HMDB0034943 RDKit 3D Sesquisabinene 39 40 0 0 0 0 0 0 0 0999 V2000 -2.4123 2.6319 -1.5812 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1107 1.6777 -0.7257 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9047 1.8219 0.7313 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7754 0.4165 1.2686 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7100 -0.5285 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -1.7867 0.1625 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4472 -2.6513 1.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5493 -1.6231 0.3506 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1849 -0.8055 -0.7616 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6417 -0.7250 -0.4458 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2658 0.4231 -0.2495 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4750 1.6730 -0.3502 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7122 0.4581 0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0128 -0.6574 -0.6782 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9248 0.2590 -1.1085 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5508 2.4604 -2.6427 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5311 3.6454 -1.2196 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7241 2.3922 1.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9535 2.3897 0.8668 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8920 0.3862 1.9098 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7115 0.2297 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0835 -2.3453 -0.7827 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2657 -3.3323 0.9551 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8078 -2.0006 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6269 -3.2587 1.7180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0085 -2.6333 0.2799 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8335 -1.2348 1.3443 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0762 -1.3842 -1.6838 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7095 0.1832 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2301 -1.6321 -0.3696 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1477 2.5450 -0.2143 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9244 1.7591 -1.3134 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7593 1.6688 0.5157 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9277 0.1365 1.1185 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 1.4452 -0.0659 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2070 -0.2706 -0.6395 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1635 -1.5423 -1.3037 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9273 -0.2644 -0.1922 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3536 0.0734 -2.0318 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 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 3 11 12 1 0 11 13 1 0 5 14 1 0 14 15 1 0 15 2 1 0 15 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 0 7 23 1 0 7 24 1 0 7 25 1 0 8 26 1 0 8 27 1 0 9 28 1 0 9 29 1 0 10 30 1 0 12 31 1 0 12 32 1 0 12 33 1 0 13 34 1 0 13 35 1 0 13 36 1 0 14 37 1 0 14 38 1 0 15 39 1 0 M END