FLW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | F27 | sing | 1.35Å | 1.34Å | |
| C15 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.53Å | 1.52Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C21 | O22 | sing | 1.43Å | 1.43Å | |
| C23 | C19 | sing | 1.53Å | 1.53Å | |
| C23 | C24 | sing | 1.53Å | 1.53Å | |
| C29 | N7 | sing | 1.47Å | 1.47Å | |
| F28 | C13 | sing | 1.35Å | 1.35Å | |
| C13 | C12 | doub | 1.39Å | 1.40Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
| C12 | O11 | sing | 1.36Å | 1.37Å | |
| O11 | C9 | sing | 1.36Å | 1.39Å | |
| C9 | C10 | doub | 1.36Å | 1.40Å | |
| C9 | C8 | sing | 1.42Å | 1.39Å | |
| C10 | C5 | sing | 1.46Å | 1.40Å | |
| C5 | C4 | doub | 1.40Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.41Å | 1.40Å | Aromatic |
| C4 | N1 | sing | 1.32Å | 1.34Å | Aromatic |
| N1 | C2 | doub | 1.33Å | 1.36Å | Aromatic |
| C8 | O26 | doub | 1.22Å | 1.25Å | |
| C8 | N7 | sing | 1.34Å | 1.42Å | |
| N7 | C6 | sing | 1.37Å | 1.42Å | |
| C6 | N3 | doub | 1.33Å | 1.36Å | Aromatic |
| N3 | C2 | sing | 1.32Å | 1.36Å | Aromatic |
| C2 | N18 | sing | 1.38Å | 1.35Å | |
| N18 | C19 | sing | 1.46Å | 1.46Å | |
| C24 | O25 | sing | 1.43Å | 1.43Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C29 | H29B | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| N18 | HN18 | sing | 0.97Å | 1.00Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| O25 | HO25 | sing | 0.97Å | 0.95Å | |
| O22 | HO22 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C15 | C14 | C13 | 119.9° | 120.0° |
| C14 | C15 | F27 | 120.2° | 120.0° |
| C14 | C15 | C16 | 120.5° | 120.1° |
| C15 | C14 | H14 | 120.0° | 120.0° |
| C14 | C13 | F28 | 119.4° | 120.0° |
| C14 | C13 | C12 | 119.7° | 120.0° |
| C13 | C14 | H14 | 120.0° | 120.0° |
| F27 | C15 | C16 | 119.4° | 120.0° |
| C15 | C16 | C17 | 119.4° | 120.0° |
| C15 | C16 | H16 | 120.3° | 119.9° |
| C21 | C20 | C19 | 110.9° | 109.5° |
| C20 | C21 | O22 | 109.4° | 109.5° |
| C21 | C20 | H20 | 109.0° | 109.5° |
| C21 | C20 | H20A | 108.6° | 109.5° |
| C20 | C21 | H21 | 109.5° | 109.5° |
| C20 | C21 | H21A | 109.5° | 109.5° |
| C20 | C19 | C23 | 108.2° | 109.5° |
| C20 | C19 | N18 | 109.4° | 109.5° |
| C19 | C20 | H20 | 109.0° | 109.5° |
| C19 | C20 | H20A | 108.7° | 109.4° |
| C20 | C19 | H19 | 110.9° | 109.5° |
