HMDB0062590 RDKit 3D Tropate 22 22 0 0 0 0 0 0 0 0999 V2000 -0.6152 -1.9106 1.4490 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4997 -1.4405 0.6955 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7953 -1.8860 0.9225 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1281 -0.4835 -0.3428 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9103 0.8071 -0.2843 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7554 1.4889 0.9084 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3124 -0.2251 -0.3172 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8705 0.3329 0.8119 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 0.6029 0.9079 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0566 0.3246 -0.1314 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5173 -0.2318 -1.2646 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1681 -0.5044 -1.3615 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5904 -1.2815 1.0183 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3582 -0.9521 -1.3311 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5362 1.4640 -1.0993 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9814 0.6620 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8265 2.4543 0.7276 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2521 0.5766 1.6706 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6004 1.0387 1.8077 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1039 0.5588 -0.0009 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1874 -0.4510 -2.0837 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7212 -0.9443 -2.2486 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 4 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 7 1 0 3 13 1 0 4 14 1 0 5 15 1 0 5 16 1 0 6 17 1 0 8 18 1 0 9 19 1 0 10 20 1 0 11 21 1 0 12 22 1 0 M END