HMDB0254499 RDKit 3D METALDEHYDE 28 28 0 0 0 0 0 0 0 0999 V2000 -0.2065 2.7636 -0.7599 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 1.6064 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9722 0.7471 -0.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -0.2344 -0.2114 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8547 0.2253 0.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8814 -1.1426 0.4623 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0045 -1.5511 -0.5633 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6217 -2.8410 -0.1353 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8889 -0.5250 -0.7514 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2582 -0.0115 0.4673 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7785 0.1691 0.4326 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6413 1.1293 0.8514 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1945 3.7111 -0.2114 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2272 2.5030 -1.1138 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4337 2.9156 -1.6649 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1297 2.0854 0.7329 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1785 -0.8373 -1.0434 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3383 -0.6896 1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5447 0.8373 1.5075 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6241 0.6908 0.0102 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5453 -1.7242 -1.5026 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1681 -2.7814 0.8223 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2258 -3.2569 -0.9664 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2128 -3.5672 0.0375 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0745 -0.7908 1.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1335 0.8843 1.1731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2510 -0.8132 0.6733 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1293 0.4979 -0.5583 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 4 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 12 2 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 4 17 1 0 5 18 1 0 5 19 1 0 5 20 1 0 7 21 1 0 8 22 1 0 8 23 1 0 8 24 1 0 10 25 1 0 11 26 1 0 11 27 1 0 11 28 1 0 M END