| O22 | C21 | H21 | 109.5° | 109.5° |
| O22 | C21 | H21A | 109.5° | 109.5° |
| C21 | O22 | HO22 | 109.5° | 114.0° |
| C19 | C23 | C24 | 113.8° | 109.5° |
| C23 | C19 | N18 | 111.0° | 109.5° |
| C19 | C23 | H23 | 108.1° | 109.5° |
| C19 | C23 | H23A | 107.1° | 109.4° |
| C23 | C19 | H19 | 109.3° | 109.4° |
| C23 | C24 | O25 | 109.6° | 109.5° |
| C24 | C23 | H23 | 108.1° | 109.5° |
| C24 | C23 | H23A | 107.1° | 109.5° |
| C23 | C24 | H24 | 109.4° | 109.5° |
| C23 | C24 | H24A | 109.4° | 109.5° |
| C29 | N7 | C8 | 120.6° | 119.5° |
| C29 | N7 | C6 | 120.4° | 119.5° |
| N7 | C29 | H29 | 109.5° | 109.5° |
| N7 | C29 | H29A | 109.5° | 109.5° |
| N7 | C29 | H29B | 109.5° | 109.5° |
| F28 | C13 | C12 | 120.9° | 120.0° |
| C13 | C12 | C17 | 120.0° | 119.9° |
| C13 | C12 | O11 | 121.9° | 120.0° |
| C16 | C17 | C12 | 120.4° | 120.0° |
| C17 | C16 | H16 | 120.3° | 120.0° |
| C16 | C17 | H17 | 119.8° | 120.0° |
| C17 | C12 | O11 | 118.0° | 120.1° |
| C12 | C17 | H17 | 119.8° | 120.0° |
| C12 | O11 | C9 | 124.7° | 118.0° |
| O11 | C9 | C10 | 122.7° | 120.0° |
| O11 | C9 | C8 | 118.0° | 120.0° |
| C10 | C9 | C8 | 119.3° | 120.1° |
| C9 | C10 | C5 | 120.9° | 118.3° |
| C9 | C10 | H10 | 119.5° | 120.8° |
| C9 | C8 | O26 | 119.0° | 119.1° |
| C9 | C8 | N7 | 120.7° | 121.7° |
| C10 | C5 | C4 | 121.0° | 122.0° |
| C10 | C5 | C6 | 120.3° | 119.2° |
| C5 | C10 | H10 | 119.6° | 120.8° |
| C4 | C5 | C6 | 118.7° | 118.8° |
| C5 | C4 | N1 | 120.1° | 118.5° |
| C5 | C4 | H4 | 120.0° | 120.8° |
| C5 | C6 | N7 | 119.8° | 119.6° |
| C5 | C6 | N3 | 119.3° | 118.7° |
| C4 | N1 | C2 | 120.6° | 121.2° |
| N1 | C4 | H4 | 119.9° | 120.8° |
| N1 | C2 | N3 | 120.4° | 122.5° |
| N1 | C2 | N18 | 119.5° | 118.8° |
| O26 | C8 | N7 | 120.3° | 119.1° |
| C8 | N7 | C6 | 119.1° | 121.1° |
| N7 | C6 | N3 | 120.9° | 121.7° |
| C6 | N3 | C2 | 120.9° | 120.4° |
| N3 | C2 | N18 | 120.1° | 118.7° |
| C2 | N18 | C19 | 123.0° | 120.0° |
| C2 | N18 | HN18 | 105.2° | 120.0° |
| C19 | N18 | HN18 | 105.2° | 120.1° |
| N18 | C19 | H19 | 108.1° | 109.5° |
| O25 | C24 | H24 | 109.4° | 109.5° |
| O25 | C24 | H24A | 109.4° | 109.5° |
| C24 | O25 | HO25 | 109.5° | 114.0° |
| H20 | C20 | H20A | 110.6° | 109.5° |
| H21 | C21 | H21A | 109.4° | 109.5° |
| H23 | C23 | H23A | 112.9° | 109.5° |
| H29 | C29 | H29A | 109.5° | 109.4° |
