YL8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N16 | N15 | sing | 1.29Å | 1.34Å | Aromatic |
| N16 | N17 | sing | 1.29Å | 1.32Å | Aromatic |
| N15 | C14 | doub | 1.32Å | 1.36Å | Aromatic |
| F09 | C08 | sing | 1.40Å | 1.34Å | |
| N17 | N18 | doub | 1.29Å | 1.33Å | Aromatic |
| C14 | N18 | sing | 1.34Å | 1.36Å | Aromatic |
| C14 | C13 | sing | 1.49Å | 1.50Å | |
| F11 | C08 | sing | 1.40Å | 1.33Å | |
| C12 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | C07 | sing | 1.38Å | 1.38Å | Aromatic |
| C08 | C07 | sing | 1.51Å | 1.55Å | |
| C08 | F10 | sing | 1.40Å | 1.34Å | |
| C13 | C19 | sing | 1.39Å | 1.38Å | Aromatic |
| C07 | C06 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | C05 | doub | 1.38Å | 1.38Å | Aromatic |
| C06 | C05 | sing | 1.38Å | 1.39Å | Aromatic |
| C05 | C02 | sing | 1.51Å | 1.53Å | |
| F04 | C02 | sing | 1.40Å | 1.34Å | |
| C02 | F01 | sing | 1.40Å | 1.36Å | |
| C02 | F03 | sing | 1.40Å | 1.34Å | |
| C06 | H1 | sing | 1.08Å | 1.08Å | |
| C12 | H2 | sing | 1.08Å | 1.08Å | |
| C19 | H3 | sing | 1.08Å | 1.08Å | |
| N16 | H4 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N15 | N16 | N17 | 109.9° | 109.3° |
| N16 | N15 | C14 | 105.5° | 107.8° |
| N15 | N16 | H4 | 125.0° | 125.4° |
| N16 | N17 | N18 | 109.6° | 109.0° |
| N17 | N16 | H4 | 125.0° | 125.3° |
| N15 | C14 | N18 | 109.1° | 106.7° |
| N15 | C14 | C13 | 125.7° | 126.7° |
| F09 | C08 | F11 | 111.5° | 109.5° |
| F09 | C08 | C07 | 110.8° | 109.5° |
| F09 | C08 | F10 | 105.2° | 109.5° |
| N17 | N18 | C14 | 106.0° | 107.2° |
| N18 | C14 | C13 | 125.2° | 126.7° |
| C14 | C13 | C12 | 119.6° | 120.1° |
| C14 | C13 | C19 | 118.4° | 120.1° |
| F11 | C08 | C07 | 111.8° | 109.5° |
| F11 | C08 | F10 | 103.5° | 109.5° |
| C13 | C12 | C07 | 119.7° | 119.9° |
| C12 | C13 | C19 | 122.0° | 119.8° |
| C13 | C12 | H2 | 120.2° | 120.1° |
| C12 | C07 | C08 | 120.0° | 119.9° |
| C12 | C07 | C06 | 118.3° | 120.1° |
| C07 | C12 | H2 | 120.1° | 120.1° |
| C07 | C08 | F10 | 113.7° | 109.4° |
| C08 | C07 | C06 | 121.7° | 119.9° |
| C13 | C19 | C05 | 118.9° | 119.9° |
| C13 | C19 | H3 | 120.6° | 120.1° |
| C07 | C06 | C05 | 121.5° | 120.2° |
| C07 | C06 | H1 | 119.3° | 119.9° |
| C19 | C05 | C06 | 119.6° | 120.1° |
| C19 | C05 | C02 | 118.8° | 120.0° |
| C05 | C19 | H3 | 120.6° | 120.1° |
| C06 | C05 | C02 | 121.6° | 119.9° |
| C05 | C06 | H1 | 119.2° | 119.9° |
| C05 | C02 | F04 | 112.4° | 109.5° |
| C05 | C02 | F01 | 110.0° | 109.5° |
| C05 | C02 | F03 | 109.1° | 109.5° |
| F04 | C02 | F01 | 108.7° | 109.4° |
| F04 | C02 | F03 | 109.3° | 109.5° |
| F01 | C02 | F03 | 107.3° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N15 | N16 | N17 | H4 | 180.0° | 180.0° |
