HMDB0038198 RDKit 3D 3,7-Bisaboladiene-2,8-dione 39 39 0 0 0 0 0 0 0 0999 V2000 5.3795 1.0739 0.7537 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0329 0.4380 0.5849 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7187 0.0040 -0.6058 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4182 -0.6412 -0.8938 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3483 -0.2315 0.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1407 -0.9614 -0.1284 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1963 -2.4714 -0.2375 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0346 -0.4251 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3167 0.9961 -0.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 1.9044 -0.0175 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7183 1.4983 -0.4462 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7503 0.4305 -0.4803 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1090 1.1040 -0.7171 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8191 -0.3786 0.7942 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9764 -0.6430 1.5018 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1059 0.3054 1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2952 0.9692 2.7332 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4279 1.5901 1.7123 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 1.8022 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1672 0.2842 0.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4017 0.0917 -1.4686 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5861 -1.7380 -0.8512 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0439 -0.2817 -1.8575 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3459 0.8496 0.1675 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3957 -2.7711 -1.2888 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7837 -2.9142 0.0332 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -2.8706 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9086 -1.0986 -0.5175 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7606 2.1296 -1.3462 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 2.1985 0.4177 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6005 -0.2674 -1.3199 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3474 1.1671 -1.7941 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0415 2.1716 -0.3684 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8664 0.6204 -0.1016 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9362 -0.2048 1.4484 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0101 -1.4327 0.5559 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7394 -0.0535 1.3697 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2397 -0.5900 2.3093 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4446 -1.6537 1.4057 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 1 0 5 6 1 0 6 7 1 0 6 8 2 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 1 0 12 13 1 0 12 14 1 0 5 15 1 0 15 16 1 0 16 17 2 0 16 2 1 0 1 18 1 0 1 19 1 0 1 20 1 0 3 21 1 0 4 22 1 0 4 23 1 0 5 24 1 0 7 25 1 0 7 26 1 0 7 27 1 0 8 28 1 0 11 29 1 0 11 30 1 0 12 31 1 0 13 32 1 0 13 33 1 0 13 34 1 0 14 35 1 0 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 M END