4YR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O11 | C8 | doub | 1.22Å | 1.36Å | |
| N9 | C8 | sing | 1.35Å | 1.34Å | |
| N9 | C10 | sing | 1.34Å | 1.34Å | |
| C8 | C2 | sing | 1.47Å | 1.40Å | |
| O12 | C10 | doub | 1.22Å | 1.35Å | |
| C10 | N7 | sing | 1.34Å | 1.36Å | |
| C2 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
| C2 | C1 | sing | 1.41Å | 1.41Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| N7 | C1 | sing | 1.39Å | 1.37Å | |
| N7 | C13 | sing | 1.46Å | 1.51Å | |
| C1 | C6 | doub | 1.39Å | 1.41Å | Aromatic |
| C4 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | C17 | sing | 1.51Å | 1.37Å | |
| C6 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.40Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | doub | 1.40Å | 1.39Å | Aromatic |
| C28 | C24 | sing | 1.55Å | 1.53Å | |
| C28 | N27 | sing | 1.48Å | 1.45Å | |
| C24 | N22 | sing | 1.46Å | 1.46Å | |
| C24 | C25 | sing | 1.55Å | 1.52Å | |
| C45 | N27 | sing | 1.47Å | 1.49Å | |
| C45 | C48 | sing | 1.53Å | 1.50Å | |
| N22 | C21 | sing | 1.35Å | 1.33Å | |
| C16 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| N27 | C26 | sing | 1.47Å | 1.47Å | |
| C19 | C21 | sing | 1.48Å | 1.38Å | |
| C19 | C14 | sing | 1.40Å | 1.40Å | Aromatic |
| C21 | O23 | doub | 1.22Å | 1.36Å | |
| C50 | C48 | sing | 1.53Å | 1.52Å | |
| C50 | C49 | sing | 1.53Å | 1.52Å | |
| C48 | C49 | sing | 1.53Å | 1.53Å | |
| C15 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.54Å | 1.49Å | |
| C14 | F20 | sing | 1.35Å | 1.36Å | |
| C49 | H1 | sing | 1.09Å | 1.10Å | |
| C49 | H2 | sing | 1.09Å | 1.10Å | |
| C50 | H3 | sing | 1.09Å | 1.10Å | |
| C50 | H4 | sing | 1.09Å | 1.10Å | |
| C48 | H5 | sing | 1.09Å | 1.10Å | |
| C45 | H6 | sing | 1.09Å | 1.10Å | |
| C45 | H7 | sing | 1.09Å | 1.10Å | |
| C28 | H9 | sing | 1.09Å | 1.10Å | |
| C28 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| N22 | H16 | sing | 0.97Å | 1.00Å | |
| C18 | H17 | sing | 1.08Å | 1.08Å | |
| C15 | H18 | sing | 1.08Å | 1.08Å | |
| C16 | H19 | sing | 1.08Å | 1.08Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.09Å | 1.10Å | |
| C6 | H22 | sing | 1.08Å | 1.08Å | |
| C5 | H23 | sing | 1.08Å | 1.08Å | |
| C4 | H24 | sing | 1.08Å | 1.08Å | |
| C3 | H25 | sing | 1.08Å | 1.08Å | |
| N9 | H26 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O11 | C8 | N9 | 120.8° | 120.9° |
| O11 | C8 | C2 | 118.7° | 120.9° |
| C8 | N9 | C10 | 120.9° | 121.2° |
| N9 | C8 | C2 | 120.6° | 118.3° |
| C8 | N9 | H26 | 119.6° | 119.4° |
| N9 | C10 | O12 | 116.7° | 118.5° |
| N9 | C10 | N7 | 121.7° | 122.9° |
