FP4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N2 | C1 | doub | 1.32Å | 1.35Å | Aromatic |
| C1 | C6 | sing | 1.37Å | 1.41Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | N2 | sing | 1.32Å | 1.35Å | Aromatic |
| C3 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| O7 | C4 | sing | 1.35Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.41Å | 1.37Å | Aromatic |
| C5 | C6 | doub | 1.40Å | 1.38Å | Aromatic |
| C5 | C9 | sing | 1.46Å | 1.50Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| O7 | C8 | sing | 1.35Å | 1.35Å | Aromatic |
| C8 | C10 | sing | 1.47Å | 1.50Å | Aromatic |
| C8 | C9 | doub | 1.36Å | 1.35Å | Aromatic |
| C9 | N16 | sing | 1.39Å | 1.31Å | |
| N15 | C10 | doub | 1.33Å | 1.35Å | Aromatic |
| C10 | N11 | sing | 1.33Å | 1.35Å | Aromatic |
| N11 | C12 | doub | 1.32Å | 1.35Å | Aromatic |
| C13 | C12 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C14 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| N15 | C14 | sing | 1.32Å | 1.35Å | Aromatic |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| N16 | C17 | sing | 1.39Å | 1.35Å | |
| N16 | HN16 | sing | 0.97Å | 1.00Å | |
| C18 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C22 | sing | 1.41Å | 1.38Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.41Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | C20 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | C21 | sing | 1.39Å | 1.38Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C22 | C21 | doub | 1.41Å | 1.35Å | Aromatic |
| C21 | N23 | sing | 1.37Å | 1.34Å | Aromatic |
| C22 | C25 | sing | 1.41Å | 1.49Å | Aromatic |
| N23 | N24 | sing | 1.40Å | 1.36Å | Aromatic |
| C25 | N24 | doub | 1.30Å | 1.28Å | Aromatic |
| C25 | C26 | sing | 1.51Å | 1.50Å | |
| C26 | C27 | sing | 1.53Å | 1.55Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C27 | C28 | sing | 1.53Å | 1.55Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| O29 | C28 | sing | 1.43Å | 1.44Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| O29 | HO29 | sing | 0.97Å | 0.95Å | |
| N23 | HN23 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C1 | C6 | 120.1° | 121.2° |
| N2 | C1 | H1 | 119.9° | 119.4° |
| C1 | N2 | C3 | 121.5° | 122.6° |
| C6 | C1 | H1 | 119.9° | 119.4° |
| C1 | C6 | C5 | 118.5° | 118.7° |
| C1 | C6 | H6 | 120.7° | 120.7° |
| N2 | C3 | C4 | 119.3° | 120.4° |
| N2 | C3 | H3 | 120.3° | 119.8° |
| C4 | C3 | H3 | 120.4° | 119.8° |
| C3 | C4 | O7 | 123.0° | 134.1° |
| C3 | C4 | C5 | 120.8° | 118.3° |
| O7 | C4 | C5 | 116.2° | 107.6° |
| C4 | O7 | C8 | 100.0° | 111.0° |
| C4 | C5 | C6 | 119.8° | 118.9° |
| C4 | C5 | C9 | 102.8° | 105.8° |
| C6 | C5 | C9 | 137.4° | 135.3° |
| C5 | C6 | H6 | 120.8° | 120.7° |
| C5 | C9 | C8 | 102.5° | 105.9° |
| C5 | C9 | N16 | 130.6° | 127.1° |
| O7 | C8 | C10 | 119.7° | 125.2° |
| O7 | C8 | C9 | 118.5° | 109.7° |
| C10 | C8 | C9 | 121.7° | 125.2° |
| C8 | C10 | N15 | 119.3° | 119.2° |
| C8 | C10 | N11 | 120.1° | 119.3° |
