3EK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C7 | C1 | sing | 1.53Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C1 | C6 | sing | 1.53Å | 1.52Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C4 | C5 | sing | 1.53Å | 1.50Å | |
| C4 | C30 | sing | 1.51Å | 1.52Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | C5 | sing | 1.53Å | 1.51Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C7 | N8 | sing | 1.47Å | 1.46Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C12 | N8 | sing | 1.35Å | 1.36Å | Aromatic |
| N8 | N9 | sing | 1.40Å | 1.34Å | Aromatic |
| C10 | N9 | doub | 1.32Å | 1.34Å | Aromatic |
| N11 | C10 | sing | 1.34Å | 1.37Å | Aromatic |
| C10 | C13 | sing | 1.48Å | 1.45Å | Aromatic |
| C12 | N11 | doub | 1.31Å | 1.31Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C18 | C13 | doub | 1.40Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.40Å | 1.38Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 1.38Å | Aromatic |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C15 | N16 | sing | 1.32Å | 1.34Å | Aromatic |
| C15 | C19 | sing | 1.51Å | 1.49Å | |
| C17 | N16 | doub | 1.33Å | 1.34Å | Aromatic |
| C18 | C17 | sing | 1.39Å | 1.38Å | Aromatic |
| C17 | C20 | sing | 1.48Å | 1.48Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| O21 | C20 | doub | 1.22Å | 1.22Å | |
| C20 | N22 | sing | 1.35Å | 1.37Å | |
| N22 | C23 | sing | 1.46Å | 1.45Å | |
| N22 | HN22 | sing | 0.97Å | 1.00Å | |
| C23 | C24 | sing | 1.51Å | 1.50Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | C25 | doub | 1.38Å | 1.38Å | Aromatic |
| C24 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | C27 | doub | 1.39Å | 1.38Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C27 | F32 | sing | 1.35Å | 1.34Å | |
| C29 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C30 | O31 | doub | 1.21Å | 1.27Å | |
| C30 | O33 | sing | 1.34Å | 1.26Å | |
| O33 | HO33 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C7 | C1 | C2 | 112.8° | 109.5° |
| C7 | C1 | C6 | 112.9° | 109.5° |
| C7 | C1 | H1 | 105.6° | 109.5° |
| C1 | C7 | N8 | 113.1° | 109.4° |
| C1 | C7 | H7 | 108.3° | 109.5° |
| C1 | C7 | H7A | 108.3° | 109.5° |
| C2 | C1 | C6 | 112.2° | 109.5° |
| C2 | C1 | H1 | 106.4° | 109.5° |
| C1 | C2 | C3 | 112.6° | 109.5° |
| C1 | C2 | H2 | 108.5° | 109.5° |
| C1 | C2 | H2A | 108.5° | 109.5° |
| C6 | C1 | H1 | 106.2° | 109.5° |
| C1 | C6 | C5 | 111.8° | 109.5° |
| C1 | C6 | H6 | 108.7° | 109.5° |
| C1 | C6 | H6A | 108.7° | 109.4° |
