HMDB0061618 RDKit 3D PS(MonoMe(13,5)/DiMe(9,3)) 141142 0 0 0 0 0 0 0 0999 V2000 16.9515 4.4215 1.7104 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2483 4.6655 0.2631 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2616 3.3975 -0.5557 C 0 0 0 0 0 0 0 0 0 0 0 0 15.9792 2.6528 -0.5323 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7829 3.4253 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6245 2.4605 -0.9247 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8347 2.3572 0.1963 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8704 1.3614 -0.0393 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8661 0.9558 0.9697 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1285 0.9147 -1.2981 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4525 -0.1174 -2.0843 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1888 0.2039 -2.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9875 0.5361 -1.9633 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5259 -0.5746 -1.0838 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2936 -0.2496 -0.2518 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0636 -1.4782 0.6051 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8994 -1.3819 1.4995 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5686 -1.2756 0.8235 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2662 -2.4581 -0.0385 C 0 0 0 0 0 0 0 0 0 0 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