| C8 | C9 | N16 | 126.9° | 127.0° |
| C9 | N16 | C17 | 126.2° | 120.0° |
| C9 | N16 | HN16 | 116.9° | 120.0° |
| N15 | C10 | N11 | 120.6° | 121.5° |
| C10 | N15 | C14 | 120.7° | 120.7° |
| C10 | N11 | C12 | 121.3° | 120.7° |
| N11 | C12 | C13 | 119.1° | 119.3° |
| N11 | C12 | H12 | 120.5° | 120.3° |
| C13 | C12 | H12 | 120.5° | 120.4° |
| C12 | C13 | C14 | 118.8° | 118.6° |
| C12 | C13 | H13 | 120.6° | 120.7° |
| C14 | C13 | H13 | 120.6° | 120.7° |
| C13 | C14 | N15 | 119.4° | 119.3° |
| C13 | C14 | H14 | 120.3° | 120.4° |
| N15 | C14 | H14 | 120.3° | 120.3° |
| C17 | N16 | HN16 | 116.9° | 120.0° |
| N16 | C17 | C18 | 123.6° | 120.2° |
| N16 | C17 | C22 | 118.4° | 120.2° |
| C18 | C17 | C22 | 117.9° | 119.6° |
| C17 | C18 | C19 | 119.6° | 120.5° |
| C17 | C18 | H18 | 120.2° | 119.8° |
| C17 | C22 | C21 | 122.8° | 119.5° |
| C17 | C22 | C25 | 134.6° | 133.6° |
| C19 | C18 | H18 | 120.2° | 119.8° |
| C18 | C19 | C20 | 120.4° | 120.7° |
| C18 | C19 | H19 | 119.8° | 119.7° |
| C20 | C19 | H19 | 119.8° | 119.6° |
| C19 | C20 | C21 | 118.2° | 120.0° |
| C19 | C20 | H20 | 120.9° | 120.0° |
| C21 | C20 | H20 | 120.9° | 120.0° |
| C20 | C21 | C22 | 121.1° | 119.7° |
| C20 | C21 | N23 | 127.3° | 133.7° |
| C22 | C21 | N23 | 111.6° | 106.6° |
| C21 | C22 | C25 | 102.7° | 106.9° |
| C21 | N23 | N24 | 106.8° | 108.1° |
| C21 | N23 | HN23 | 126.6° | 125.9° |
| C22 | C25 | N24 | 107.6° | 108.7° |
| C22 | C25 | C26 | 127.1° | 125.6° |
| N23 | N24 | C25 | 111.3° | 109.7° |
| N24 | N23 | HN23 | 126.6° | 126.0° |
| N24 | C25 | C26 | 125.3° | 125.7° |
| C25 | C26 | C27 | 112.1° | 109.5° |
| C25 | C26 | H26 | 108.6° | 109.4° |
| C25 | C26 | H26A | 108.6° | 109.5° |
| C27 | C26 | H26 | 108.6° | 109.5° |
| C27 | C26 | H26A | 108.6° | 109.5° |
| C26 | C27 | C28 | 111.6° | 109.5° |
| C26 | C27 | H27 | 108.8° | 109.4° |
| C26 | C27 | H27A | 108.8° | 109.5° |
| H26 | C26 | H26A | 110.3° | 109.5° |
| C28 | C27 | H27 | 108.8° | 109.5° |
| C28 | C27 | H27A | 108.8° | 109.5° |
| C27 | C28 | O29 | 109.7° | 109.5° |
| C27 | C28 | H28 | 109.4° | 109.5° |
| C27 | C28 | H28A | 109.4° | 109.5° |
| H27 | C27 | H27A | 110.1° | 109.5° |
| O29 | C28 | H28 | 109.4° | 109.5° |
| O29 | C28 | H28A | 109.4° | 109.5° |
| C28 | O29 | HO29 | 109.5° | 114.0° |
| H28 | C28 | H28A | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C1 | C6 | H1 | 180.0° | 179.8° |
| C1 | N2 | C3 | C4 | 0.1° | 0.0° |
| C1 | N2 | C3 | H3 | 179.9° | 180.0° |
| N2 | C1 | C6 | C5 | 0.0° | 0.1° |
| N2 | C1 | C6 | H6 | 180.0° | 179.7° |
| C6 | C1 | N2 | C3 | 0.2° | 0.0° |
| C1 | C6 | C5 | C4 | 0.1° | 0.1° |
| C1 | C6 | C5 | H6 | 180.0° | 179.8° |
| C1 | C6 | C5 | C9 | 179.9° | 180.0° |
| H1 | C1 | N2 | C3 | 179.8° | 179.8° |
| H1 | C1 | C6 | C5 | 180.0° | 179.8° |
| H1 | C1 | C6 | H6 | 0.0° | 0.0° |
| N2 | C3 | C4 | H3 | 180.0° | 179.9° |
| N2 | C3 | C4 | O7 | 179.9° | 180.0° |
| N2 | C3 | C4 | C5 | 0.0° | 0.0° |
| C3 | C4 | O7 | C5 | 179.9° | 180.0° |
