HMDB0029504 RDKit 3D Marindinin 33 34 0 0 0 0 0 0 0 0999 V2000 4.6053 1.7658 -0.7807 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3253 1.2720 -1.0202 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6376 0.4631 -0.0999 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3108 0.0755 0.9583 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6788 -0.7533 1.9454 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3775 -1.0951 2.9438 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3719 -1.1377 1.7782 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5273 -0.6009 0.7632 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2897 -1.7664 0.2817 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2857 -1.4908 -0.7735 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3561 -0.5345 -0.4197 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3530 0.8139 -0.6687 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3934 1.6474 -0.2919 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4879 1.1323 0.3593 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5147 -0.2011 0.6170 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4928 -1.0151 0.2463 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2501 0.0918 -0.3364 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3770 0.9796 -0.6225 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6287 2.4002 0.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9390 2.3714 -1.6282 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3636 0.4097 1.0518 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1834 0.0859 1.3092 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4387 -2.5151 -0.1355 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7401 -2.2534 1.1746 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7326 -1.1498 -1.6883 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7234 -2.4888 -1.0858 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5202 1.2344 -1.1814 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3839 2.7086 -0.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3276 1.7590 0.6718 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3841 -0.6065 1.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5225 -2.0886 0.4579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1585 -0.5694 -1.2495 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7011 1.0561 -0.5247 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 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 8 17 1 0 17 3 1 0 16 11 1 0 1 18 1 0 1 19 1 0 1 20 1 0 4 21 1 0 8 22 1 0 9 23 1 0 9 24 1 0 10 25 1 0 10 26 1 0 12 27 1 0 13 28 1 0 14 29 1 0 15 30 1 0 16 31 1 0 17 32 1 0 17 33 1 0 M END