| C10 | N9 | H26 | 119.5° | 119.4° |
| C8 | C2 | C3 | 121.2° | 121.7° |
| C8 | C2 | C1 | 117.9° | 118.2° |
| O12 | C10 | N7 | 121.6° | 118.6° |
| C10 | N7 | C1 | 119.4° | 120.6° |
| C10 | N7 | C13 | 119.6° | 119.7° |
| C3 | C2 | C1 | 120.9° | 120.1° |
| C2 | C3 | C4 | 120.4° | 119.5° |
| C2 | C3 | H25 | 119.8° | 120.3° |
| C2 | C1 | N7 | 119.5° | 118.8° |
| C2 | C1 | C6 | 117.3° | 119.6° |
| C3 | C4 | C5 | 119.2° | 120.4° |
| C3 | C4 | H24 | 120.4° | 119.8° |
| C4 | C3 | H25 | 119.8° | 120.2° |
| C1 | N7 | C13 | 121.0° | 119.7° |
| N7 | C1 | C6 | 123.2° | 121.6° |
| N7 | C13 | C17 | 113.7° | 109.4° |
| N7 | C13 | H20 | 108.4° | 109.5° |
| N7 | C13 | H21 | 108.4° | 109.5° |
| C1 | C6 | C5 | 121.3° | 119.8° |
| C1 | C6 | H22 | 119.3° | 120.1° |
| C4 | C5 | C6 | 120.8° | 120.6° |
| C4 | C5 | H23 | 119.6° | 119.7° |
| C5 | C4 | H24 | 120.4° | 119.8° |
| C13 | C17 | C18 | 123.3° | 119.9° |
| C13 | C17 | C16 | 118.5° | 119.9° |
| C17 | C13 | H20 | 108.4° | 109.5° |
| C17 | C13 | H21 | 108.4° | 109.5° |
| C5 | C6 | H22 | 119.4° | 120.1° |
| C6 | C5 | H23 | 119.6° | 119.7° |
| C18 | C17 | C16 | 118.2° | 120.2° |
| C17 | C18 | C19 | 120.7° | 119.9° |
| C17 | C18 | H17 | 119.6° | 120.0° |
| C17 | C16 | C15 | 120.9° | 120.4° |
| C17 | C16 | H19 | 119.6° | 119.9° |
| C18 | C19 | C21 | 116.0° | 120.2° |
| C18 | C19 | C14 | 121.0° | 119.7° |
| C19 | C18 | H17 | 119.6° | 120.1° |
| C24 | C28 | N27 | 97.7° | 104.8° |
| C28 | C24 | N22 | 108.0° | 111.0° |
| C28 | C24 | C25 | 107.3° | 101.7° |
| C24 | C28 | H9 | 112.3° | 110.4° |
| C24 | C28 | H10 | 112.3° | 110.4° |
| C28 | C24 | H15 | 110.1° | 111.0° |
| C28 | N27 | C45 | 107.2° | 111.0° |
| C28 | N27 | C26 | 103.0° | 108.6° |
| N27 | C28 | H9 | 112.3° | 110.3° |
| N27 | C28 | H10 | 112.3° | 110.4° |
| N22 | C24 | C25 | 110.1° | 111.0° |
| C24 | N22 | C21 | 123.2° | 120.0° |
| N22 | C24 | H15 | 111.1° | 110.9° |
| C24 | N22 | H16 | 118.4° | 120.1° |
| C24 | C25 | C26 | 101.3° | 103.0° |
| C24 | C25 | H13 | 111.5° | 110.7° |
| C24 | C25 | H14 | 111.5° | 110.8° |
| C25 | C24 | H15 | 110.2° | 111.0° |
| N27 | C45 | C48 | 108.9° | 109.5° |
| C45 | N27 | C26 | 108.9° | 111.0° |
| N27 | C45 | H6 | 109.6° | 109.5° |
| N27 | C45 | H7 | 109.7° | 109.5° |
| C45 | C48 | C50 | 116.1° | 117.5° |
| C45 | C48 | C49 | 116.3° | 117.5° |
| C45 | C48 | H5 | 117.6° | 115.6° |
| C48 | C45 | H6 | 109.6° | 109.5° |
| C48 | C45 | H7 | 109.6° | 109.5° |
| N22 | C21 | C19 | 114.2° | 120.0° |
| N22 | C21 | O23 | 126.6° | 120.0° |
| C21 | N22 | H16 | 118.4° | 120.0° |
| C16 | C15 | C14 | 120.4° | 120.1° |
| C16 | C15 | H18 | 119.8° | 119.9° |