| C3 | C4 | C5 | C6 | 0.2° | 0.1° |
| C3 | C4 | C5 | C9 | 179.9° | 180.0° |
| C3 | C4 | O7 | C8 | 179.8° | 180.0° |
| H3 | C3 | C4 | O7 | 0.1° | 0.0° |
| H3 | C3 | C4 | C5 | 179.9° | 179.9° |
| O7 | C4 | C5 | C6 | 180.0° | 179.9° |
| O7 | C4 | C5 | C9 | 0.0° | 0.0° |
| C4 | O7 | C8 | C10 | 179.4° | 180.0° |
| C4 | O7 | C8 | C9 | 0.1° | 0.0° |
| C4 | C5 | C6 | C9 | 180.0° | 179.8° |
| C4 | C5 | C6 | H6 | 179.9° | 179.7° |
| C5 | C4 | O7 | C8 | 0.0° | 0.0° |
| C4 | C5 | C9 | C8 | 0.0° | 0.1° |
| C4 | C5 | C9 | N16 | 179.9° | 180.0° |
| C6 | C5 | C9 | C8 | 180.0° | 179.9° |
| C6 | C5 | C9 | N16 | 0.1° | 0.1° |
| C9 | C5 | C6 | H6 | 0.1° | 0.2° |
| C5 | C9 | C8 | O7 | 0.1° | 0.1° |
| C5 | C9 | C8 | C10 | 179.4° | 180.0° |
| C5 | C9 | C8 | N16 | 179.9° | 180.0° |
| C5 | C9 | N16 | C17 | 0.4° | 22.2° |
| C5 | C9 | N16 | HN16 | 179.6° | 157.7° |
| O7 | C8 | C10 | C9 | 179.4° | 180.0° |
| O7 | C8 | C9 | N16 | 180.0° | 180.0° |
| O7 | C8 | C10 | N15 | 15.8° | 174.9° |
| O7 | C8 | C10 | N11 | 164.7° | 4.7° |
| C10 | C8 | C9 | N16 | 0.5° | 0.0° |
| C8 | C10 | N15 | N11 | 179.5° | 179.6° |
| C8 | C10 | N11 | C12 | 179.7° | 180.0° |
| C8 | C10 | N15 | C14 | 179.7° | 179.7° |
| C9 | C8 | C10 | N15 | 163.6° | 5.1° |
| C9 | C8 | C10 | N11 | 15.9° | 175.3° |
| C8 | C9 | N16 | C17 | 179.5° | 157.7° |
| C8 | C9 | N16 | HN16 | 0.5° | 22.3° |
| C9 | N16 | C17 | HN16 | 180.0° | 179.9° |
| C9 | N16 | C17 | C18 | 51.8° | 42.0° |
| C9 | N16 | C17 | C22 | 129.6° | 138.2° |
| N15 | C10 | N11 | C12 | 0.3° | 0.4° |
| C10 | N15 | C14 | C13 | 0.0° | 0.6° |
| C10 | N15 | C14 | H14 | 180.0° | 179.7° |
| C10 | N11 | C12 | C13 | 0.1° | 0.1° |
| C10 | N11 | C12 | H12 | 179.9° | 180.0° |
| N11 | C10 | N15 | C14 | 0.2° | 0.7° |
| N11 | C12 | C13 | H12 | 180.0° | 179.9° |
| N11 | C12 | C13 | C14 | 0.1° | 0.1° |
| N11 | C12 | C13 | H13 | 179.9° | 180.0° |
| C12 | C13 | C14 | H13 | 180.0° | 179.9° |
| C12 | C13 | C14 | N15 | 0.1° | 0.3° |
| C12 | C13 | C14 | H14 | 179.9° | 180.0° |
| H12 | C12 | C13 | C14 | 179.9° | 180.0° |
| H12 | C12 | C13 | H13 | 0.1° | 0.1° |
| C13 | C14 | N15 | H14 | 180.0° | 179.7° |
| H13 | C13 | C14 | N15 | 179.9° | 179.7° |
| H13 | C13 | C14 | H14 | 0.1° | 0.0° |
| N16 | C17 | C18 | C22 | 178.7° | 179.8° |
| N16 | C17 | C18 | C19 | 179.0° | 180.0° |
| N16 | C17 | C18 | H18 | 1.0° | 0.0° |
| N16 | C17 | C22 | C21 | 178.9° | 179.8° |
| N16 | C17 | C22 | C25 | 1.0° | 0.0° |
| HN16 | N16 | C17 | C18 | 128.2° | 138.0° |
| HN16 | N16 | C17 | C22 | 50.4° | 41.7° |
| C17 | C18 | C19 | H18 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.3° | 0.0° |
| C17 | C18 | C19 | H19 | 179.6° | 180.0° |
| C18 | C17 | C22 | C21 | 0.2° | 0.5° |
| C18 | C17 | C22 | C25 | 179.7° | 179.8° |
| C22 | C17 | C18 | C19 | 0.3° | 0.2° |
| C22 | C17 | C18 | H18 | 179.7° | 179.8° |
| C17 | C22 | C21 | C20 | 0.0° | 0.5° |
| C17 | C22 | C21 | C25 | 179.9° | 179.8° |
| C17 | C22 | C21 | N23 | 180.0° | 179.7° |
