HMDB0040511 RDKit 3D Physcionin 54 57 0 0 0 0 0 0 0 0999 V2000 1.1717 5.4597 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1974 4.4744 0.9137 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5198 3.1421 0.6627 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4445 2.1813 0.4376 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1410 0.8643 0.1890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0735 -0.0895 -0.0336 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 0.0018 -0.0666 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9709 -0.8383 0.9087 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3145 -1.0366 0.8848 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1467 0.0871 1.4216 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9978 1.2786 0.7636 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8739 -1.4219 -0.4662 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6404 -0.3611 -0.9879 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7458 -1.6665 -1.4406 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9726 -2.7418 -1.0564 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9089 -0.4043 -1.4607 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6662 0.6391 -2.0354 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1922 0.5104 0.1683 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1915 1.4310 0.3868 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8383 2.7534 0.6346 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5843 1.0167 0.3564 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5126 1.8212 0.5494 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9368 -0.3931 0.0914 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2563 -0.7833 0.0631 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6263 -2.0802 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0709 -2.4909 -0.2066 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6345 -2.9929 -0.3956 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2629 -2.6835 -0.3852 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3472 -3.6685 -0.6133 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9575 -1.3489 -0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5895 -0.8917 -0.0936 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6526 -1.7039 -0.2883 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7061 6.4602 1.0632 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0113 5.4033 0.4051 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6455 5.3847 2.1438 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4645 2.5337 0.4695 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7653 1.0300 0.1253 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5239 -1.9245 1.5542 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2144 -0.2197 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9690 0.1821 2.5328 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8574 1.7244 0.5498 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5144 -2.3054 -0.4402 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9663 -0.6468 -1.8829 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1776 -1.7749 -2.4549 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1346 -2.7311 -1.5838 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0610 -0.5847 -2.1435 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0832 1.4266 -2.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6382 3.4559 0.8027 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0159 -0.0396 0.2378 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4728 -2.3636 0.8028 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6297 -1.8896 -0.9746 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1460 -3.5370 -0.5314 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8951 -4.0309 -0.5907 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -3.6177 -0.6386 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 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 9 12 1 0 12 13 1 0 12 14 1 0 14 15 1 0 14 16 1 0 16 17 1 0 5 18 2 0 18 19 1 0 19 20 2 0 19 21 1 0 21 22 2 0 21 23 1 0 23 24 2 0 24 25 1 0 25 26 1 0 25 27 2 0 27 28 1 0 28 29 1 0 28 30 2 0 30 31 1 0 31 32 2 0 20 3 1 0 30 23 1 0 16 7 1 0 31 18 1 0 1 33 1 0 1 34 1 0 1 35 1 0 4 36 1 0 7 37 1 0 9 38 1 0 10 39 1 0 10 40 1 0 11 41 1 0 12 42 1 0 13 43 1 0 14 44 1 0 15 45 1 0 16 46 1 0 17 47 1 0 20 48 1 0 24 49 1 0 26 50 1 0 26 51 1 0 26 52 1 0 27 53 1 0 29 54 1 0 M END