A1A4O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C32 | C31 | sing | 1.51Å | 1.48Å | |
| F17 | C16 | sing | 1.35Å | 1.34Å | |
| O5 | C4 | doub | 1.22Å | 1.24Å | |
| O19 | C18 | doub | 1.21Å | 1.23Å | |
| C15 | C16 | doub | 1.37Å | 1.34Å | Aromatic |
| C15 | C14 | sing | 1.40Å | 1.37Å | Aromatic |
| C30 | C31 | doub | 1.38Å | 1.36Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.34Å | Aromatic |
| C16 | C11 | sing | 1.40Å | 1.39Å | Aromatic |
| C31 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C4 | N3 | sing | 1.35Å | 1.35Å | |
| C4 | N6 | sing | 1.35Å | 1.38Å | |
| C18 | C14 | sing | 1.47Å | 1.47Å | |
| C18 | C20 | sing | 1.52Å | 1.51Å | |
| C2 | N3 | sing | 1.47Å | 1.47Å | |
| C14 | C13 | doub | 1.41Å | 1.43Å | Aromatic |
| C29 | C28 | doub | 1.38Å | 1.35Å | Aromatic |
| C11 | N6 | sing | 1.40Å | 1.39Å | |
| C11 | C12 | doub | 1.39Å | 1.38Å | Aromatic |
| N3 | C8 | sing | 1.37Å | 1.40Å | |
| C26 | C20 | sing | 1.51Å | 1.51Å | |
| C26 | C27 | doub | 1.38Å | 1.43Å | Aromatic |
| N6 | N7 | sing | 1.40Å | 1.40Å | |
| C20 | C21 | sing | 1.53Å | 1.50Å | |
| C13 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
| C13 | N22 | sing | 1.38Å | 1.40Å | |
| C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | N22 | sing | 1.46Å | 1.44Å | |
| C8 | N7 | doub | 1.29Å | 1.28Å | |
| C8 | C9 | sing | 1.51Å | 1.53Å | |
| N22 | C23 | sing | 1.47Å | 1.51Å | |
| O10 | C9 | sing | 1.43Å | 1.39Å | |
| C25 | C23 | sing | 1.53Å | 1.48Å | |
| C23 | C24 | sing | 1.53Å | 1.50Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.08Å | 1.08Å | |
| C15 | H7 | sing | 1.08Å | 1.08Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.09Å | 1.10Å | |
| C23 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C27 | H14 | sing | 1.08Å | 1.08Å | |
| C30 | H15 | sing | 1.08Å | 1.08Å | |
| C32 | H16 | sing | 1.09Å | 1.10Å | |
| C32 | H17 | sing | 1.09Å | 1.10Å | |
| C32 | H18 | sing | 1.09Å | 1.10Å | |
| C9 | H19 | sing | 1.09Å | 1.10Å | |
| C9 | H20 | sing | 1.09Å | 1.10Å | |
| O10 | H21 | sing | 0.97Å | 0.95Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.08Å | 1.08Å | |
| C29 | H27 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C32 | C31 | C30 | 113.5° | 120.0° |
| C32 | C31 | C26 | 126.5° | 120.0° |
| C31 | C32 | H16 | 109.5° | 109.5° |
| C31 | C32 | H17 | 109.5° | 109.5° |
| C31 | C32 | H18 | 109.5° | 109.5° |
| F17 | C16 | C15 | 118.9° | 119.9° |
| F17 | C16 | C11 | 119.8° | 119.9° |
| O5 | C4 | N3 | 126.7° | 126.3° |
| O5 | C4 | N6 | 127.0° | 126.3° |
| O19 | C18 | C14 | 122.5° | 121.7° |
| O19 | C18 | C20 | 120.1° | 121.8° |
| C16 | C15 | C14 | 121.2° | 119.9° |
| C15 | C16 | C11 | 121.2° | 120.2° |
| C16 | C15 | H7 | 119.4° | 120.0° |
| C15 | C14 | C18 | 119.2° | 120.0° |
| C15 | C14 | C13 | 119.6° | 120.4° |
| C14 | C15 | H7 | 119.4° | 120.1° |
| C31 | C30 | C29 | 119.7° | 120.0° |
| C30 | C31 | C26 | 120.0° | 120.0° |
| C31 | C30 | H15 | 120.1° | 120.0° |
| C30 | C29 | C28 | 122.5° | 120.0° |
| C29 | C30 | H15 | 120.1° | 120.0° |
| C30 | C29 | H27 | 118.7° | 120.0° |
| C16 | C11 | N6 | 123.7° | 119.7° |
| C16 | C11 | C12 | 119.6° | 120.6° |
| C31 | C26 | C20 | 127.3° | 120.0° |
| C31 | C26 | C27 | 119.8° | 120.0° |
| C1 | C2 | N3 | 111.7° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| C1 | C2 | H4 | 108.9° | 109.5° |
