HMDB0285056 RDKit 3D PE(DiMe(9,3)/PGD1) 131132 0 0 0 0 0 0 0 0999 V2000 15.4948 3.1095 -0.2495 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5290 1.9345 -0.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1461 2.5146 -0.4652 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0752 1.4671 -0.6099 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0416 0.4953 0.5221 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9410 -0.5163 0.2920 C 0 0 2 0 0 0 0 0 0 0 0 0 11.1900 -1.1814 -0.8847 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5803 0.1424 0.3027 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0647 0.6443 1.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7613 1.2866 1.4630 C 0 0 1 0 0 0 0 0 0 0 0 0 7.8585 2.7303 1.8673 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8236 3.1698 2.9848 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0073 3.5059 0.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4649 2.6372 -0.5060 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4016 3.3172 -1.0961 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9754 1.3603 0.1999 C 0 0 2 0 0 0 0 0 0 0 0 0 5.5229 1.6371 0.5373 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 0.5957 1.3948 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8982 -0.7831 0.7746 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1310 -0.7144 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