| H29 | C29 | H29B | 109.4° | 109.5° |
| H29A | C29 | H29B | 109.5° | 109.5° |
| H24 | C24 | H24A | 109.6° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C15 | C14 | C13 | H14 | 180.0° | 179.7° |
| C14 | C15 | F27 | C16 | 180.0° | 180.0° |
| C15 | C14 | C13 | F28 | 179.4° | 180.0° |
| C15 | C14 | C13 | C12 | 0.1° | 0.0° |
| C14 | C15 | C16 | C17 | 0.1° | 0.0° |
| C14 | C15 | C16 | H16 | 179.9° | 180.0° |
| C13 | C14 | C15 | F27 | 179.8° | 180.0° |
| C13 | C14 | C15 | C16 | 0.2° | 0.0° |
| C14 | C13 | F28 | C12 | 179.3° | 180.0° |
| C14 | C13 | C12 | C17 | 0.6° | 0.0° |
| C14 | C13 | C12 | O11 | 179.9° | 179.9° |
| F27 | C15 | C16 | C17 | 179.9° | 180.0° |
| F27 | C15 | C14 | H14 | 0.2° | 0.3° |
| F27 | C15 | C16 | H16 | 0.1° | 0.0° |
| C15 | C16 | C17 | H16 | 180.0° | 180.0° |
| C15 | C16 | C17 | C12 | 0.6° | 0.0° |
| C16 | C15 | C14 | H14 | 179.8° | 179.7° |
| C15 | C16 | C17 | H17 | 179.4° | 180.0° |
| C21 | C20 | C19 | H20 | 120.0° | 120.0° |
| C21 | C20 | C19 | H20A | 119.4° | 120.0° |
| C20 | C21 | O22 | H21 | 120.0° | 120.0° |
| C20 | C21 | O22 | H21A | 120.1° | 120.0° |
| C21 | C20 | C19 | C23 | 137.7° | 175.0° |
| C21 | C20 | C19 | N18 | 101.3° | 65.0° |
| C21 | C20 | H20 | H20A | 119.4° | 120.0° |
| C20 | C21 | H21 | H21A | 120.0° | 120.0° |
| C21 | C20 | C19 | H19 | 17.8° | 55.0° |
| C20 | C21 | O22 | HO22 | 3.8° | 180.0° |
| C19 | C20 | C21 | O22 | 129.2° | 180.0° |
| C20 | C19 | C23 | N18 | 120.0° | 120.0° |
| C20 | C19 | C23 | H19 | 120.8° | 120.0° |
| C20 | C19 | C23 | C24 | 168.7° | 175.0° |
| C20 | C19 | N18 | C2 | 140.3° | 85.0° |
| C20 | C19 | N18 | H19 | 120.8° | 120.0° |
| C19 | C20 | H20 | H20A | 119.4° | 120.0° |
| C19 | C20 | C21 | H21 | 110.8° | 60.0° |
| C19 | C20 | C21 | H21A | 9.1° | 60.0° |
| C20 | C19 | C23 | H23 | 48.7° | 55.0° |
| C20 | C19 | C23 | H23A | 73.1° | 65.0° |
| C20 | C19 | N18 | HN18 | 20.2° | 95.1° |
| O22 | C21 | C20 | H20 | 110.8° | 60.0° |
| O22 | C21 | C20 | H20A | 9.8° | 60.0° |
| O22 | C21 | H21 | H21A | 120.0° | 120.0° |
| C19 | C23 | C24 | H23 | 120.0° | 120.1° |
| C19 | C23 | C24 | H23A | 118.1° | 119.9° |
| C23 | C19 | N18 | C2 | 100.5° | 155.0° |
| C23 | C19 | N18 | H19 | 119.9° | 120.0° |
| C19 | C23 | C24 | O25 | 64.5° | 180.0° |
| C23 | C19 | C20 | H20 | 17.7° | 55.0° |
| C23 | C19 | C20 | H20A | 102.9° | 65.0° |
