HMDB0251608 RDKit 3D Cedpht 43 44 0 0 0 0 0 0 0 0999 V2000 7.5970 -0.4641 -3.0155 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8647 0.4607 -2.7025 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7903 1.5888 -3.5441 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0213 0.5071 -1.4945 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0113 -0.6254 -1.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9853 -0.6557 -0.6427 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8595 0.1269 -0.9071 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 0.1011 0.0097 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8426 -0.6842 1.1419 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6259 -0.8349 1.9553 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5119 -0.5141 1.3175 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7992 -0.5185 1.7079 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9783 -0.5224 2.0655 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -0.5733 2.5896 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3531 -0.1959 1.9185 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3983 0.3427 0.5888 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4235 1.1566 0.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4936 1.6591 -1.2344 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5611 1.3580 -2.0482 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5691 0.5321 -1.5431 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4437 0.0812 -0.2942 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9705 -1.4225 1.3337 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 -1.4327 0.4735 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 2.3237 -3.2665 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4936 1.4793 -1.3702 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6842 0.2961 -0.6345 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5363 -0.4598 -2.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5878 -1.5961 -1.7874 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7896 0.7479 -1.7670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9466 0.7416 -0.1726 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6416 -1.1650 2.9442 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2787 -0.3078 0.2111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2476 -0.2180 0.3902 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4949 -1.3202 3.1789 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5250 -0.9243 3.6524 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3353 -0.2611 2.4096 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5855 1.4721 0.6964 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6736 2.3107 -1.5793 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6195 1.7745 -3.0665 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3925 0.3086 -2.1956 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2154 -0.5705 0.1429 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -2.0405 2.2303 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9211 -2.0621 0.6858 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 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 3 11 12 1 0 12 13 2 3 13 14 1 0 14 15 2 3 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 9 22 1 0 22 23 2 0 23 6 1 0 21 16 1 0 3 24 1 0 4 25 1 0 4 26 1 0 5 27 1 0 5 28 1 0 7 29 1 0 8 30 1 0 10 31 1 0 11 32 1 0 12 33 1 0 13 34 1 0 14 35 1 0 15 36 1 0 17 37 1 0 18 38 1 0 19 39 1 0 20 40 1 0 21 41 1 0 22 42 1 0 23 43 1 0 M END