HMDB0038926 RDKit 3D Samin 32 35 0 0 0 0 0 0 0 0999 V2000 -4.2482 1.4253 0.0841 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8487 0.0804 0.2424 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5145 -0.3873 -1.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3094 0.2311 -1.3268 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5391 0.3735 -0.0595 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5563 -0.7568 0.1524 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8014 -0.2564 -0.1343 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9873 0.8322 -0.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2652 1.2894 -1.2026 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3439 0.6619 -0.6378 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1751 -0.4347 0.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8970 -0.8832 0.4311 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4508 -0.8198 0.5825 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4132 -0.2134 -0.2812 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7021 0.9200 -0.7288 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7405 -1.1436 1.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1523 -1.2421 1.5447 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5767 0.0918 1.0249 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4498 1.9064 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6429 -0.5184 0.7149 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7563 -0.4871 -1.9913 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4266 1.1818 -1.8499 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1202 1.3760 0.1344 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8075 -1.6314 -0.4778 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1285 1.3491 -1.4235 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3485 2.1519 -1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7692 -1.7557 1.0887 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6837 -0.8548 -1.1287 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3044 0.1098 0.3224 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5268 -2.0155 0.8386 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5012 -1.4660 2.5562 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5535 0.8856 1.8059 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 5 6 1 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 6 16 1 0 16 17 1 0 17 18 1 0 18 2 1 0 18 5 1 0 12 7 1 0 15 10 1 0 1 19 1 0 2 20 1 0 4 21 1 0 4 22 1 0 5 23 1 0 6 24 1 0 8 25 1 0 9 26 1 0 12 27 1 0 14 28 1 0 14 29 1 0 17 30 1 0 17 31 1 0 18 32 1 0 M END