HMDB0303888 RDKit 3D (E)-p-mentha-6,8-dien-2-hydroperoxide 28 28 0 0 0 0 0 0 0 0999 V2000 -2.9918 -0.1727 -1.5131 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2448 0.0594 -0.4452 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8672 0.6011 0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7842 -0.2313 -0.4927 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4213 -1.3213 0.5075 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0184 -1.7089 0.2026 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8798 -0.4845 0.3152 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3035 -0.6667 0.6693 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4193 0.7192 0.1134 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2872 1.7978 0.2387 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0397 2.9910 -0.3115 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0223 1.0044 -0.2422 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0495 0.0416 -1.4678 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6016 -0.5704 -2.4433 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0597 -0.1929 1.5441 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2594 1.3746 1.2851 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8511 1.0780 0.5642 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5151 -0.6327 -1.4911 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4889 -0.9608 1.5394 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0671 -2.1934 0.2856 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3578 -2.4973 0.9071 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1282 -2.0743 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5783 -1.7226 0.8002 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9858 -0.2639 -0.1347 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 -0.1377 1.5989 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9407 2.8795 -1.3036 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3939 1.6779 0.5177 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 1.6067 -1.1955 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 2 0 9 10 1 0 10 11 1 0 9 12 1 0 12 4 1 0 1 13 1 0 1 14 1 0 3 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 5 19 1 0 5 20 1 0 6 21 1 0 6 22 1 0 8 23 1 0 8 24 1 0 8 25 1 0 11 26 1 0 12 27 1 0 12 28 1 0 M END