| C19 | C23 | H23 | H23A | 118.2° | 119.9° |
| C23 | C19 | N18 | HN18 | 139.5° | 25.0° |
| C19 | C23 | C24 | H24 | 175.5° | 59.9° |
| C19 | C23 | C24 | H24A | 55.4° | 60.0° |
| C24 | C23 | C19 | N18 | 71.3° | 65.0° |
| C23 | C24 | O25 | H24 | 120.0° | 120.0° |
| C23 | C24 | O25 | H24A | 119.9° | 120.0° |
| C24 | C23 | H23 | H23A | 118.3° | 120.0° |
| C24 | C23 | C19 | H19 | 47.9° | 55.0° |
| C23 | C24 | H24 | H24A | 120.0° | 120.0° |
| C23 | C24 | O25 | HO25 | 27.0° | 180.0° |
| C29 | N7 | C8 | C9 | 180.0° | 180.0° |
| C29 | N7 | C6 | C5 | 179.9° | 179.7° |
| C29 | N7 | C8 | O26 | 0.1° | 0.1° |
| C29 | N7 | C8 | C6 | 180.0° | 180.0° |
| C29 | N7 | C6 | N3 | 0.1° | 0.0° |
| N7 | C29 | H29 | H29A | 120.0° | 120.0° |
| N7 | C29 | H29 | H29B | 120.0° | 120.0° |
| N7 | C29 | H29A | H29B | 120.0° | 120.0° |
| F28 | C13 | C12 | C17 | 179.9° | 180.0° |
| F28 | C13 | C12 | O11 | 0.6° | 0.1° |
| F28 | C13 | C14 | H14 | 0.6° | 0.3° |
| C13 | C12 | C17 | C16 | 0.9° | 0.0° |
| C13 | C12 | C17 | O11 | 179.5° | 179.9° |
| C13 | C12 | O11 | C9 | 63.4° | 174.5° |
| C12 | C13 | C14 | H14 | 179.9° | 179.7° |
| C13 | C12 | C17 | H17 | 179.1° | 180.0° |
| C16 | C17 | C12 | H17 | 180.0° | 180.0° |
| C16 | C17 | C12 | O11 | 179.6° | 179.9° |
| C17 | C12 | O11 | C9 | 117.1° | 5.6° |
| C12 | C17 | C16 | H16 | 179.4° | 180.0° |
| C12 | O11 | C9 | C10 | 9.6° | 113.1° |
| C12 | O11 | C9 | C8 | 170.0° | 67.2° |
| O11 | C12 | C17 | H17 | 0.4° | 0.1° |
| O11 | C9 | C10 | C8 | 179.6° | 179.7° |
| O11 | C9 | C10 | C5 | 179.7° | 180.0° |
| O11 | C9 | C8 | O26 | 0.2° | 0.1° |
| O11 | C9 | C8 | N7 | 179.7° | 180.0° |
| O11 | C9 | C10 | H10 | 0.3° | 0.0° |
| C9 | C10 | C5 | H10 | 180.0° | 180.0° |
| C9 | C10 | C5 | C4 | 179.8° | 180.0° |
| C9 | C10 | C5 | C6 | 0.1° | 0.0° |
| C10 | C9 | C8 | O26 | 179.9° | 179.8° |
| C10 | C9 | C8 | N7 | 0.1° | 0.3° |
| C8 | C9 | C10 | C5 | 0.1° | 0.3° |
| C9 | C8 | O26 | N7 | 179.9° | 179.9° |
| C9 | C8 | N7 | C6 | 0.1° | 0.0° |
| C8 | C9 | C10 | H10 | 179.9° | 179.7° |
| C10 | C5 | C4 | C6 | 179.9° | 180.0° |
| C10 | C5 | C4 | N1 | 179.7° | 180.0° |
| C10 | C5 | C6 | N7 | 0.1° | 0.3° |
| C10 | C5 | C6 | N3 | 179.8° | 180.0° |
| C10 | C5 | C4 | H4 | 0.3° | 0.0° |
| C5 | C4 | N1 | H4 | 180.0° | 180.0° |
| C5 | C4 | N1 | C2 | 0.3° | 0.0° |
| C4 | C5 | C6 | N7 | 179.8° | 179.7° |
