HMDB0033341 RDKit 3D Mollicellin C 50 52 0 0 0 0 0 0 0 0999 V2000 -3.3716 -2.3691 -2.9033 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1073 -1.0634 -2.4287 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9434 -0.8771 -1.6764 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7468 -0.5488 -2.2647 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6542 -0.3897 -3.6401 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4024 -0.3658 -1.5147 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3894 -0.5103 -0.1183 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8029 -0.8376 0.4819 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9167 -0.9920 1.9519 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9488 -1.0154 -0.3103 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1731 -1.3809 0.3707 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3514 -2.6419 0.5140 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1692 -0.4856 0.8815 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1981 0.8203 0.8458 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3883 1.4937 1.4723 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1923 1.6949 0.2557 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4452 -0.3668 0.7775 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7449 0.0732 0.5433 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5880 -0.0296 1.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1422 -0.5746 2.8918 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9792 -0.9709 3.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9137 0.3788 1.5255 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7349 0.2618 2.6365 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3981 0.8854 0.3569 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5820 1.0118 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0693 1.5391 -2.0458 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2772 0.5997 -0.6479 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5652 0.7751 -1.9065 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9668 1.7053 -2.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4930 -0.0347 -2.3294 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9299 -2.5498 -3.9015 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4741 -2.5563 -2.9079 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9531 -3.0839 -2.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4908 -0.5226 -4.1903 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 -0.0988 2.4395 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0139 -0.9514 2.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4458 -1.8854 2.3544 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0319 -0.9917 1.3745 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6315 0.9282 2.4064 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2229 2.5569 1.6508 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2561 1.3279 0.7911 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2162 1.5303 -0.8623 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1838 1.6279 0.6866 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5524 2.7706 0.3338 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8297 -0.6568 3.7441 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6996 0.5562 2.5731 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4267 1.2099 0.2564 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9768 2.6209 -2.2263 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2126 1.5069 -1.9159 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0156 0.8762 -2.9305 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 4 6 1 0 6 7 2 0 7 8 1 0 8 9 1 0 8 10 2 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 2 3 14 15 1 0 14 16 1 0 7 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 19 22 1 0 22 23 1 0 22 24 2 0 24 25 1 0 25 26 1 0 25 27 2 0 27 28 1 0 28 29 2 0 28 30 1 0 10 3 1 0 27 18 1 0 30 6 1 0 1 31 1 0 1 32 1 0 1 33 1 0 5 34 1 0 9 35 1 0 9 36 1 0 9 37 1 0 13 38 1 0 15 39 1 0 15 40 1 0 15 41 1 0 16 42 1 0 16 43 1 0 16 44 1 0 20 45 1 0 23 46 1 0 24 47 1 0 26 48 1 0 26 49 1 0 26 50 1 0 M END