HMDB0061611 RDKit 3D PS(MonoMe(11,5)/MonoMe(11,3)) 138139 0 0 0 0 0 0 0 0999 V2000 -0.6834 8.6228 -0.2734 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7327 9.2277 1.0959 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8582 8.2120 2.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1083 7.3812 2.0912 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1564 6.3986 3.2411 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9603 5.5132 3.1893 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2400 5.7649 3.8044 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0564 4.6985 3.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4700 4.5628 3.9715 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3351 3.8363 2.7135 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8261 2.5663 2.1634 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7524 2.6994 1.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1364 3.3991 -0.1856 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0799 2.6604 -0.6916 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6826 3.3478 -1.9012 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3206 3.4265 -3.0365 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8178 2.0761 -3.4502 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1971 1.1217 -3.9419 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5368 -0.1931 -4.2394 C 0 0 0 0 0 0 0 0 0 0 0 0 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