FL4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| C4 | F8 | sing | 1.35Å | 1.34Å | |
| C14 | C13 | doub | 1.41Å | 1.38Å | Aromatic |
| C14 | N15 | sing | 1.33Å | 1.35Å | Aromatic |
| C14 | N18 | sing | 1.36Å | 1.35Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C1 | doub | 1.39Å | 1.40Å | Aromatic |
| C10 | O9 | sing | 1.35Å | 1.37Å | |
| C10 | N11 | sing | 1.33Å | 1.37Å | Aromatic |
| C10 | N15 | doub | 1.32Å | 1.36Å | Aromatic |
| C12 | C13 | sing | 1.40Å | 1.39Å | Aromatic |
| C12 | N11 | doub | 1.32Å | 1.35Å | Aromatic |
| C13 | C16 | sing | 1.47Å | 1.49Å | Aromatic |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | F7 | sing | 1.35Å | 1.34Å | |
| C2 | C1 | sing | 1.39Å | 1.39Å | Aromatic |
| C1 | O9 | sing | 1.36Å | 1.38Å | |
| N18 | N17 | sing | 1.40Å | 1.41Å | Aromatic |
| N17 | C16 | doub | 1.31Å | 1.36Å | Aromatic |
| C16 | C19 | sing | 1.48Å | 1.50Å | Aromatic |
| C19 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C19 | C20 | sing | 1.39Å | 1.40Å | Aromatic |
| C24 | CL1 | sing | 1.51Å | 1.79Å | |
| C24 | C23 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.40Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| N18 | HN18 | sing | 0.97Å | 1.00Å | |
| CL1 | HL1 | sing | 1.09Å | 1.10Å | |
| CL1 | HL1A | sing | 1.09Å | 1.10Å | |
| CL1 | HL1B | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | C3 | 120.2° | 120.0° |
| C5 | C4 | F8 | 120.5° | 120.0° |
| C4 | C5 | C6 | 119.6° | 120.1° |
| C4 | C5 | H5 | 120.2° | 119.9° |
| C3 | C4 | F8 | 119.4° | 120.0° |
| C4 | C3 | C2 | 119.9° | 120.1° |
| C4 | C3 | H3 | 120.1° | 119.9° |
| C13 | C14 | N15 | 122.0° | 118.7° |
| C13 | C14 | N18 | 110.4° | 106.8° |
| C14 | C13 | C12 | 119.6° | 118.7° |
| C14 | C13 | C16 | 106.4° | 106.4° |
| N15 | C14 | N18 | 127.6° | 134.5° |
| C14 | N15 | C10 | 117.8° | 120.4° |
| C14 | N18 | N17 | 107.9° | 109.5° |
| C14 | N18 | HN18 | 126.1° | 125.2° |
| C5 | C6 | C1 | 120.3° | 120.0° |
| C6 | C5 | H5 | 120.2° | 120.0° |
| C5 | C6 | H6 | 119.8° | 120.0° |
| C6 | C1 | C2 | 119.6° | 119.9° |
| C6 | C1 | O9 | 120.1° | 120.0° |
| C1 | C6 | H6 | 119.9° | 120.0° |
| O9 | C10 | N11 | 119.6° | 118.8° |
| O9 | C10 | N15 | 119.4° | 118.7° |
| C10 | O9 | C1 | 120.5° | 118.0° |
| N11 | C10 | N15 | 121.0° | 122.4° |
| C10 | N11 | C12 | 122.1° | 121.2° |
| C13 | C12 | N11 | 117.5° | 118.6° |
| C12 | C13 | C16 | 134.0° | 134.9° |
| C13 | C12 | H12 | 121.3° | 120.7° |
| N11 | C12 | H12 | 121.2° | 120.7° |
| C13 | C16 | N17 | 105.1° | 107.3° |
| C13 | C16 | C19 | 129.7° | 126.3° |
| C3 | C2 | F7 | 119.3° | 120.1° |
| C3 | C2 | C1 | 120.4° | 119.9° |
| C2 | C3 | H3 | 120.0° | 120.0° |
| F7 | C2 | C1 | 120.3° | 120.0° |
| C2 | C1 | O9 | 120.2° | 120.1° |
| N18 | N17 | C16 | 110.2° | 110.0° |
| N17 | N18 | HN18 | 126.0° | 125.3° |
| N17 | C16 | C19 | 125.2° | 126.4° |
