HMDB0035645 RDKit 3D Epoxyguaiene 40 42 0 0 0 0 0 0 0 0999 V2000 4.0277 -0.1050 -0.4685 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9682 -0.5912 0.1375 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0458 -1.9233 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6645 0.1253 0.2024 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7013 1.4820 -0.4462 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5130 2.2630 0.0861 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7836 1.8779 -0.5492 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7364 3.0547 -0.3856 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3946 0.6381 0.0491 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8713 0.4451 -0.1996 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0949 -1.0537 -0.1802 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7240 -1.6446 -0.3755 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5264 -2.8900 0.4372 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7543 -0.5595 0.0295 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6398 -0.7357 -0.4556 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9171 0.1093 1.2166 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9867 0.8550 -0.9524 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9417 -0.6668 -0.4826 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0803 -1.9846 1.2421 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9771 -2.7613 0.0923 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3058 -1.9730 1.6249 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4171 0.2754 1.2782 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7412 1.4510 -1.5373 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6017 2.0339 -0.0432 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4407 2.0325 1.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6982 3.3337 -0.0874 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6894 1.6864 -1.6471 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2566 2.9559 0.6111 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5125 3.0457 -1.1756 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1459 3.9699 -0.3528 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4994 0.8778 0.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1151 0.8942 -1.1861 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7875 -1.3485 -0.9918 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4560 -1.3790 0.8261 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5664 -1.8231 -1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4636 -3.0059 0.7735 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8792 -3.7639 -0.1282 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1459 -2.7850 1.3639 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9313 -1.8082 -0.2696 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6381 -0.6045 -1.5645 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 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 11 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 14 16 1 0 15 4 1 0 14 9 1 0 16 9 1 0 1 17 1 0 1 18 1 0 3 19 1 0 3 20 1 0 3 21 1 0 4 22 1 0 5 23 1 0 5 24 1 0 6 25 1 0 6 26 1 0 7 27 1 0 8 28 1 0 8 29 1 0 8 30 1 0 10 31 1 0 10 32 1 0 11 33 1 0 11 34 1 0 12 35 1 0 13 36 1 0 13 37 1 0 13 38 1 0 15 39 1 0 15 40 1 0 M END