HMDB0061853 RDKit 3D beta-Cubebene 39 41 0 0 0 0 0 0 0 0999 V2000 2.1261 2.8671 -0.7281 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9766 1.6982 -0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7028 1.2576 1.0681 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7409 0.3143 1.7103 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9318 -0.3139 0.5906 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0765 0.6295 -0.5939 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.2336 0.3864 0.1320 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2497 -0.3736 -0.6439 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.6119 0.2825 -0.4004 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9792 0.2596 1.0651 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6907 1.6509 -0.9926 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3716 -1.8146 -0.2753 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1224 -2.5317 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0973 -1.7443 0.2626 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0765 -1.8420 -0.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8152 3.5861 -0.3221 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5691 3.1291 -1.6115 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9630 2.1192 1.7169 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6849 0.7762 0.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0587 0.9158 2.3648 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2899 -0.4549 2.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2026 0.2006 -1.6025 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5633 1.2873 0.7208 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0663 -0.2704 -1.7344 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3563 -0.3639 -0.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2024 1.2777 1.4567 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8816 -0.3627 1.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1666 -0.1430 1.7056 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1164 2.3295 -0.2022 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7313 2.0546 -1.3419 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4288 1.7039 -1.8309 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9521 -2.3047 -1.1006 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0743 -1.8644 0.6094 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0919 -3.2255 -0.8591 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3119 -3.2472 0.8645 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6719 -2.2073 1.1215 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8437 -1.0504 -0.8056 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5732 -1.8039 -1.8791 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6177 -2.8077 -0.8369 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 5 4 1 1 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 8 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 6 2 1 0 7 5 1 0 14 5 1 0 1 16 1 0 1 17 1 0 3 18 1 0 3 19 1 0 4 20 1 0 4 21 1 0 6 22 1 6 7 23 1 1 8 24 1 6 9 25 1 0 10 26 1 0 10 27 1 0 10 28 1 0 11 29 1 0 11 30 1 0 11 31 1 0 12 32 1 0 12 33 1 0 13 34 1 0 13 35 1 0 14 36 1 1 15 37 1 0 15 38 1 0 15 39 1 0 M END