| C3 | C2 | H2 | 108.4° | 109.4° |
| C3 | C2 | H2A | 108.4° | 109.5° |
| C2 | C3 | C4 | 109.6° | 109.5° |
| C2 | C3 | H3 | 109.4° | 109.5° |
| C2 | C3 | H3A | 109.4° | 109.5° |
| H2 | C2 | H2A | 110.5° | 109.5° |
| C4 | C3 | H3 | 109.5° | 109.5° |
| C4 | C3 | H3A | 109.5° | 109.5° |
| C3 | C4 | C5 | 108.6° | 109.5° |
| C3 | C4 | C30 | 108.0° | 109.4° |
| C3 | C4 | H4 | 108.7° | 109.5° |
| H3 | C3 | H3A | 109.5° | 109.4° |
| C5 | C4 | C30 | 101.2° | 109.5° |
| C5 | C4 | H4 | 114.8° | 109.5° |
| C4 | C5 | C6 | 106.7° | 109.5° |
| C4 | C5 | H5 | 110.4° | 109.4° |
| C4 | C5 | H5A | 110.4° | 109.5° |
| C30 | C4 | H4 | 115.3° | 109.4° |
| C4 | C30 | O31 | 113.3° | 120.1° |
| C4 | C30 | O33 | 117.5° | 120.0° |
| C6 | C5 | H5 | 110.4° | 109.5° |
| C6 | C5 | H5A | 110.4° | 109.5° |
| C5 | C6 | H6 | 108.7° | 109.5° |
| C5 | C6 | H6A | 108.7° | 109.5° |
| H5 | C5 | H5A | 108.5° | 109.5° |
| H6 | C6 | H6A | 110.2° | 109.5° |
| N8 | C7 | H7 | 108.3° | 109.5° |
| N8 | C7 | H7A | 108.3° | 109.4° |
| C7 | N8 | C12 | 125.9° | 126.7° |
| C7 | N8 | N9 | 122.5° | 126.8° |
| H7 | C7 | H7A | 110.6° | 109.5° |
| C12 | N8 | N9 | 111.6° | 106.5° |
| N8 | C12 | N11 | 108.6° | 108.3° |
| N8 | C12 | H12 | 125.7° | 125.9° |
| N8 | N9 | C10 | 101.9° | 106.7° |
| N9 | C10 | N11 | 114.0° | 108.7° |
| N9 | C10 | C13 | 122.8° | 125.6° |
| N11 | C10 | C13 | 123.2° | 125.7° |
| C10 | N11 | C12 | 104.0° | 109.8° |
| C10 | C13 | C18 | 122.1° | 120.9° |
| C10 | C13 | C14 | 119.7° | 120.8° |
| N11 | C12 | H12 | 125.7° | 125.8° |
| C18 | C13 | C14 | 118.2° | 118.2° |
| C13 | C18 | C17 | 118.3° | 119.0° |
| C13 | C18 | H18 | 120.8° | 120.5° |
| C13 | C14 | C15 | 119.0° | 119.2° |
| C13 | C14 | H14 | 120.5° | 120.4° |
| C15 | C14 | H14 | 120.5° | 120.3° |
| C14 | C15 | N16 | 124.2° | 121.0° |
| C14 | C15 | C19 | 119.5° | 119.5° |
| N16 | C15 | C19 | 116.3° | 119.5° |
| C15 | N16 | C17 | 115.7° | 122.0° |
| C15 | C19 | H19 | 109.5° | 109.5° |
| C15 | C19 | H19A | 109.5° | 109.5° |
| C15 | C19 | H19B | 109.5° | 109.4° |
| N16 | C17 | C18 | 124.6° | 120.6° |
| N16 | C17 | C20 | 116.3° | 119.7° |
| C18 | C17 | C20 | 119.1° | 119.7° |
| C17 | C18 | H18 | 120.8° | 120.5° |
| C17 | C20 | O21 | 120.3° | 120.0° |
| C17 | C20 | N22 | 115.6° | 120.0° |
| H19 | C19 | H19A | 109.4° | 109.5° |
| H19 | C19 | H19B | 109.5° | 109.6° |
| H19A | C19 | H19B | 109.5° | 109.5° |
| O21 | C20 | N22 | 124.0° | 120.0° |
| C20 | N22 | C23 | 120.0° | 120.0° |
| C20 | N22 | HN22 | 120.0° | 120.0° |
| C23 | N22 | HN22 | 120.0° | 120.0° |