| C4 | C5 | C6 | N3 | 0.3° | 0.0° |
| C4 | C5 | C10 | H10 | 0.2° | 0.0° |
| C6 | C5 | C4 | N1 | 0.4° | 0.0° |
| C5 | C6 | N7 | C8 | 0.1° | 0.3° |
| C5 | C6 | N7 | N3 | 179.9° | 179.7° |
| C5 | C6 | N3 | C2 | 0.0° | 0.0° |
| C6 | C5 | C10 | H10 | 179.9° | 180.0° |
| C6 | C5 | C4 | H4 | 179.6° | 180.0° |
| C4 | N1 | C2 | N3 | 0.1° | 0.1° |
| C4 | N1 | C2 | N18 | 179.6° | 180.0° |
| N1 | C2 | N3 | C6 | 0.1° | 0.0° |
| N1 | C2 | N3 | N18 | 179.6° | 180.0° |
| N1 | C2 | N18 | C19 | 172.6° | 0.0° |
| C2 | N1 | C4 | H4 | 179.7° | 180.0° |
| N1 | C2 | N18 | HN18 | 67.3° | 180.0° |
| O26 | C8 | N7 | C6 | 179.8° | 179.9° |
| C8 | N7 | C6 | N3 | 179.8° | 180.0° |
| C8 | N7 | C29 | H29 | 101.3° | 0.0° |
| C8 | N7 | C29 | H29A | 18.7° | 120.0° |
| C8 | N7 | C29 | H29B | 138.7° | 120.0° |
| N7 | C6 | N3 | C2 | 180.0° | 179.7° |
| C6 | N7 | C29 | H29 | 78.7° | 180.0° |
| C6 | N7 | C29 | H29A | 161.3° | 60.0° |
| C6 | N7 | C29 | H29B | 41.3° | 60.0° |
| C6 | N3 | C2 | N18 | 179.7° | 180.0° |
| N3 | C2 | N18 | C19 | 7.0° | 180.0° |
| N3 | C2 | N18 | HN18 | 113.0° | 0.1° |
| C2 | N18 | C19 | HN18 | 120.0° | 180.0° |
| C2 | N18 | C19 | H19 | 19.4° | 35.0° |
| N18 | C19 | C20 | H20 | 138.7° | 175.0° |
| N18 | C19 | C20 | H20A | 18.0° | 55.0° |
| N18 | C19 | C23 | H23 | 168.7° | 175.0° |
| N18 | C19 | C23 | H23A | 46.9° | 55.0° |
| O25 | C24 | C23 | H23 | 55.5° | 60.0° |
| O25 | C24 | C23 | H23A | 177.4° | 60.0° |
| O25 | C24 | H24 | H24A | 120.0° | 120.0° |
| H20 | C20 | C21 | H21 | 9.2° | 60.0° |
| H20 | C20 | C21 | H21A | 129.1° | 180.0° |
| H20 | C20 | C19 | H19 | 102.2° | 65.0° |
| H20A | C20 | C21 | H21 | 129.8° | 180.0° |
| H20A | C20 | C21 | H21A | 110.2° | 60.0° |
| H20A | C20 | C19 | H19 | 137.2° | 175.0° |
| H21 | C21 | O22 | HO22 | 116.2° | 60.0° |
| H21A | C21 | O22 | HO22 | 123.8° | 60.0° |
| H23 | C23 | C19 | H19 | 72.1° | 65.0° |
| H23 | C23 | C24 | H24 | 64.5° | 180.0° |
| H23 | C23 | C24 | H24A | 175.4° | 60.1° |
| H23A | C23 | C19 | H19 | 166.0° | 175.0° |
| H23A | C23 | C24 | H24 | 57.4° | 60.0° |
| H23A | C23 | C24 | H24A | 62.7° | 179.9° |
| H29 | C29 | H29A | H29B | 120.0° | 120.0° |
| H16 | C16 | C17 | H17 | 0.6° | 0.0° |
| HN18 | N18 | C19 | H19 | 100.6° | 145.0° |
| H24 | C24 | O25 | HO25 | 146.9° | 59.9° |
| H24A | C24 | O25 | HO25 | 93.0° | 60.0° |