| C16 | C19 | C24 | 122.4° | 120.1° |
| C16 | C19 | C20 | 118.3° | 120.1° |
| C24 | C19 | C20 | 119.3° | 119.7° |
| C19 | C24 | CL1 | 121.1° | 120.1° |
| C19 | C24 | C23 | 120.2° | 119.9° |
| C19 | C20 | C21 | 120.6° | 119.9° |
| C19 | C20 | H20 | 119.7° | 120.1° |
| CL1 | C24 | C23 | 118.7° | 120.0° |
| C24 | CL1 | HL1 | 109.5° | 109.5° |
| C24 | CL1 | HL1A | 109.5° | 109.5° |
| C24 | CL1 | HL1B | 109.4° | 109.5° |
| C24 | C23 | C22 | 120.4° | 120.1° |
| C24 | C23 | H23 | 119.8° | 119.9° |
| C20 | C21 | C22 | 119.9° | 120.1° |
| C21 | C20 | H20 | 119.7° | 120.0° |
| C20 | C21 | H21 | 120.0° | 119.9° |
| C21 | C22 | C23 | 119.6° | 120.2° |
| C22 | C21 | H21 | 120.1° | 119.9° |
| C21 | C22 | H22 | 120.2° | 119.9° |
| C23 | C22 | H22 | 120.2° | 119.9° |
| C22 | C23 | H23 | 119.8° | 119.9° |
| HL1 | CL1 | HL1A | 109.5° | 109.5° |
| HL1 | CL1 | HL1B | 109.4° | 109.4° |
| HL1A | CL1 | HL1B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | C3 | F8 | 179.0° | 179.7° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | C1 | 0.0° | 0.0° |
| C5 | C4 | C3 | C2 | 0.2° | 0.0° |
| C4 | C5 | C6 | H6 | 180.0° | 179.9° |
| C5 | C4 | C3 | H3 | 179.9° | 180.0° |
| C3 | C4 | C5 | C6 | 0.3° | 0.1° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C4 | C3 | C2 | F7 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.3° | 0.0° |
| C3 | C4 | C5 | H5 | 179.7° | 180.0° |
| F8 | C4 | C5 | C6 | 179.3° | 179.8° |
| F8 | C4 | C3 | C2 | 179.1° | 179.8° |
| F8 | C4 | C5 | H5 | 0.8° | 0.3° |
| F8 | C4 | C3 | H3 | 0.9° | 0.2° |
| C13 | C14 | N15 | N18 | 180.0° | 179.6° |
| C13 | C14 | N15 | C10 | 0.0° | 0.0° |
| C14 | C13 | C12 | C16 | 179.6° | 180.0° |
| C14 | C13 | C12 | N11 | 0.0° | 0.0° |
| C13 | C14 | N18 | N17 | 0.2° | 0.0° |
| C14 | C13 | C16 | N17 | 0.2° | 0.5° |
| C14 | C13 | C16 | C19 | 179.7° | 180.0° |
| C14 | C13 | C12 | H12 | 180.0° | 180.0° |
| C13 | C14 | N18 | HN18 | 179.8° | 180.0° |
| C14 | N15 | C10 | O9 | 180.0° | 180.0° |
| C14 | N15 | C10 | N11 | 0.2° | 0.0° |
| N15 | C14 | C13 | C12 | 0.1° | 0.0° |
| N15 | C14 | C13 | C16 | 179.8° | 180.0° |
| N15 | C14 | N18 | N17 | 179.9° | 179.6° |
| N15 | C14 | N18 | HN18 | 0.1° | 0.4° |
| N18 | C14 | N15 | C10 | 180.0° | 179.7° |
| N18 | C14 | C13 | C12 | 179.9° | 179.7° |
| N18 | C14 | C13 | C16 | 0.2° | 0.2° |
| C14 | N18 | N17 | HN18 | 180.0° | 180.0° |
| C14 | N18 | N17 | C16 | 0.0° | 0.4° |
| C5 | C6 | C1 | H6 | 180.0° | 180.0° |
| C5 | C6 | C1 | C2 | 0.5° | 0.0° |
| C5 | C6 | C1 | O9 | 180.0° | 180.0° |
| C6 | C1 | O9 | C10 | 107.6° | 97.5° |
| C6 | C1 | C2 | C3 | 0.6° | 0.0° |
| C6 | C1 | C2 | F7 | 179.7° | 179.9° |
| C6 | C1 | C2 | O9 | 179.6° | 180.0° |
| C1 | C6 | C5 | H5 | 180.0° | 179.9° |
| O9 | C10 | N11 | N15 | 179.8° | 180.0° |
| O9 | C10 | N11 | C12 | 180.0° | 180.0° |
| C10 | O9 | C1 | C2 | 71.9° | 82.5° |
