HMDB0033343 RDKit 3D Mollicellin D 49 51 0 0 0 0 0 0 0 0999 V2000 -6.0681 1.2416 0.7111 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9599 0.2727 0.4109 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3901 -0.4701 1.5918 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6032 0.1049 -0.7766 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6430 -0.6445 -1.5752 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3144 -0.9089 -1.0575 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7641 -2.0310 -0.5944 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4445 -3.2418 -0.5554 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4346 -2.1352 -0.1012 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3727 -1.0074 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1840 0.1703 -0.5633 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4676 0.2252 -1.0269 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0055 1.5659 -1.4607 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 1.4328 -0.6294 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7762 1.7614 -0.6301 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0231 2.8933 -1.0514 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8698 0.9116 -0.1814 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 1.6421 -0.2477 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1483 3.0059 -0.7476 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1705 0.9341 0.2152 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7242 1.7570 0.1696 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.1533 -0.3325 0.6915 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2840 -0.9910 1.1298 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9379 -1.0119 0.7329 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9501 -2.3394 1.3732 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7608 -3.2277 0.5838 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8155 -0.3866 0.2964 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6496 -1.2050 0.3971 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.8830 1.2211 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5156 1.1401 1.7032 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6685 2.2900 0.6385 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3738 -0.7857 1.4429 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4454 0.1861 2.4918 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0790 -1.3376 1.8385 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2171 0.8024 -1.5038 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5609 -0.2853 -2.6572 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1901 -1.6526 -1.7729 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3905 -3.2745 -0.8739 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0357 -3.0564 0.2572 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7042 1.5058 -2.2954 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1777 2.2345 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4837 2.0179 -0.5219 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2916 3.2120 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8503 3.8253 -0.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0117 3.1203 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1675 -0.4672 1.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0825 -2.4338 2.4217 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9014 -2.7938 1.0889 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5654 -3.4543 1.1663 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 2 4 2 3 4 5 1 0 5 6 1 0 6 7 2 0 7 8 1 0 7 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 11 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 17 18 2 0 18 19 1 0 18 20 1 0 20 21 1 0 20 22 2 0 22 23 1 0 22 24 1 0 24 25 1 0 25 26 1 0 24 27 2 0 27 28 1 0 12 6 1 0 27 17 1 0 28 10 1 0 1 29 1 0 1 30 1 0 1 31 1 0 3 32 1 0 3 33 1 0 3 34 1 0 4 35 1 0 5 36 1 0 5 37 1 0 8 38 1 0 9 39 1 0 13 40 1 0 13 41 1 0 13 42 1 0 19 43 1 0 19 44 1 0 19 45 1 0 23 46 1 0 25 47 1 0 25 48 1 0 26 49 1 0 M END