| C15 | C16 | H19 | 119.5° | 119.8° |
| N27 | C26 | C25 | 99.6° | 107.3° |
| N27 | C26 | H11 | 111.9° | 109.9° |
| N27 | C26 | H12 | 111.9° | 109.9° |
| C21 | C19 | C14 | 123.0° | 120.2° |
| C19 | C21 | O23 | 118.8° | 120.0° |
| C19 | C14 | C15 | 118.7° | 119.8° |
| C19 | C14 | F20 | 121.3° | 120.1° |
| C48 | C50 | C49 | 60.3° | 60.0° |
| C50 | C48 | C49 | 59.8° | 60.0° |
| C48 | C50 | H3 | 120.0° | 117.5° |
| C48 | C50 | H4 | 119.9° | 117.5° |
| C50 | C48 | H5 | 117.2° | 117.5° |
| C50 | C49 | C48 | 59.9° | 60.0° |
| C50 | C49 | H1 | 120.0° | 117.5° |
| C50 | C49 | H2 | 120.0° | 117.5° |
| C49 | C50 | H3 | 120.0° | 117.5° |
| C49 | C50 | H4 | 120.0° | 117.5° |
| C48 | C49 | H1 | 120.0° | 117.5° |
| C48 | C49 | H2 | 120.0° | 117.5° |
| C49 | C48 | H5 | 117.1° | 117.5° |
| C15 | C14 | F20 | 119.9° | 120.1° |
| C14 | C15 | H18 | 119.8° | 120.0° |
| C25 | C26 | H11 | 111.9° | 109.9° |
| C25 | C26 | H12 | 111.9° | 110.1° |
| C26 | C25 | H13 | 111.5° | 110.8° |
| C26 | C25 | H14 | 111.5° | 110.7° |
| H1 | C49 | H2 | 109.4° | 115.6° |
| H3 | C50 | H4 | 109.5° | 115.6° |
| H6 | C45 | H7 | 109.4° | 109.5° |
| H9 | C28 | H10 | 109.4° | 110.5° |
| H11 | C26 | H12 | 109.5° | 109.8° |
| H13 | C25 | H14 | 109.5° | 110.6° |
| H20 | C13 | H21 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O11 | C8 | N9 | C2 | 179.8° | 179.9° |
| O11 | C8 | N9 | C10 | 179.7° | 179.7° |
| O11 | C8 | C2 | C3 | 0.3° | 0.1° |
| O11 | C8 | C2 | C1 | 180.0° | 180.0° |
| O11 | C8 | N9 | H26 | 0.4° | 0.1° |
| C8 | N9 | C10 | H26 | 180.0° | 179.8° |
| C8 | N9 | C10 | O12 | 179.8° | 180.0° |
| C8 | N9 | C10 | N7 | 0.7° | 0.6° |
| N9 | C8 | C2 | C3 | 179.6° | 180.0° |
| N9 | C8 | C2 | C1 | 0.1° | 0.1° |
| C10 | N9 | C8 | C2 | 0.5° | 0.2° |
| N9 | C10 | O12 | N7 | 179.6° | 179.4° |
| N9 | C10 | N7 | C1 | 0.4° | 0.6° |
| N9 | C10 | N7 | C13 | 179.6° | 179.8° |
| C8 | C2 | C3 | C1 | 179.7° | 179.9° |
| C8 | C2 | C3 | C4 | 179.9° | 179.9° |
| C8 | C2 | C1 | N7 | 0.1° | 0.0° |
| C8 | C2 | C1 | C6 | 179.9° | 179.9° |
| C8 | C2 | C3 | H25 | 0.2° | 0.0° |
| C2 | C8 | N9 | H26 | 179.5° | 180.0° |
| O12 | C10 | N7 | C1 | 180.0° | 180.0° |
| O12 | C10 | N7 | C13 | 0.9° | 0.4° |
| O12 | C10 | N9 | H26 | 0.3° | 0.2° |
| C10 | N7 | C1 | C2 | 0.0° | 0.3° |
| C10 | N7 | C1 | C13 | 179.2° | 179.6° |
| C10 | N7 | C1 | C6 | 179.7° | 179.7° |
| C10 | N7 | C13 | C17 | 93.2° | 90.3° |
| C10 | N7 | C13 | H20 | 27.5° | 149.7° |
| C10 | N7 | C13 | H21 | 146.2° | 29.6° |
| N7 | C10 | N9 | H26 | 179.3° | 179.7° |
| C2 | C3 | C4 | H25 | 180.0° | 180.0° |
