HMDB0168957 RDKit 3D Allylamine 11 10 0 0 0 0 0 0 0 0999 V2000 1.7548 -0.3152 -0.2606 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6407 0.3424 -0.4282 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6646 -0.2581 -0.0434 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3526 0.5172 0.9506 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6912 0.1450 -0.5491 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8115 -1.3121 0.1563 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6303 1.3407 -0.8502 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4937 -1.2828 0.3436 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.3822 -0.9544 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9718 1.2458 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7507 -0.0407 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 1 5 1 0 1 6 1 0 2 7 1 0 3 8 1 0 3 9 1 0 4 10 1 0 4 11 1 0 M END