3548 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7304 -0.6138 -1.1663 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6486 -1.3880 0.4856 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7749 0.6146 1.4555 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8220 1.3517 -0.2092 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3900 1.3144 0.7002 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 1 0 7 8 1 0 8 9 2 0 8 10 1 0 3 11 1 0 4 12 1 0 4 13 1 0 5 14 1 0 5 15 1 0 6 16 1 0 6 17 1 0 7 18 1 0 7 19 1 0 10 20 1 0 M END