HMDB0113776 RDKit 3D PE-NMe(11M3/11M3) 132133 0 0 0 0 0 0 0 0999 V2000 -5.6153 -7.7581 4.3352 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1726 -7.5474 4.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6587 -6.2035 4.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3999 -5.0884 3.8371 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 -3.7592 4.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9933 -3.0032 3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0981 -1.5028 3.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7729 -3.9077 2.6246 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8282 -3.5429 1.6822 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4682 -3.3624 0.2879 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4778 -2.4366 -0.2306 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0399 -2.5885 0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5488 -3.9511 -0.4207 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0683 -4.0751 -0.1339 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6157 -5.4320 -0.6276 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1224 -5.6250 -0.4108 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -4.5611 -1.1664 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3699 -4.6361 -2.6520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0969 -3.5490 -3.3788 C 0 0 0 0 0 0 0 0 0 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