HMDB0061554 RDKit 3D PS(DiMe(11,3)/DiMe(13,5)) 150151 0 0 0 0 0 0 0 0999 V2000 -4.4507 3.1543 -8.5608 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9717 4.4249 -7.9966 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0814 5.1027 -7.0042 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7755 4.3913 -5.7409 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0944 3.0620 -5.8674 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8289 2.6055 -4.4467 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6516 2.6352 -3.8895 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6909 2.1798 -2.6426 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4992 2.0798 -1.7256 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0699 0.6216 -1.6215 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2505 0.0447 -2.9583 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6696 -1.3986 -2.7870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9695 -2.0778 -4.0634 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0276 -2.1511 -5.1291 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2729 -2.9084 -4.8941 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1489 -2.4931 -3.7563 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4313 -3.3413 -3.7857 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3267 -2.9956 -2.6021 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6475 -3.2980 -1.3034 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5432 -2.9838 -0.0973 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7798 -3.3629 1.1348 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7405 -4.5992 1.4286 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1093 -2.4949 1.9736 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3863 -2.9925 3.1012 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9175 -2.6976 2.9699 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6208 -1.3308 3.0051 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6847 -0.8573 2.7961 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5338 -1.7450 2.5502 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0494 0.5493 2.8572 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3776 0.9442 2.3684 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5758 0.2934 2.9621 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8664 0.8897 2.3607 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9049 0.7773 0.8805 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8499 -0.5722 0.2854 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0430 -1.4595 0.6686 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8721 -2.7814 -0.0007 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9001 -3.7931 0.1248 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3235 -4.4749 1.3395 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8430 -3.6929 2.4618 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1280 -3.3539 2.5954 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