HMDB0041793 RDKit 3D 1-Aminopyrene 28 31 0 0 0 0 0 0 0 0999 V2000 3.8799 0.6154 -0.0970 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7018 -0.1730 0.0025 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8189 -1.5373 0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6782 -2.3085 0.2574 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4131 -1.7299 0.1985 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7380 -2.4677 0.2919 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0073 -1.9279 0.2376 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1216 -0.5482 0.0781 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3719 0.0226 0.0201 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4996 1.3798 -0.1368 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3699 2.1487 -0.2336 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1190 1.5820 -0.1761 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0418 2.3284 -0.2705 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 1.7452 -0.2111 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4398 0.3873 -0.0543 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2815 -0.3644 0.0408 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9661 0.2218 -0.0191 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7329 0.2885 -0.6263 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9769 1.5655 0.3457 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8191 -1.9451 0.2009 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7705 -3.3674 0.3798 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6482 -3.5266 0.4143 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9062 -2.5405 0.3148 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2419 -0.6228 0.1008 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5059 1.8259 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4699 3.2113 -0.3564 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0762 3.3963 -0.3938 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1933 2.3406 -0.2862 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 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 15 2 1 0 16 5 1 0 17 8 1 0 17 12 1 0 1 18 1 0 1 19 1 0 3 20 1 0 4 21 1 0 6 22 1 0 7 23 1 0 9 24 1 0 10 25 1 0 11 26 1 0 13 27 1 0 14 28 1 0 M END