HMDB0061584 RDKit 3D PS(DiMe(9,3)/MonoMe(11,3)) 129130 0 0 0 0 0 0 0 0999 V2000 -3.8179 -4.0725 3.8271 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0562 -4.7261 4.4105 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9948 -3.6561 4.9213 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4126 -2.7384 3.8281 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5129 -2.8689 2.9858 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5053 -1.7773 2.1198 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4755 -1.4650 1.0401 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4018 -1.0532 2.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9506 0.2358 1.8459 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2817 -0.0327 0.5449 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8291 1.1377 -0.1927 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8089 2.0741 0.2491 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 2.8984 1.4564 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6645 3.7902 1.5112 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4013 2.9788 1.6001 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3785 2.0950 2.8041 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0734 1.2955 2.8467 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0466 0.4031 4.0437 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1834 -0.3756 4.1279 C 0 0 0 0 0 0 0 0 0 0 0 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