HMDB0302260 RDKit 3D D-Selinene 39 40 0 0 0 0 0 0 0 0999 V2000 1.4240 2.7666 0.6903 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7694 1.3456 0.4723 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8279 0.4716 0.1734 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5757 0.9049 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5768 0.0561 -0.0813 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9595 0.5696 -0.1951 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5871 0.2283 -1.5388 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8259 0.0348 0.9381 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2421 -1.3869 -0.1107 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0675 -1.5595 -0.8586 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -0.9361 -0.0344 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2597 -1.7205 1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5035 -1.0861 -0.7336 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4229 0.0808 -0.6693 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1800 0.8935 0.5852 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3526 3.3481 0.9107 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9515 3.1997 -0.2266 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7747 2.9010 1.5888 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8089 1.9599 0.0768 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9960 1.6737 -0.1084 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2979 -0.6166 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1214 1.0941 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8232 -0.0881 -2.2843 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4094 0.3868 1.8881 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9064 -1.0703 0.9096 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8569 0.4304 0.7829 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1774 -1.7291 0.9383 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0161 -1.9957 -0.6048 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2877 -2.6115 -1.1009 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0173 -0.9861 -1.7927 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6032 -1.3188 2.0413 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2779 -1.7772 1.6874 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9678 -2.7616 1.0275 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0897 -1.9783 -0.3605 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2967 -1.3551 -1.8097 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1612 0.7630 -1.5256 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4779 -0.2434 -0.7453 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8785 1.7744 0.6087 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3879 0.3379 1.5121 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 6 8 1 0 5 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 2 1 0 11 3 1 0 1 16 1 0 1 17 1 0 1 18 1 0 4 19 1 0 6 20 1 0 7 21 1 0 7 22 1 0 7 23 1 0 8 24 1 0 8 25 1 0 8 26 1 0 9 27 1 0 9 28 1 0 10 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 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 M END