| N15 | N16 | N17 | N18 | 0.1° | 0.0° |
| N16 | N15 | C14 | N18 | 0.3° | 0.0° |
| N16 | N15 | C14 | C13 | 179.3° | 179.7° |
| N17 | N16 | N15 | C14 | 0.1° | 0.0° |
| N16 | N17 | N18 | C14 | 0.3° | 0.0° |
| N15 | C14 | N18 | N17 | 0.4° | 0.0° |
| N15 | C14 | N18 | C13 | 179.6° | 179.7° |
| N15 | C14 | C13 | C12 | 34.6° | 179.7° |
| N15 | C14 | C13 | C19 | 145.5° | 0.6° |
| C14 | N15 | N16 | H4 | 179.9° | 180.0° |
| F09 | C08 | F11 | C07 | 124.7° | 120.0° |
| F09 | C08 | F11 | F10 | 112.5° | 120.1° |
| F09 | C08 | C07 | C12 | 96.0° | 150.0° |
| F09 | C08 | C07 | F10 | 118.2° | 120.0° |
| F09 | C08 | C07 | C06 | 82.1° | 29.9° |
| N17 | N18 | C14 | C13 | 179.3° | 179.7° |
| N18 | N17 | N16 | H4 | 179.9° | 180.0° |
| N18 | C14 | C13 | C12 | 145.0° | 0.1° |
| N18 | C14 | C13 | C19 | 35.0° | 179.8° |
| C14 | C13 | C12 | C19 | 179.9° | 179.7° |
| C14 | C13 | C12 | C07 | 179.2° | 180.0° |
| C14 | C13 | C19 | C05 | 179.5° | 179.8° |
| C14 | C13 | C12 | H2 | 0.8° | 0.3° |
| C14 | C13 | C19 | H3 | 0.5° | 0.3° |
| F11 | C08 | C07 | C12 | 29.1° | 30.0° |
| F11 | C08 | C07 | F10 | 116.7° | 120.0° |
| F11 | C08 | C07 | C06 | 152.8° | 150.0° |
| C13 | C12 | C07 | H2 | 180.0° | 179.7° |
| C13 | C12 | C07 | C08 | 179.9° | 180.0° |
| C13 | C12 | C07 | C06 | 1.9° | 0.0° |
| C12 | C13 | C19 | C05 | 0.6° | 0.5° |
| C12 | C13 | C19 | H3 | 179.4° | 180.0° |
| C12 | C07 | C08 | C06 | 178.2° | 180.0° |
| C12 | C07 | C08 | F10 | 145.8° | 90.0° |
| C07 | C12 | C13 | C19 | 0.7° | 0.3° |
| C12 | C07 | C06 | C05 | 1.8° | 0.0° |
| C12 | C07 | C06 | H1 | 178.2° | 180.0° |
| C08 | C07 | C06 | C05 | 180.0° | 180.0° |
| C08 | C07 | C06 | H1 | 0.0° | 0.0° |
| C08 | C07 | C12 | H2 | 0.1° | 0.2° |
| F10 | C08 | C07 | C06 | 36.1° | 90.1° |
| C13 | C19 | C05 | H3 | 180.0° | 179.5° |
| C13 | C19 | C05 | C06 | 0.7° | 0.5° |
| C13 | C19 | C05 | C02 | 179.1° | 179.8° |
| C19 | C13 | C12 | H2 | 179.3° | 180.0° |
| C07 | C06 | C05 | C19 | 0.5° | 0.2° |
| C07 | C06 | C05 | H1 | 180.0° | 180.0° |
| C07 | C06 | C05 | C02 | 177.9° | 180.0° |
| C06 | C07 | C12 | H2 | 178.1° | 179.7° |
| C19 | C05 | C06 | C02 | 178.4° | 179.8° |
| C19 | C05 | C02 | F04 | 96.3° | 149.8° |
| C19 | C05 | C02 | F01 | 24.9° | 90.3° |
| C19 | C05 | C02 | F03 | 142.3° | 29.7° |
| C19 | C05 | C06 | H1 | 179.5° | 179.8° |
| C06 | C05 | C02 | F04 | 85.3° | 30.0° |
| C06 | C05 | C02 | F01 | 153.5° | 89.9° |
| C06 | C05 | C02 | F03 | 36.1° | 150.0° |
| C06 | C05 | C19 | H3 | 179.3° | 180.0° |
| C05 | C02 | F04 | F01 | 122.0° | 120.0° |
| C05 | C02 | F04 | F03 | 121.3° | 120.0° |
| C05 | C02 | F01 | F03 | 118.5° | 120.0° |
| C02 | C05 | C06 | H1 | 2.1° | 0.0° |
| C02 | C05 | C19 | H3 | 0.9° | 0.3° |
| F04 | C02 | F01 | F03 | 118.0° | 120.0° |