| N22 | C23 | C24 | 115.8° | 109.5° |
| N22 | C23 | H23 | 107.4° | 109.5° |
| N22 | C23 | H23A | 107.4° | 109.5° |
| C24 | C23 | H23 | 107.4° | 109.4° |
| C24 | C23 | H23A | 107.4° | 109.5° |
| C23 | C24 | C25 | 119.2° | 120.0° |
| C23 | C24 | C29 | 121.7° | 120.0° |
| H23 | C23 | H23A | 111.4° | 109.5° |
| C25 | C24 | C29 | 119.1° | 120.0° |
| C24 | C25 | C26 | 120.5° | 120.1° |
| C24 | C25 | H25 | 119.8° | 120.0° |
| C24 | C29 | C28 | 121.0° | 120.1° |
| C24 | C29 | H29 | 119.5° | 120.0° |
| C26 | C25 | H25 | 119.8° | 120.0° |
| C25 | C26 | C27 | 119.5° | 119.9° |
| C25 | C26 | H26 | 120.3° | 120.1° |
| C27 | C26 | H26 | 120.2° | 120.0° |
| C26 | C27 | C28 | 120.8° | 120.0° |
| C26 | C27 | F32 | 119.9° | 120.0° |
| C28 | C27 | F32 | 119.3° | 120.1° |
| C27 | C28 | C29 | 119.1° | 120.0° |
| C27 | C28 | H28 | 120.5° | 120.0° |
| C29 | C28 | H28 | 120.4° | 120.1° |
| C28 | C29 | H29 | 119.5° | 120.0° |
| O31 | C30 | O33 | 129.2° | 120.0° |
| C30 | O33 | HO33 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C7 | C1 | C2 | C6 | 129.0° | 120.0° |
| C7 | C1 | C2 | H1 | 115.3° | 120.0° |
| C7 | C1 | C6 | H1 | 115.3° | 120.0° |
| C7 | C1 | C2 | C3 | 175.5° | 180.0° |
| C7 | C1 | C2 | H2 | 55.5° | 60.0° |
| C7 | C1 | C2 | H2A | 64.5° | 60.0° |
| C7 | C1 | C6 | C5 | 179.2° | 180.0° |
| C7 | C1 | C6 | H6 | 59.2° | 60.0° |
| C7 | C1 | C6 | H6A | 60.8° | 60.0° |
| C1 | C7 | N8 | H7 | 120.0° | 120.0° |
| C1 | C7 | N8 | H7A | 120.0° | 120.0° |
| C1 | C7 | H7 | H7A | 118.5° | 120.0° |
| C1 | C7 | N8 | C12 | 100.3° | 124.8° |
| C1 | C7 | N8 | N9 | 78.1° | 54.9° |
| C2 | C1 | C6 | H1 | 115.9° | 120.0° |
| C1 | C2 | C3 | H2 | 120.0° | 120.0° |
| C1 | C2 | C3 | H2A | 120.0° | 120.0° |
| C1 | C2 | H2 | H2A | 118.8° | 120.0° |
| C1 | C2 | C3 | C4 | 52.1° | 60.0° |
| C1 | C2 | C3 | H3 | 172.1° | 180.0° |
| C1 | C2 | C3 | H3A | 67.9° | 60.1° |
| C2 | C1 | C6 | C5 | 51.9° | 60.0° |
| C2 | C1 | C6 | H6 | 172.0° | 180.0° |
| C2 | C1 | C6 | H6A | 68.1° | 60.0° |
| C2 | C1 | C7 | N8 | 163.7° | 65.1° |
| C2 | C1 | C7 | H7 | 76.3° | 55.0° |
| C2 | C1 | C7 | H7A | 43.7° | 175.0° |
| C6 | C1 | C2 | C3 | 46.6° | 60.0° |
| C6 | C1 | C2 | H2 | 73.4° | 60.0° |
| C6 | C1 | C2 | H2A | 166.6° | 180.0° |
| C1 | C6 | C5 | C4 | 61.9° | 60.0° |
| C1 | C6 | C5 | H6 | 120.0° | 120.0° |
| C1 | C6 | C5 | H6A | 120.0° | 120.0° |
| C1 | C6 | C5 | H5 | 178.1° | 180.0° |
| C1 | C6 | C5 | H5A | 58.1° | 60.0° |
| C1 | C6 | H6 | H6A | 119.0° | 120.0° |
| C6 | C1 | C7 | N8 | 35.1° | 175.0° |