| C3 | C2 | C1 | N7 | 179.8° | 179.9° |
| C3 | C2 | C1 | C6 | 0.4° | 0.0° |
| C2 | C3 | C4 | C5 | 0.2° | 0.0° |
| C2 | C3 | C4 | H24 | 179.8° | 180.0° |
| C1 | C2 | C3 | C4 | 0.2° | 0.0° |
| C2 | C1 | N7 | C6 | 179.7° | 180.0° |
| C2 | C1 | N7 | C13 | 179.2° | 179.9° |
| C2 | C1 | C6 | C5 | 0.3° | 0.0° |
| C2 | C1 | C6 | H22 | 179.7° | 180.0° |
| C1 | C2 | C3 | H25 | 179.8° | 179.9° |
| C3 | C4 | C5 | H24 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.4° | 0.0° |
| C3 | C4 | C5 | H23 | 179.6° | 180.0° |
| C1 | N7 | C13 | C17 | 87.7° | 90.0° |
| N7 | C1 | C6 | C5 | 180.0° | 180.0° |
| C1 | N7 | C13 | H20 | 151.7° | 29.9° |
| C1 | N7 | C13 | H21 | 32.9° | 150.0° |
| N7 | C1 | C6 | H22 | 0.0° | 0.0° |
| C13 | N7 | C1 | C6 | 0.6° | 0.1° |
| N7 | C13 | C17 | H20 | 120.6° | 120.0° |
| N7 | C13 | C17 | H21 | 120.6° | 120.0° |
| N7 | C13 | C17 | C18 | 35.8° | 90.0° |
| N7 | C13 | C17 | C16 | 146.4° | 90.0° |
| N7 | C13 | H20 | H21 | 118.1° | 120.0° |
| C1 | C6 | C5 | C4 | 0.2° | 0.0° |
| C1 | C6 | C5 | H22 | 180.0° | 180.0° |
| C1 | C6 | C5 | H23 | 179.8° | 180.0° |
| C4 | C5 | C6 | H23 | 180.0° | 179.9° |
| C4 | C5 | C6 | H22 | 179.8° | 180.0° |
| C5 | C4 | C3 | H25 | 179.7° | 180.0° |
| C13 | C17 | C18 | C16 | 177.8° | 180.0° |
| C13 | C17 | C18 | C19 | 179.7° | 180.0° |
| C13 | C17 | C16 | C15 | 179.1° | 179.8° |
| C13 | C17 | C18 | H17 | 0.3° | 0.0° |
| C13 | C17 | C16 | H19 | 0.9° | 0.0° |
| C17 | C13 | H20 | H21 | 118.1° | 120.0° |
| C6 | C5 | C4 | H24 | 179.6° | 180.0° |
| C17 | C18 | C19 | H17 | 180.0° | 180.0° |
| C18 | C17 | C16 | C15 | 1.2° | 0.2° |
| C17 | C18 | C19 | C21 | 179.7° | 180.0° |
| C17 | C18 | C19 | C14 | 2.4° | 0.2° |
| C18 | C17 | C16 | H19 | 178.8° | 180.0° |
| C18 | C17 | C13 | H20 | 84.8° | 150.0° |
| C18 | C17 | C13 | H21 | 156.4° | 30.0° |
| C16 | C17 | C18 | C19 | 1.9° | 0.0° |
| C17 | C16 | C15 | H19 | 180.0° | 179.8° |
| C17 | C16 | C15 | C14 | 0.9° | 0.2° |
| C16 | C17 | C18 | H17 | 178.1° | 180.0° |
| C17 | C16 | C15 | H18 | 179.1° | 179.7° |
| C16 | C17 | C13 | H20 | 93.0° | 30.0° |
| C16 | C17 | C13 | H21 | 25.8° | 150.0° |
| C18 | C19 | C21 | N22 | 93.9° | 0.2° |
| C18 | C19 | C21 | C14 | 177.2° | 179.8° |
| C18 | C19 | C21 | O23 | 79.4° | 179.7° |
| C18 | C19 | C14 | C15 | 2.1° | 0.2° |
| C18 | C19 | C14 | F20 | 179.3° | 179.7° |
| C24 | C28 | N27 | H9 | 118.1° | 118.8° |
| C24 | C28 | N27 | H10 | 118.1° | 118.8° |
| C28 | C24 | N22 | C25 | 116.8° | 112.3° |
| C28 | C24 | N22 | H15 | 120.8° | 123.8° |
| C28 | C24 | C25 | H15 | 119.9° | 118.1° |
| C24 | C28 | N27 | C45 | 163.6° | 146.4° |
