HMDB0254199 RDKit 3D Lumichrome 28 30 0 0 0 0 0 0 0 0999 V2000 -3.7933 -1.2171 -0.1395 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4572 -0.5758 -0.0822 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2821 -1.3203 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0442 -0.7085 -0.1062 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0917 -1.4450 -0.1839 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2852 -0.8284 -0.1283 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4542 -1.5120 -0.2009 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6527 -0.8750 -0.1433 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7185 -1.5403 -0.2137 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 0.4593 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5648 1.1530 0.0615 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5985 2.4069 0.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3202 0.5399 0.0065 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2043 1.2863 0.0851 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0003 0.6642 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1695 1.3913 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4126 0.7957 0.0529 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6757 1.5750 0.1355 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2675 -1.1187 0.8808 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7494 -2.2846 -0.3524 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4379 -0.6297 -0.8184 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3396 -2.3916 -0.2664 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4555 -2.5515 -0.3035 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6457 0.9358 0.0309 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 2.4568 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9227 1.9221 -0.8806 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5118 2.4581 0.7887 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4981 0.9542 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 17 2 1 0 15 4 1 0 13 6 2 0 1 19 1 0 1 20 1 0 1 21 1 0 3 22 1 0 7 23 1 0 10 24 1 0 16 25 1 0 18 26 1 0 18 27 1 0 18 28 1 0 M END