HMDB0033272 RDKit 3D Dihydroclusin 57 59 0 0 0 0 0 0 0 0999 V2000 -4.6381 3.5283 -0.8597 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1717 2.2857 -0.4319 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2728 1.3273 0.0135 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9059 1.5172 0.0614 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0650 0.5276 0.5136 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5722 0.7533 0.5571 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0437 0.2808 -0.7223 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5197 1.0188 -1.9049 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3284 2.3739 -1.8829 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5491 0.2278 -0.7271 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0921 -0.2319 -2.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4772 -0.2662 -2.0837 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0297 -0.6940 0.3642 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4889 -0.8486 0.4651 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1889 -1.8842 -0.1266 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5460 -1.9981 -0.0135 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2586 -1.0645 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6186 -0.0092 1.3202 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2524 0.0756 1.1865 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5987 0.7409 1.9558 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8834 0.2391 1.6267 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6314 -0.9830 0.9523 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5603 -0.6884 0.9346 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9127 -0.9028 0.8974 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4506 -2.0954 1.3058 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5927 -3.1175 1.7719 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7627 0.1107 0.4352 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1363 -0.1070 0.3974 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7916 -0.6513 -0.7352 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8548 3.2848 -1.6227 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1285 4.0065 -0.0052 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4304 4.1738 -1.3082 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5462 2.4868 -0.2762 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4721 1.8519 0.7058 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1593 0.2887 1.4551 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2981 -0.7913 -0.8493 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2107 0.5301 -2.8651 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6314 0.8374 -1.8888 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 2.6803 -2.2141 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9515 1.2425 -0.5337 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7946 0.4259 -2.8922 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7295 -1.2501 -2.3081 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8986 0.6246 -2.0256 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5673 -0.5138 1.3543 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6373 -1.7145 0.0606 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6475 -2.6344 -0.7007 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0684 -2.8356 -0.4981 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7401 0.9038 1.6664 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5055 0.1248 2.5202 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3973 0.9039 0.8848 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8992 -1.4806 1.2956 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8024 -3.3720 1.0363 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1882 -4.0156 2.0354 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0694 -2.6974 2.6730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9991 -1.0671 -1.4086 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3605 0.0844 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4164 -1.5429 -0.4515 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 7 10 1 0 10 11 1 0 11 12 1 0 10 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 18 20 1 0 20 21 1 0 21 22 1 0 5 23 2 0 23 24 1 0 24 25 1 0 25 26 1 0 24 27 2 0 27 28 1 0 28 29 1 0 27 3 1 0 19 14 1 0 22 17 1 0 1 30 1 0 1 31 1 0 1 32 1 0 4 33 1 0 6 34 1 0 6 35 1 0 7 36 1 0 8 37 1 0 8 38 1 0 9 39 1 0 10 40 1 0 11 41 1 0 11 42 1 0 12 43 1 0 13 44 1 0 13 45 1 0 15 46 1 0 16 47 1 0 19 48 1 0 21 49 1 0 21 50 1 0 23 51 1 0 26 52 1 0 26 53 1 0 26 54 1 0 29 55 1 0 29 56 1 0 29 57 1 0 M END