| C28 | C24 | N22 | C21 | 167.6° | 155.0° |
| C24 | C28 | N27 | C26 | 48.8° | 24.1° |
| C28 | C24 | C25 | C26 | 9.2° | 35.6° |
| C24 | C28 | H9 | H10 | 125.5° | 122.4° |
| C28 | C24 | C25 | H13 | 127.8° | 154.1° |
| C28 | C24 | C25 | H14 | 109.5° | 82.8° |
| C28 | C24 | N22 | H16 | 12.4° | 25.0° |
| N27 | C28 | C24 | N22 | 142.1° | 155.1° |
| N27 | C28 | C24 | C25 | 23.5° | 37.0° |
| C28 | N27 | C45 | C26 | 110.8° | 120.9° |
| C28 | N27 | C45 | C48 | 168.0° | 169.3° |
| C28 | N27 | C26 | C25 | 57.0° | 1.0° |
| C28 | N27 | C45 | H6 | 48.1° | 70.8° |
| C28 | N27 | C45 | H7 | 72.0° | 49.2° |
| N27 | C28 | H9 | H10 | 125.5° | 122.3° |
| C28 | N27 | C26 | H11 | 175.4° | 120.4° |
| C28 | N27 | C26 | H12 | 61.4° | 118.7° |
| N27 | C28 | C24 | H15 | 96.5° | 81.1° |
| N22 | C24 | C25 | H15 | 122.8° | 123.8° |
| C24 | N22 | C21 | H16 | 180.0° | 180.0° |
| C24 | N22 | C21 | C19 | 176.0° | 180.0° |
| C24 | N22 | C21 | O23 | 3.4° | 0.0° |
| N22 | C24 | C25 | C26 | 108.1° | 153.7° |
| N22 | C24 | C28 | H9 | 99.9° | 36.4° |
| N22 | C24 | C28 | H10 | 24.0° | 86.1° |
| N22 | C24 | C25 | H13 | 10.6° | 87.9° |
| N22 | C24 | C25 | H14 | 133.2° | 35.3° |
| C25 | C24 | N22 | C21 | 75.6° | 92.8° |
| C24 | C25 | C26 | N27 | 38.0° | 22.3° |
| C24 | C25 | C26 | H13 | 118.6° | 118.4° |
| C24 | C25 | C26 | H14 | 118.6° | 118.5° |
| C25 | C24 | C28 | H9 | 141.5° | 81.7° |
| C25 | C24 | C28 | H10 | 94.6° | 155.9° |
| C24 | C25 | C26 | H11 | 156.3° | 97.2° |
| C24 | C25 | C26 | H12 | 80.4° | 141.8° |
| C24 | C25 | H13 | H14 | 123.8° | 123.3° |
| C25 | C24 | N22 | H16 | 104.4° | 87.3° |
| N27 | C45 | C48 | H6 | 119.9° | 120.0° |
| N27 | C45 | C48 | H7 | 119.9° | 120.1° |
| N27 | C45 | C48 | C50 | 169.3° | 175.0° |
| N27 | C45 | C48 | C49 | 123.2° | 116.4° |
| C45 | N27 | C26 | C25 | 170.6° | 123.3° |
| N27 | C45 | C48 | H5 | 23.1° | 29.3° |
| N27 | C45 | H6 | H7 | 120.3° | 120.1° |
| C45 | N27 | C28 | H9 | 78.4° | 27.6° |
| C45 | N27 | C28 | H10 | 45.5° | 94.8° |
| C45 | N27 | C26 | H11 | 71.1° | 117.3° |
| C45 | N27 | C26 | H12 | 52.2° | 3.6° |
| C48 | C45 | N27 | C26 | 81.2° | 69.9° |
| C45 | C48 | C50 | C49 | 106.7° | 107.5° |
| C45 | C48 | C50 | H5 | 146.3° | 145.1° |
| C45 | C48 | C49 | H5 | 146.6° | 145.0° |
| C45 | C48 | C49 | H1 | 144.3° | 145.0° |
| C45 | C48 | C49 | H2 | 3.2° | 0.0° |
| C45 | C48 | C50 | H3 | 143.8° | 0.0° |
| C45 | C48 | C50 | H4 | 2.9° | 145.0° |
| C48 | C45 | H6 | H7 | 120.3° | 120.0° |
| N22 | C21 | C19 | O23 | 173.3° | 180.0° |
| N22 | C21 | C19 | C14 | 83.3° | 179.9° |
| C21 | N22 | C24 | H15 | 46.7° | 31.2° |
| C16 | C15 | C14 | C19 | 1.4° | 0.0° |
