LZ1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.40Å | 1.40Å | Aromatic |
| C1 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C1 | N | sing | 1.37Å | 1.37Å | Aromatic |
| C2 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C9 | sing | 1.42Å | 1.42Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.38Å | Aromatic |
| N | N2 | sing | 1.36Å | 1.36Å | Aromatic |
| C9 | N2 | doub | 1.34Å | 1.34Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| N | H | sing | 1.00Å | 1.00Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 120.6° | 120.6° |
| C2 | C1 | N | 106.2° | 106.2° |
| C1 | C2 | C3 | 118.4° | 118.4° |
| C1 | C2 | C9 | 105.6° | 105.6° |
| C6 | C1 | N | 133.2° | 133.2° |
| C1 | C6 | C5 | 120.0° | 120.0° |
| C1 | C6 | H6 | 120.0° | 120.0° |
| C1 | N | N2 | 111.5° | 111.5° |
| C1 | N | H | 124.3° | 124.3° |
| C3 | C2 | C9 | 136.1° | 136.1° |
| C2 | C3 | C4 | 120.7° | 120.7° |
| C2 | C3 | H3 | 119.7° | 119.7° |
| C2 | C9 | N2 | 110.2° | 110.2° |
| C2 | C9 | H9 | 124.9° | 124.9° |
| C3 | C4 | C5 | 120.4° | 120.4° |
| C4 | C3 | H3 | 119.6° | 119.6° |
| C3 | C4 | H4 | 119.8° | 119.8° |
| C4 | C5 | C6 | 120.0° | 120.0° |
| C5 | C4 | H4 | 119.8° | 119.8° |
| C4 | C5 | H5 | 120.0° | 120.0° |
| C5 | C6 | H6 | 120.0° | 120.0° |
| C6 | C5 | H5 | 120.0° | 120.0° |
| N | N2 | C9 | 106.6° | 106.6° |
| N2 | N | H | 124.3° | 124.3° |
| N2 | C9 | H9 | 124.9° | 124.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | N | 178.9° | 178.9° |
| C1 | C2 | C3 | C9 | 179.4° | 179.4° |
| C1 | C2 | C3 | C4 | 0.5° | 0.5° |
| C2 | C1 | C6 | C5 | 0.7° | 0.7° |
| C2 | C1 | N | N2 | 0.1° | 0.1° |
| C1 | C2 | C9 | N2 | 0.8° | 0.8° |
| C2 | C1 | C6 | H6 | 179.3° | 179.3° |
| C2 | C1 | N | H | 179.9° | 179.9° |
| C1 | C2 | C3 | H3 | 179.5° | 179.5° |
| C1 | C2 | C9 | H9 | 179.3° | 179.3° |
| C6 | C1 | C2 | C3 | 0.8° | 0.8° |
| C6 | C1 | C2 | C9 | 179.6° | 179.6° |
| C1 | C6 | C5 | C4 | 0.4° | 0.4° |
| C1 | C6 | C5 | H6 | 180.0° | 180.0° |
| C6 | C1 | N | N2 | 179.1° | 179.1° |
| C6 | C1 | N | H | 0.9° | 0.9° |
| C1 | C6 | C5 | H5 | 179.7° | 179.7° |
| N | C1 | C2 | C3 | 179.9° | 179.9° |
| N | C1 | C2 | C9 | 0.5° | 0.5° |
| N | C1 | C6 | C5 | 179.6° | 179.6° |
| C1 | N | N2 | H | 180.0° | 180.0° |
| C1 | N | N2 | C9 | 0.4° | 0.4° |
| N | C1 | C6 | H6 | 0.4° | 0.4° |
| C2 | C3 | C4 | H3 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.1° | 0.1° |
| C3 | C2 | C9 | N2 | 179.8° | 179.8° |
| C3 | C2 | C9 | H9 | 0.2° | 0.2° |
| C2 | C3 | C4 | H4 | 179.9° | 179.9° |
| C9 | C2 | C3 | C4 | 179.9° | 179.9° |
| C2 | C9 | N2 | N | 0.7° | 0.7° |
| C2 | C9 | N2 | H9 | 180.0° | 180.0° |
| C9 | C2 | C3 | H3 | 0.1° | 0.1° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.1° | 0.1° |
| C3 | C4 | C5 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | H6 | 179.7° | 179.7° |
| C5 | C4 | C3 | H3 | 179.9° | 179.9° |
| C6 | C5 | C4 | H4 | 179.9° | 180.0° |
| N | N2 | C9 | H9 | 179.3° | 179.3° |
| C9 | N2 | N | H | 179.6° | 179.6° |
| H6 | C6 | C5 | H5 | 0.3° | 0.3° |
| H3 | C3 | C4 | H4 | 0.1° | 0.1° |
| H4 | C4 | C5 | H5 | 0.0° | 0.0° |
