HMDB0014613 RDKit 3D Tetrahydrocannabinol 53 55 0 0 0 0 0 0 0 0999 V2000 6.7328 -0.9095 -0.5882 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3359 -1.2149 -1.0896 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2853 -0.6812 -0.1458 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3896 0.8183 0.0152 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3204 1.2928 0.9643 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9623 0.9905 0.5078 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2192 1.8454 -0.2787 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0784 1.4917 -0.6814 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7700 2.3972 -1.4693 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6049 0.2972 -0.2927 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1279 -0.5816 0.5024 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3856 -0.2104 0.8777 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4857 -1.7934 0.8632 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8802 -1.8426 1.1514 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4539 -3.0408 0.4521 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0040 -1.9613 2.6591 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5753 -0.5866 0.6796 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.0555 -0.6944 0.6798 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7488 0.4525 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0172 0.9664 -1.1692 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8199 1.8902 -2.0614 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7706 0.6815 -1.4708 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9542 -0.2007 -0.6450 C 0 0 1 0 0 0 0 0 0 0 0 0 7.4755 -1.3115 -1.2992 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9243 -1.4122 0.3824 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9005 0.1770 -0.5275 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2006 -2.3171 -1.1246 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2229 -0.8498 -2.1175 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4056 -1.2123 0.8225 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2909 -0.9351 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3477 1.2759 -0.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3716 1.0789 0.4777 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4287 2.3760 1.1934 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4904 0.7667 1.9285 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6234 2.8020 -0.5983 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3853 3.2611 -1.7486 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9707 -0.8978 1.5047 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6739 -3.8397 0.2839 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8643 -2.8292 -0.5556 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3005 -3.4878 1.0427 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9506 -1.5341 3.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1730 -1.3880 3.0996 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9544 -3.0320 2.9013 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2617 0.2170 1.4116 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3478 -1.6247 0.1511 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3980 -0.8022 1.7287 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7786 0.1903 -0.3054 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8370 1.2810 0.7398 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 1.9265 -3.0773 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8580 1.4996 -2.1883 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8624 2.8757 -1.5721 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3652 1.1126 -2.3721 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7984 -1.2088 -1.1714 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 8 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 14 16 1 0 14 17 1 0 17 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 2 0 22 23 1 0 12 6 1 0 23 17 1 0 23 10 1 0 1 24 1 0 1 25 1 0 1 26 1 0 2 27 1 0 2 28 1 0 3 29 1 0 3 30 1 0 4 31 1 0 4 32 1 0 5 33 1 0 5 34 1 0 7 35 1 0 9 36 1 0 12 37 1 0 15 38 1 0 15 39 1 0 15 40 1 0 16 41 1 0 16 42 1 0 16 43 1 0 17 44 1 1 18 45 1 0 18 46 1 0 19 47 1 0 19 48 1 0 21 49 1 0 21 50 1 0 21 51 1 0 22 52 1 0 23 53 1 6 M END