| C16 | C15 | C14 | H18 | 180.0° | 180.0° |
| C16 | C15 | C14 | F20 | 180.0° | 180.0° |
| N27 | C26 | C25 | H11 | 118.3° | 119.4° |
| N27 | C26 | C25 | H12 | 118.4° | 119.6° |
| C26 | N27 | C45 | H6 | 158.9° | 50.1° |
| C26 | N27 | C45 | H7 | 38.7° | 170.1° |
| C26 | N27 | C28 | H9 | 166.9° | 94.8° |
| C26 | N27 | C28 | H10 | 69.3° | 142.9° |
| N27 | C26 | H11 | H12 | 124.6° | 121.0° |
| N27 | C26 | C25 | H13 | 156.6° | 140.7° |
| N27 | C26 | C25 | H14 | 80.7° | 96.2° |
| C21 | C19 | C14 | C15 | 179.2° | 180.0° |
| C21 | C19 | C14 | F20 | 2.2° | 0.1° |
| C19 | C21 | N22 | H16 | 4.0° | 0.0° |
| C21 | C19 | C18 | H17 | 0.3° | 0.0° |
| C14 | C19 | C21 | O23 | 103.4° | 0.1° |
| C19 | C14 | C15 | F20 | 178.6° | 180.0° |
| C14 | C19 | C18 | H17 | 177.6° | 179.8° |
| C19 | C14 | C15 | H18 | 178.6° | 180.0° |
| O23 | C21 | N22 | H16 | 176.6° | 180.0° |
| C48 | C50 | C49 | H3 | 109.6° | 107.5° |
| C48 | C50 | C49 | H4 | 109.5° | 107.5° |
| C50 | C48 | C49 | H5 | 107.2° | 107.5° |
| C48 | C50 | C49 | H1 | 109.5° | 107.5° |
| C48 | C50 | C49 | H2 | 109.5° | 107.5° |
| C48 | C50 | H3 | H4 | 144.6° | 145.7° |
| C50 | C48 | C45 | H6 | 49.3° | 65.0° |
| C50 | C48 | C45 | H7 | 70.8° | 55.0° |
| C50 | C49 | H1 | H2 | 144.8° | 145.7° |
| C49 | C50 | H3 | H4 | 144.6° | 145.7° |
| C48 | C49 | H1 | H2 | 144.8° | 145.7° |
| C49 | C48 | C45 | H6 | 116.8° | 3.6° |
| C49 | C48 | C45 | H7 | 3.3° | 123.6° |
| C14 | C15 | C16 | H19 | 179.1° | 180.0° |
| C25 | C26 | H11 | H12 | 124.6° | 121.2° |
| C26 | C25 | H13 | H14 | 123.9° | 123.1° |
| C26 | C25 | C24 | H15 | 129.1° | 82.5° |
| F20 | C14 | C15 | H18 | 0.0° | 0.0° |
| H1 | C49 | C50 | H3 | 0.1° | 145.0° |
| H1 | C49 | C50 | H4 | 141.0° | 0.0° |
| H1 | C49 | C48 | H5 | 2.3° | 0.0° |
| H2 | C49 | C50 | H3 | 141.0° | 0.0° |
| H2 | C49 | C50 | H4 | 0.0° | 145.0° |
| H2 | C49 | C48 | H5 | 143.3° | 145.0° |
| H3 | C50 | C48 | H5 | 2.5° | 145.0° |
| H4 | C50 | C48 | H5 | 143.4° | 0.0° |
| H5 | C48 | C45 | H6 | 96.8° | 149.3° |
| H5 | C48 | C45 | H7 | 143.1° | 90.7° |
| H9 | C28 | C24 | H15 | 21.5° | 160.1° |
| H10 | C28 | C24 | H15 | 145.4° | 37.7° |
| H11 | C26 | C25 | H13 | 85.0° | 21.3° |
| H11 | C26 | C25 | H14 | 37.7° | 144.3° |
| H12 | C26 | C25 | H13 | 38.2° | 99.8° |
| H12 | C26 | C25 | H14 | 160.9° | 23.3° |
| H13 | C25 | C24 | H15 | 112.3° | 36.0° |
| H14 | C25 | C24 | H15 | 10.4° | 159.1° |
| H15 | C24 | N22 | H16 | 133.2° | 148.8° |
| H18 | C15 | C16 | H19 | 0.9° | 0.0° |
| H22 | C6 | C5 | H23 | 0.2° | 0.0° |
| H23 | C5 | C4 | H24 | 0.4° | 0.1° |
| H24 | C4 | C3 | H25 | 0.3° | 0.1° |
