HMDB0038625 RDKit 3D Medicanine 24 24 0 0 0 0 0 0 0 0999 V2000 -2.1450 1.6577 1.7623 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5217 1.3499 0.7197 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1529 2.3532 -0.1507 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2137 -0.0716 0.4749 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4698 -0.6933 -0.1685 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4763 -1.4648 -0.9401 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4527 -0.4169 -0.6763 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8186 -1.0534 -0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0135 -0.2125 -0.3096 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0619 0.7324 0.8358 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3236 1.3914 0.7738 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7365 3.1266 -0.4108 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9263 -0.6687 1.3783 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0634 -1.1878 0.6046 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9864 0.0530 -0.8018 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1714 -2.4023 -0.4407 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6892 -1.5680 -2.0204 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7766 -1.8200 0.3421 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9795 -1.6562 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2638 0.2817 -1.2881 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8917 -0.9200 -0.1709 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2903 1.5469 0.7658 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 0.2092 1.7978 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 1.4335 -0.1713 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 1 0 9 10 1 0 10 11 1 0 7 4 1 0 3 12 1 0 4 13 1 0 5 14 1 0 5 15 1 0 6 16 1 0 6 17 1 0 8 18 1 0 8 19 1 0 9 20 1 0 9 21 1 0 10 22 1 0 10 23 1 0 11 24 1 0 M END