HMDB0256580 RDKit 3D Piperoxan 36 38 0 0 0 0 0 0 0 0999 V2000 5.4749 0.2065 0.4231 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1020 -0.6607 -0.5844 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7663 -0.8436 -0.8843 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7566 -0.1847 -0.2105 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1384 0.6884 0.8026 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4660 0.8632 1.0947 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1016 1.3468 1.4696 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9351 1.6003 0.6774 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4091 0.2539 0.2586 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8923 0.4279 -0.4578 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5141 -0.8047 -0.8773 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9943 -1.5847 0.2445 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8768 -0.7487 1.1551 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9903 -0.0751 0.4154 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6076 0.4701 -0.9317 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6949 -0.4657 -1.6558 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4067 -0.3820 -0.5276 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5281 0.3340 0.6433 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8904 -1.1866 -1.1247 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4941 -1.5292 -1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7359 1.5549 1.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2055 2.1794 1.2765 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1938 2.2176 -0.2052 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3216 -0.3397 1.1917 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5308 1.0801 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6631 0.9970 -1.3985 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2276 -2.0665 0.8428 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6419 -2.3772 -0.1815 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2608 -0.0254 1.7457 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3189 -1.4453 1.8939 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3677 0.7524 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8616 -0.7607 0.2927 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2389 1.5071 -0.8904 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5611 0.5265 -1.5367 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2617 -1.4420 -1.7579 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4219 -0.0835 -2.6394 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 5 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 9 17 1 0 6 1 1 0 16 11 1 0 17 4 1 0 1 18 1 0 2 19 1 0 3 20 1 0 6 21 1 0 8 22 1 0 8 23 1 0 9 24 1 0 10 25 1 0 10 26 1 0 12 27 1 0 12 28 1 0 13 29 1 0 13 30 1 0 14 31 1 0 14 32 1 0 15 33 1 0 15 34 1 0 16 35 1 0 16 36 1 0 M END