| C6 | C1 | C7 | H7 | 155.1° | 65.0° |
| C6 | C1 | C7 | H7A | 84.9° | 55.0° |
| H1 | C1 | C2 | C3 | 69.2° | 60.0° |
| H1 | C1 | C2 | H2 | 170.8° | 180.0° |
| H1 | C1 | C2 | H2A | 50.8° | 60.0° |
| H1 | C1 | C6 | C5 | 63.9° | 60.0° |
| H1 | C1 | C6 | H6 | 56.1° | 60.0° |
| H1 | C1 | C6 | H6A | 176.1° | 180.0° |
| H1 | C1 | C7 | N8 | 80.5° | 55.0° |
| H1 | C1 | C7 | H7 | 39.5° | 175.0° |
| H1 | C1 | C7 | H7A | 159.5° | 65.0° |
| C3 | C2 | H2 | H2A | 118.7° | 120.0° |
| C2 | C3 | C4 | H3 | 120.0° | 120.0° |
| C2 | C3 | C4 | H3A | 120.0° | 120.0° |
| C2 | C3 | H3 | H3A | 119.9° | 120.0° |
| C2 | C3 | C4 | C5 | 63.1° | 60.0° |
| C2 | C3 | C4 | C30 | 172.0° | 180.0° |
| C2 | C3 | C4 | H4 | 62.4° | 60.0° |
| H2 | C2 | C3 | C4 | 67.9° | 60.0° |
| H2 | C2 | C3 | H3 | 52.1° | 60.0° |
| H2 | C2 | C3 | H3A | 172.1° | 180.0° |
| H2A | C2 | C3 | C4 | 172.1° | 180.0° |
| H2A | C2 | C3 | H3 | 67.9° | 60.0° |
| H2A | C2 | C3 | H3A | 52.1° | 59.9° |
| C4 | C3 | H3 | H3A | 120.0° | 120.0° |
| C3 | C4 | C5 | C30 | 113.5° | 120.0° |
| C3 | C4 | C5 | H4 | 121.8° | 120.1° |
| C3 | C4 | C30 | H4 | 121.7° | 120.0° |
| C3 | C4 | C5 | C6 | 67.3° | 60.0° |
| C3 | C4 | C5 | H5 | 172.7° | 180.0° |
| C3 | C4 | C5 | H5A | 52.7° | 60.0° |
| C3 | C4 | C30 | O31 | 162.0° | 0.0° |
| C3 | C4 | C30 | O33 | 17.5° | 180.0° |
| H3 | C3 | C4 | C5 | 176.9° | 180.0° |
| H3 | C3 | C4 | C30 | 68.1° | 60.0° |
| H3 | C3 | C4 | H4 | 57.6° | 59.9° |
| H3A | C3 | C4 | C5 | 56.9° | 60.0° |
| H3A | C3 | C4 | C30 | 52.0° | 60.0° |
| H3A | C3 | C4 | H4 | 177.7° | 179.9° |
| C5 | C4 | C30 | H4 | 124.4° | 120.0° |
| C4 | C5 | C6 | H5 | 120.0° | 120.0° |
| C4 | C5 | C6 | H5A | 120.0° | 120.0° |
| C4 | C5 | H5 | H5A | 121.1° | 120.0° |
| C4 | C5 | C6 | H6 | 178.1° | 180.0° |
| C4 | C5 | C6 | H6A | 58.1° | 60.0° |
| C5 | C4 | C30 | O31 | 84.1° | 120.0° |
| C5 | C4 | C30 | O33 | 96.5° | 60.0° |
| C30 | C4 | C5 | C6 | 179.2° | 180.0° |
| C30 | C4 | C5 | H5 | 59.2° | 60.0° |
| C30 | C4 | C5 | H5A | 60.8° | 60.0° |
| C4 | C30 | O31 | O33 | 179.4° | 180.0° |
| C4 | C30 | O33 | HO33 | 179.3° | 180.0° |
| H4 | C4 | C5 | C6 | 54.4° | 60.0° |
| H4 | C4 | C5 | H5 | 65.5° | 60.0° |
| H4 | C4 | C5 | H5A | 174.5° | 180.0° |
| H4 | C4 | C30 | O31 | 40.3° | 120.0° |
| H4 | C4 | C30 | O33 | 139.1° | 60.0° |
| C6 | C5 | H5 | H5A | 121.1° | 120.0° |
| C5 | C6 | H6 | H6A | 119.1° | 120.1° |
| H5 | C5 | C6 | H6 | 58.1° | 60.0° |
| H5 | C5 | C6 | H6A | 61.9° | 60.0° |
| H5A | C5 | C6 | H6 | 61.9° | 60.0° |