| C17 | C22 | C25 | N24 | 179.9° | 179.4° |
| C17 | C22 | C25 | C26 | 0.2° | 0.1° |
| C18 | C19 | C20 | H19 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.2° | 0.0° |
| C18 | C19 | C20 | H20 | 179.8° | 179.9° |
| H18 | C18 | C19 | C20 | 179.7° | 180.0° |
| H18 | C18 | C19 | H19 | 0.3° | 0.0° |
| C19 | C20 | C21 | H20 | 180.0° | 179.9° |
| C19 | C20 | C21 | C22 | 0.0° | 0.3° |
| C19 | C20 | C21 | N23 | 180.0° | 180.0° |
| H19 | C19 | C20 | C21 | 179.8° | 180.0° |
| H19 | C19 | C20 | H20 | 0.2° | 0.1° |
| C20 | C21 | C22 | N23 | 180.0° | 179.8° |
| C20 | C21 | C22 | C25 | 179.9° | 179.7° |
| C20 | C21 | N23 | N24 | 179.9° | 180.0° |
| C20 | C21 | N23 | HN23 | 0.2° | 0.1° |
| H20 | C20 | C21 | C22 | 180.0° | 179.8° |
| H20 | C20 | C21 | N23 | 0.0° | 0.1° |
| C22 | C21 | N23 | N24 | 0.1° | 0.2° |
| C21 | C22 | C25 | N24 | 0.0° | 0.4° |
| C21 | C22 | C25 | C26 | 179.9° | 179.8° |
| C22 | C21 | N23 | HN23 | 179.9° | 179.9° |
| N23 | C21 | C22 | C25 | 0.0° | 0.1° |
| C21 | N23 | N24 | HN23 | 180.0° | 179.9° |
| C21 | N23 | N24 | C25 | 0.1° | 0.5° |
| C22 | C25 | N24 | N23 | 0.1° | 0.5° |
| C22 | C25 | N24 | C26 | 180.0° | 179.5° |
| C22 | C25 | C26 | C27 | 167.0° | 87.0° |
| C22 | C25 | C26 | H26 | 46.9° | 153.0° |
| C22 | C25 | C26 | H26A | 73.0° | 33.0° |
| N23 | N24 | C25 | C26 | 179.8° | 180.0° |
| N24 | C25 | C26 | C27 | 13.1° | 92.4° |
| N24 | C25 | C26 | H26 | 133.1° | 27.6° |
| N24 | C25 | C26 | H26A | 106.9° | 147.6° |
| C25 | N24 | N23 | HN23 | 179.9° | 179.6° |
| C25 | C26 | C27 | H26 | 120.0° | 120.0° |
| C25 | C26 | C27 | H26A | 120.0° | 120.0° |
| C25 | C26 | H26 | H26A | 118.9° | 120.0° |
| C25 | C26 | C27 | C28 | 175.0° | 180.0° |
| C25 | C26 | C27 | H27 | 55.0° | 60.0° |
| C25 | C26 | C27 | H27A | 64.9° | 60.0° |
| C27 | C26 | H26 | H26A | 118.9° | 120.0° |
| C26 | C27 | C28 | H27 | 120.0° | 120.0° |
| C26 | C27 | C28 | H27A | 120.0° | 120.0° |
| C26 | C27 | H27 | H27A | 119.1° | 120.0° |
| C26 | C27 | C28 | O29 | 125.8° | 180.0° |
| C26 | C27 | C28 | H28 | 5.8° | 60.0° |
| C26 | C27 | C28 | H28A | 114.2° | 60.0° |
| H26 | C26 | C27 | C28 | 64.9° | 60.0° |
| H26 | C26 | C27 | H27 | 175.1° | 180.0° |
| H26 | C26 | C27 | H27A | 55.1° | 60.0° |
| H26A | C26 | C27 | C28 | 55.0° | 60.0° |
| H26A | C26 | C27 | H27 | 65.0° | 60.0° |
| H26A | C26 | C27 | H27A | 175.0° | 180.0° |
| C28 | C27 | H27 | H27A | 119.1° | 120.0° |
| C27 | C28 | O29 | H28 | 120.0° | 120.0° |
| C27 | C28 | O29 | H28A | 120.0° | 120.0° |
| C27 | C28 | H28 | H28A | 119.9° | 120.0° |
| C27 | C28 | O29 | HO29 | 180.0° | 180.0° |
| H27 | C27 | C28 | O29 | 114.2° | 60.0° |
| H27 | C27 | C28 | H28 | 125.8° | 180.0° |
| H27 | C27 | C28 | H28A | 5.8° | 60.0° |
| H27A | C27 | C28 | O29 | 5.8° | 60.0° |
| H27A | C27 | C28 | H28 | 114.2° | 60.0° |
| H27A | C27 | C28 | H28A | 125.8° | 180.0° |
| O29 | C28 | H28 | H28A | 119.9° | 120.0° |
| H28 | C28 | O29 | HO29 | 60.0° | 60.0° |
| H28A | C28 | O29 | HO29 | 60.0° | 60.0° |
