A1AXM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | trip | 1.14Å | 1.14Å | |
| C1 | C2 | sing | 1.43Å | 1.44Å | |
| C2 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.37Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.37Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | doub | 1.39Å | 1.40Å | Aromatic |
| C7 | N2 | sing | 1.40Å | 1.43Å | |
| N2 | C8 | sing | 1.37Å | 1.37Å | Aromatic |
| C8 | C9 | doub | 1.35Å | 1.34Å | Aromatic |
| C9 | N3 | sing | 1.34Å | 1.37Å | Aromatic |
| N3 | C10 | doub | 1.30Å | 1.32Å | Aromatic |
| C2 | C7 | sing | 1.40Å | 1.39Å | Aromatic |
| N2 | C10 | sing | 1.36Å | 1.35Å | Aromatic |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| C10 | H7 | sing | 1.08Å | 1.08Å | |
| C6 | H4 | sing | 1.08Å | 1.08Å | |
| C8 | H5 | sing | 1.08Å | 1.08Å | |
| C9 | H6 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C1 | C2 | 179.9° | 180.0° |
| C1 | C2 | C3 | 117.9° | 120.2° |
| C1 | C2 | C7 | 122.6° | 120.2° |
| C2 | C3 | C4 | 119.8° | 119.9° |
| C3 | C2 | C7 | 119.6° | 119.6° |
| C2 | C3 | H1 | 120.1° | 120.1° |
| C3 | C4 | C5 | 120.8° | 120.3° |
| C4 | C3 | H1 | 120.1° | 120.0° |
| C3 | C4 | H2 | 119.6° | 119.8° |
| C4 | C5 | C6 | 120.3° | 120.4° |
| C5 | C4 | H2 | 119.6° | 119.8° |
| C4 | C5 | H3 | 119.9° | 119.9° |
| C5 | C6 | C7 | 119.8° | 120.0° |
| C6 | C5 | H3 | 119.8° | 119.7° |
| C5 | C6 | H4 | 120.1° | 120.0° |
| C6 | C7 | N2 | 119.3° | 120.1° |
| C6 | C7 | C2 | 119.6° | 119.7° |
| C7 | C6 | H4 | 120.1° | 120.0° |
| C7 | N2 | C8 | 125.1° | 126.4° |
| N2 | C7 | C2 | 121.2° | 120.1° |
| C7 | N2 | C10 | 128.0° | 126.5° |
| N2 | C8 | C9 | 106.6° | 106.8° |
| C8 | N2 | C10 | 106.8° | 107.1° |
| N2 | C8 | H5 | 126.7° | 126.6° |
| C8 | C9 | N3 | 110.0° | 108.2° |
| C9 | C8 | H5 | 126.7° | 126.6° |
| C8 | C9 | H6 | 125.0° | 125.9° |
| C9 | N3 | C10 | 105.6° | 109.4° |
| N3 | C9 | H6 | 125.0° | 125.9° |
| N3 | C10 | N2 | 110.9° | 108.6° |
| N3 | C10 | H7 | 124.5° | 125.7° |
| N2 | C10 | H7 | 124.6° | 125.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C1 | C2 | C3 | 122.7° | 104.9° |
| N1 | C1 | C2 | C7 | 57.2° | 74.9° |
| C1 | C2 | C3 | C7 | 179.9° | 179.8° |
| C1 | C2 | C3 | C4 | 179.4° | 180.0° |
| C1 | C2 | C7 | C6 | 179.0° | 179.8° |
| C1 | C2 | C7 | N2 | 0.6° | 0.1° |
| C1 | C2 | C3 | H1 | 0.6° | 0.1° |
| C2 | C3 | C4 | H1 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 0.2° | 0.0° |
| C3 | C2 | C7 | C6 | 1.0° | 0.5° |
| C3 | C2 | C7 | N2 | 179.5° | 179.7° |
| C2 | C3 | C4 | H2 | 179.8° | 180.0° |
| C3 | C4 | C5 | H2 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.3° | 0.0° |
| C4 | C3 | C2 | C7 | 0.5° | 0.2° |
| C3 | C4 | C5 | H3 | 179.7° | 180.0° |
| C4 | C5 | C6 | H3 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 0.7° | 0.3° |
| C5 | C4 | C3 | H1 | 179.8° | 180.0° |
| C4 | C5 | C6 | H4 | 179.3° | 180.0° |
| C5 | C6 | C7 | H4 | 180.0° | 179.7° |
| C5 | C6 | C7 | N2 | 179.4° | 179.7° |
| C5 | C6 | C7 | C2 | 1.1° | 0.5° |
| C6 | C5 | C4 | H2 | 179.7° | 180.0° |
| C6 | C7 | N2 | C2 | 179.5° | 179.8° |
| C6 | C7 | N2 | C8 | 35.2° | 49.8° |
| C6 | C7 | N2 | C10 | 141.2° | 130.2° |
| C7 | C6 | C5 | H3 | 179.3° | 179.8° |
| C7 | N2 | C8 | C10 | 177.0° | 179.9° |
| C7 | N2 | C8 | C9 | 178.7° | 179.9° |
| C7 | N2 | C10 | N3 | 178.6° | 179.7° |
| C7 | N2 | C10 | H7 | 1.5° | 0.1° |
| N2 | C7 | C6 | H4 | 0.6° | 0.0° |
| C7 | N2 | C8 | H5 | 1.3° | 0.1° |
| N2 | C8 | C9 | H5 | 180.0° | 179.9° |
| N2 | C8 | C9 | N3 | 1.2° | 0.0° |
| C8 | N2 | C10 | N3 | 1.7° | 0.3° |
| C8 | N2 | C7 | C2 | 144.4° | 130.0° |
| C8 | N2 | C10 | H7 | 178.3° | 180.0° |
| N2 | C8 | C9 | H6 | 178.8° | 180.0° |
| C8 | C9 | N3 | H6 | 180.0° | 180.0° |
| C8 | C9 | N3 | C10 | 0.2° | 0.2° |
| C9 | C8 | N2 | C10 | 1.7° | 0.2° |
| C9 | N3 | C10 | N2 | 0.9° | 0.3° |
| C9 | N3 | C10 | H7 | 179.1° | 180.0° |
| N3 | C9 | C8 | H5 | 178.8° | 180.0° |
| N3 | C10 | N2 | H7 | 180.0° | 179.7° |
| C10 | N3 | C9 | H6 | 179.8° | 179.8° |
| C2 | C7 | N2 | C10 | 39.3° | 49.9° |
| C7 | C2 | C3 | H1 | 179.5° | 179.8° |
| C2 | C7 | C6 | H4 | 179.0° | 179.8° |
| C10 | N2 | C8 | H5 | 178.3° | 179.9° |
| H1 | C3 | C4 | H2 | 0.2° | 0.0° |
| H2 | C4 | C5 | H3 | 0.3° | 0.0° |
| H3 | C5 | C6 | H4 | 0.7° | 0.1° |
| H5 | C8 | C9 | H6 | 1.2° | 0.0° |