| H5A | C5 | C6 | H6A | 178.1° | 180.0° |
| N8 | C7 | H7 | H7A | 118.5° | 120.0° |
| C7 | N8 | C12 | N9 | 178.6° | 179.7° |
| C7 | N8 | N9 | C10 | 179.1° | 180.0° |
| C7 | N8 | C12 | N11 | 179.0° | 179.9° |
| C7 | N8 | C12 | H12 | 1.0° | 0.0° |
| H7 | C7 | N8 | C12 | 139.7° | 4.7° |
| H7 | C7 | N8 | N9 | 41.9° | 175.0° |
| H7A | C7 | N8 | C12 | 19.7° | 115.3° |
| H7A | C7 | N8 | N9 | 161.9° | 65.0° |
| C12 | N8 | N9 | C10 | 0.4° | 0.2° |
| N8 | C12 | N11 | C10 | 0.2° | 0.4° |
| N8 | C12 | N11 | H12 | 180.0° | 179.9° |
| N8 | N9 | C10 | N11 | 0.3° | 0.0° |
| N8 | N9 | C10 | C13 | 178.7° | 180.0° |
| N9 | N8 | C12 | N11 | 0.4° | 0.4° |
| N9 | N8 | C12 | H12 | 179.6° | 179.8° |
| N9 | C10 | N11 | C13 | 178.4° | 180.0° |
| N9 | C10 | N11 | C12 | 0.1° | 0.3° |
| N9 | C10 | C13 | C18 | 165.2° | 0.3° |
| N9 | C10 | C13 | C14 | 13.0° | 180.0° |
| C10 | N11 | C12 | H12 | 179.8° | 179.7° |
| N11 | C10 | C13 | C18 | 13.1° | 179.7° |
| N11 | C10 | C13 | C14 | 168.7° | 0.0° |
| C13 | C10 | N11 | C12 | 178.5° | 179.8° |
| C10 | C13 | C18 | C14 | 178.2° | 179.7° |
| C10 | C13 | C14 | C15 | 178.4° | 180.0° |
| C10 | C13 | C14 | H14 | 1.6° | 0.1° |
| C10 | C13 | C18 | C17 | 178.7° | 179.8° |
| C10 | C13 | C18 | H18 | 1.3° | 0.1° |
| C18 | C13 | C14 | C15 | 0.2° | 0.3° |
| C18 | C13 | C14 | H14 | 179.8° | 179.8° |
| C13 | C18 | C17 | N16 | 0.8° | 0.5° |
| C13 | C18 | C17 | H18 | 180.0° | 179.8° |
| C13 | C18 | C17 | C20 | 179.9° | 179.7° |
| C13 | C14 | C15 | H14 | 180.0° | 179.9° |
| C13 | C14 | C15 | N16 | 0.1° | 0.0° |
| C13 | C14 | C15 | C19 | 180.0° | 180.0° |
| C14 | C13 | C18 | C17 | 0.5° | 0.5° |
| C14 | C13 | C18 | H18 | 179.5° | 179.7° |
| C14 | C15 | N16 | C19 | 179.9° | 180.0° |
| C14 | C15 | N16 | C17 | 0.3° | 0.0° |
| C14 | C15 | C19 | H19 | 179.9° | 90.0° |
| C14 | C15 | C19 | H19A | 59.9° | 150.0° |
| C14 | C15 | C19 | H19B | 60.1° | 30.0° |
| H14 | C14 | C15 | N16 | 179.9° | 179.9° |
| H14 | C14 | C15 | C19 | 0.0° | 0.1° |
| C15 | N16 | C17 | C18 | 0.7° | 0.2° |
| C15 | N16 | C17 | C20 | 179.8° | 180.0° |
| N16 | C15 | C19 | H19 | 0.0° | 90.0° |
| N16 | C15 | C19 | H19A | 120.0° | 30.0° |
| N16 | C15 | C19 | H19B | 120.0° | 149.9° |
| C19 | C15 | N16 | C17 | 179.8° | 180.0° |
| C15 | C19 | H19 | H19A | 120.0° | 120.0° |
| C15 | C19 | H19 | H19B | 120.0° | 120.0° |
| C15 | C19 | H19A | H19B | 120.0° | 119.9° |
| N16 | C17 | C18 | C20 | 179.1° | 179.8° |
| N16 | C17 | C18 | H18 | 179.2° | 179.7° |
| N16 | C17 | C20 | O21 | 171.0° | 180.0° |