| C10 | N11 | C12 | C13 | 0.1° | 0.0° |
| N11 | C10 | O9 | C1 | 173.0° | 4.8° |
| C10 | N11 | C12 | H12 | 179.8° | 180.0° |
| N15 | C10 | N11 | C12 | 0.2° | 0.0° |
| N15 | C10 | O9 | C1 | 7.2° | 175.2° |
| C13 | C12 | N11 | H12 | 180.0° | 180.0° |
| C12 | C13 | C16 | N17 | 179.8° | 179.5° |
| C12 | C13 | C16 | C19 | 0.7° | 0.0° |
| N11 | C12 | C13 | C16 | 179.6° | 180.0° |
| C13 | C16 | N17 | N18 | 0.1° | 0.5° |
| C13 | C16 | N17 | C19 | 179.5° | 179.5° |
| C13 | C16 | C19 | C24 | 58.6° | 132.5° |
| C13 | C16 | C19 | C20 | 122.4° | 47.8° |
| C16 | C13 | C12 | H12 | 0.4° | 0.0° |
| C3 | C2 | F7 | C1 | 179.7° | 180.0° |
| C3 | C2 | C1 | O9 | 179.8° | 180.0° |
| F7 | C2 | C1 | O9 | 0.1° | 0.1° |
| F7 | C2 | C3 | H3 | 0.0° | 0.0° |
| C2 | C1 | C6 | H6 | 179.5° | 180.0° |
| C1 | C2 | C3 | H3 | 179.7° | 180.0° |
| O9 | C1 | C6 | H6 | 0.1° | 0.0° |
| N18 | N17 | C16 | C19 | 179.6° | 180.0° |
| N17 | C16 | C19 | C24 | 122.0° | 48.1° |
| N17 | C16 | C19 | C20 | 57.0° | 131.6° |
| C16 | N17 | N18 | HN18 | 180.0° | 179.6° |
| C16 | C19 | C24 | C20 | 179.0° | 179.7° |
| C16 | C19 | C24 | CL1 | 1.0° | 0.0° |
| C16 | C19 | C24 | C23 | 179.5° | 180.0° |
| C16 | C19 | C20 | C21 | 179.5° | 180.0° |
| C16 | C19 | C20 | H20 | 0.5° | 0.0° |
| C19 | C24 | CL1 | C23 | 179.5° | 179.9° |
| C24 | C19 | C20 | C21 | 0.5° | 0.2° |
| C19 | C24 | C23 | C22 | 0.1° | 0.0° |
| C19 | C24 | CL1 | HL1 | 91.0° | 89.9° |
| C19 | C24 | CL1 | HL1A | 149.0° | 150.0° |
| C19 | C24 | CL1 | HL1B | 29.0° | 30.0° |
| C24 | C19 | C20 | H20 | 179.5° | 179.7° |
| C19 | C24 | C23 | H23 | 179.9° | 180.0° |
| C20 | C19 | C24 | CL1 | 180.0° | 179.7° |
| C20 | C19 | C24 | C23 | 0.5° | 0.2° |
| C19 | C20 | C21 | H20 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 0.1° | 0.0° |
| C19 | C20 | C21 | H21 | 179.9° | 180.0° |
| CL1 | C24 | C23 | C22 | 179.6° | 180.0° |
| C24 | CL1 | HL1 | HL1A | 120.0° | 120.1° |
| C24 | CL1 | HL1 | HL1B | 120.0° | 120.0° |
| C24 | CL1 | HL1A | HL1B | 120.0° | 120.0° |
| CL1 | C24 | C23 | H23 | 0.4° | 0.1° |
| C24 | C23 | C22 | C21 | 0.3° | 0.3° |
| C24 | C23 | C22 | H23 | 180.0° | 179.9° |
| C23 | C24 | CL1 | HL1 | 88.5° | 90.0° |
| C23 | C24 | CL1 | HL1A | 31.5° | 30.0° |
| C23 | C24 | CL1 | HL1B | 151.5° | 150.1° |
| C24 | C23 | C22 | H22 | 179.7° | 180.0° |
| C20 | C21 | C22 | H21 | 180.0° | 179.9° |
| C20 | C21 | C22 | C23 | 0.3° | 0.2° |
| C20 | C21 | C22 | H22 | 179.7° | 180.0° |
| C21 | C22 | C23 | H22 | 180.0° | 179.8° |
| C22 | C21 | C20 | H20 | 179.9° | 179.9° |
| C21 | C22 | C23 | H23 | 179.7° | 179.8° |
| C23 | C22 | C21 | H21 | 179.7° | 179.7° |
| H5 | C5 | C6 | H6 | 0.1° | 0.0° |
| HL1 | CL1 | HL1A | HL1B | 120.0° | 119.9° |
| H20 | C20 | C21 | H21 | 0.1° | 0.0° |
| H21 | C21 | C22 | H22 | 0.3° | 0.1° |
| H22 | C22 | C23 | H23 | 0.3° | 0.0° |
