HMDB0033229 RDKit 3D Absindiol 41 43 0 0 0 0 0 0 0 0999 V2000 1.5794 2.3640 -1.8909 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7402 1.4368 -0.9679 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8753 1.3799 -0.0174 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2212 2.6169 0.4975 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2851 0.4726 1.0713 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5805 -0.5390 0.2312 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7429 -1.5086 0.9895 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6676 -2.6593 1.4098 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3309 -2.1231 0.1285 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6442 -1.3930 0.2375 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6404 -2.2341 -0.2635 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5783 -0.1882 -0.6573 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8574 0.6157 -0.6599 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 0.6149 0.6556 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3177 1.9983 -0.9183 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0606 2.9475 -1.2535 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9412 1.9893 -0.7210 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 0.7715 -0.1632 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8016 0.3066 -0.7442 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7332 2.3802 -2.5771 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3201 3.1526 -1.9789 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6960 0.8342 -0.4831 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0596 2.9326 0.0695 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 1.0856 1.6941 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0794 0.0467 1.7069 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3508 -1.0814 -0.3608 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3436 -1.0983 1.9442 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1278 -3.4465 1.9393 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1442 -3.0272 0.4559 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4934 -2.2482 2.0103 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0116 -2.1122 -0.9292 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5090 -3.1716 0.4473 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8838 -1.1250 1.2793 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5407 -2.2499 -1.2497 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3380 -0.5069 -1.6759 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5485 0.2968 -1.4665 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8592 0.6581 1.5046 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1698 1.5645 0.7113 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2783 -0.2056 0.7127 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5353 0.7576 0.9376 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6438 -0.3049 -1.6556 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 3 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 7 9 1 0 9 10 1 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 2 0 15 17 1 0 17 18 1 0 18 19 1 0 19 2 1 0 19 6 1 0 18 12 1 0 1 20 1 0 1 21 1 0 3 22 1 0 4 23 1 0 5 24 1 0 5 25 1 0 6 26 1 0 7 27 1 0 8 28 1 0 8 29 1 0 8 30 1 0 9 31 1 0 9 32 1 0 10 33 1 0 11 34 1 0 12 35 1 0 13 36 1 0 14 37 1 0 14 38 1 0 14 39 1 0 18 40 1 0 19 41 1 0 M END