HMDB0284688 RDKit 3D PE(DiMe(11,3)/TXB2) 138139 0 0 0 0 0 0 0 0999 V2000 -15.5358 5.6838 -0.4691 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.0768 5.3420 -0.1679 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.9644 3.9376 0.3768 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5199 3.6290 0.6701 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6259 3.7259 -0.5454 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2215 3.3624 -0.0645 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.3062 3.4216 -1.1033 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.3210 1.9548 0.4722 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0532 0.9371 -0.3302 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1577 -0.4732 0.2151 C 0 0 1 0 0 0 0 0 0 0 0 0 -11.4936 -0.7198 0.3135 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.9348 -2.0007 0.2571 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.7941 -2.7202 1.4316 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.3323 -2.8015 -0.8782 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8427 -2.7866 -0.6818 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.5666 -3.3571 0.5667 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3725 -1.3545 -0.7086 C 0 0 2 0 0 0 0 0 0 0 0 0 -7.9251 -1.3776 -0.2456 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2851 -0.0629 -0.2222 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2138 0.2069 -0.9467 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5154 -0.7172 -1.8552 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0829 -0.9619 -1.4483 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2635 0.3156 -1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8538 0.0060 -0.9913 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0928 0.9342 -0.6744 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3759 -1.2893 -0.9576 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0971 -1.7023 -0.5894 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6539 -2.3119 -1.7837 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9245 -2.7711 -1.4053 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9490 -2.0210 -0.8793 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7898 -0.7948 -0.7037 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2345 -2.6476 -0.5170 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3701 -2.3736 -1.4306 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7815 -0.9458 -1.5711 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2068 -0.3144 -0.2626 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3635 -1.1188 0.2978 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8052 -0.4958 1.5801 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3142 0.9056 1.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5360 0.9938 0.5354 C 0 0 0 0 0 0 0 0 0 0 0 0 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