| N16 | C17 | C20 | N22 | 11.4° | 0.0° |
| C18 | C17 | C20 | O21 | 9.8° | 0.2° |
| C18 | C17 | C20 | N22 | 167.7° | 179.8° |
| C20 | C17 | C18 | H18 | 0.1° | 0.1° |
| C17 | C20 | O21 | N22 | 177.3° | 180.0° |
| C17 | C20 | N22 | C23 | 175.0° | 180.0° |
| C17 | C20 | N22 | HN22 | 5.0° | 0.0° |
| H19 | C19 | H19A | H19B | 120.0° | 120.1° |
| O21 | C20 | N22 | C23 | 2.5° | 0.0° |
| O21 | C20 | N22 | HN22 | 177.5° | 179.9° |
| C20 | N22 | C23 | HN22 | 180.0° | 180.0° |
| C20 | N22 | C23 | C24 | 76.1° | 180.0° |
| C20 | N22 | C23 | H23 | 163.9° | 60.0° |
| C20 | N22 | C23 | H23A | 43.9° | 60.0° |
| N22 | C23 | C24 | H23 | 120.0° | 120.0° |
| N22 | C23 | C24 | H23A | 120.0° | 120.0° |
| N22 | C23 | H23 | H23A | 117.4° | 120.0° |
| N22 | C23 | C24 | C25 | 173.8° | 90.0° |
| N22 | C23 | C24 | C29 | 6.5° | 90.3° |
| HN22 | N22 | C23 | C24 | 103.9° | 0.0° |
| HN22 | N22 | C23 | H23 | 16.1° | 119.9° |
| HN22 | N22 | C23 | H23A | 136.1° | 120.0° |
| C24 | C23 | H23 | H23A | 117.4° | 120.0° |
| C23 | C24 | C25 | C29 | 179.8° | 179.7° |
| C23 | C24 | C25 | C26 | 179.8° | 180.0° |
| C23 | C24 | C25 | H25 | 0.2° | 0.1° |
| C23 | C24 | C29 | C28 | 179.8° | 179.8° |
| C23 | C24 | C29 | H29 | 0.2° | 0.0° |
| H23 | C23 | C24 | C25 | 66.2° | 30.0° |
| H23 | C23 | C24 | C29 | 113.6° | 149.7° |
| H23A | C23 | C24 | C25 | 53.7° | 150.0° |
| H23A | C23 | C24 | C29 | 126.5° | 29.7° |
| C24 | C25 | C26 | H25 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 0.1° | 0.0° |
| C24 | C25 | C26 | H26 | 179.9° | 179.9° |
| C25 | C24 | C29 | C28 | 0.0° | 0.5° |
| C25 | C24 | C29 | H29 | 179.9° | 179.7° |
| C29 | C24 | C25 | C26 | 0.0° | 0.3° |
| C29 | C24 | C25 | H25 | 180.0° | 179.8° |
| C24 | C29 | C28 | C27 | 0.1° | 0.4° |
| C24 | C29 | C28 | H29 | 180.0° | 179.8° |
| C24 | C29 | C28 | H28 | 179.9° | 179.7° |
| C25 | C26 | C27 | H26 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 0.2° | 0.1° |
| C25 | C26 | C27 | F32 | 180.0° | 180.0° |
| H25 | C25 | C26 | C27 | 179.9° | 180.0° |
| H25 | C25 | C26 | H26 | 0.1° | 0.0° |
| C26 | C27 | C28 | F32 | 179.8° | 179.9° |
| C26 | C27 | C28 | C29 | 0.2° | 0.1° |
| C26 | C27 | C28 | H28 | 179.8° | 180.0° |
| H26 | C26 | C27 | C28 | 179.8° | 180.0° |
| H26 | C26 | C27 | F32 | 0.0° | 0.1° |
| C27 | C28 | C29 | H28 | 180.0° | 179.8° |
| C27 | C28 | C29 | H29 | 179.9° | 179.7° |
| F32 | C27 | C28 | C29 | 180.0° | 179.8° |
| F32 | C27 | C28 | H28 | 0.0° | 0.1° |
| H28 | C28 | C29 | H29 | 0.1° | 0.1° |
| O31 | C30 | O33 | HO33 | 0.0° | 0.0° |