| C1 | C2 | H5 | 108.9° | 109.5° |
| N3 | C4 | N6 | 106.3° | 107.4° |
| C4 | N3 | C2 | 125.9° | 125.8° |
| C4 | N3 | C8 | 107.6° | 108.3° |
| C4 | N6 | C11 | 130.9° | 126.4° |
| C4 | N6 | N7 | 108.3° | 107.3° |
| C14 | C18 | C20 | 116.9° | 116.4° |
| C18 | C14 | C13 | 121.2° | 119.5° |
| C18 | C20 | C26 | 118.5° | 110.0° |
| C18 | C20 | C21 | 113.0° | 107.0° |
| C18 | C20 | H22 | 104.9° | 110.0° |
| C2 | N3 | C8 | 126.5° | 125.8° |
| N3 | C2 | H4 | 108.9° | 109.4° |
| N3 | C2 | H5 | 108.9° | 109.4° |
| C14 | C13 | C12 | 117.9° | 118.9° |
| C14 | C13 | N22 | 120.0° | 122.0° |
| C29 | C28 | C27 | 120.8° | 120.0° |
| C29 | C28 | H26 | 119.6° | 120.0° |
| C28 | C29 | H27 | 118.8° | 120.0° |
| N6 | C11 | C12 | 116.7° | 119.7° |
| C11 | N6 | N7 | 120.8° | 126.4° |
| C11 | C12 | C13 | 120.3° | 120.1° |
| C11 | C12 | H6 | 119.8° | 120.0° |
| N3 | C8 | N7 | 110.0° | 108.9° |
| N3 | C8 | C9 | 127.8° | 125.6° |
| C20 | C26 | C27 | 112.9° | 120.0° |
| C26 | C20 | C21 | 109.2° | 110.2° |
| C26 | C20 | H22 | 104.9° | 110.1° |
| C26 | C27 | C28 | 117.1° | 120.0° |
| C26 | C27 | H14 | 121.5° | 120.0° |
| N6 | N7 | C8 | 107.8° | 108.1° |
| C20 | C21 | N22 | 114.8° | 109.7° |
| C20 | C21 | H8 | 108.1° | 109.4° |
| C20 | C21 | H9 | 108.1° | 109.4° |
| C21 | C20 | H22 | 105.0° | 109.6° |
| C12 | C13 | N22 | 122.1° | 119.1° |
| C13 | C12 | H6 | 119.9° | 119.9° |
| C13 | N22 | C21 | 117.4° | 113.9° |
| C13 | N22 | C23 | 118.7° | 111.1° |
| C28 | C27 | H14 | 121.5° | 120.0° |
| C27 | C28 | H26 | 119.6° | 120.0° |
| C21 | N22 | C23 | 120.8° | 111.0° |
| N22 | C21 | H8 | 108.1° | 109.5° |
| N22 | C21 | H9 | 108.1° | 109.4° |
| N7 | C8 | C9 | 122.1° | 125.6° |
| C8 | C9 | O10 | 111.0° | 109.4° |
| C8 | C9 | H19 | 109.1° | 109.5° |
| C8 | C9 | H20 | 109.1° | 109.5° |
| N22 | C23 | C25 | 109.7° | 109.5° |
| N22 | C23 | C24 | 109.4° | 109.4° |
| N22 | C23 | H10 | 110.0° | 109.5° |
| O10 | C9 | H19 | 109.1° | 109.4° |
| O10 | C9 | H20 | 109.1° | 109.5° |
| C9 | O10 | H21 | 109.5° | 114.0° |
| C25 | C23 | C24 | 107.0° | 109.5° |
| C25 | C23 | H10 | 110.5° | 109.5° |
| C23 | C25 | H23 | 109.5° | 109.5° |
| C23 | C25 | H24 | 109.5° | 109.4° |
| C23 | C25 | H25 | 109.5° | 109.5° |
| C24 | C23 | H10 | 110.2° | 109.5° |
| C23 | C24 | H11 | 109.5° | 109.5° |
| C23 | C24 | H12 | 109.5° | 109.4° |
| C23 | C24 | H13 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.4° | 109.5° |
| H4 | C2 | H5 | 109.5° | 109.5° |
| H8 | C21 | H9 | 109.5° | 109.5° |
| H11 | C24 | H12 | 109.5° | 109.5° |
| H11 | C24 | H13 | 109.5° | 109.5° |
| H12 | C24 | H13 | 109.4° | 109.5° |
| H16 | C32 | H17 | 109.5° | 109.5° |
| H16 | C32 | H18 | 109.4° | 109.5° |
| H17 | C32 | H18 | 109.5° | 109.4° |
| H19 | C9 | H20 | 109.5° | 109.5° |
| H23 | C25 | H24 | 109.5° | 109.5° |
| H23 | C25 | H25 | 109.5° | 109.5° |
| H24 | C25 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C32 | C31 | C30 | C26 | 177.2° | 179.8° |
| C32 | C31 | C30 | C29 | 179.2° | 180.0° |
| C32 | C31 | C26 | C20 | 1.3° | 0.2° |
| C32 | C31 | C26 | C27 | 177.9° | 179.7° |
| C32 | C31 | C30 | H15 | 0.8° | 0.2° |
| C31 | C32 | H16 | H17 | 120.0° | 120.0° |
| C31 | C32 | H16 | H18 | 120.0° | 120.0° |
| C31 | C32 | H17 | H18 | 120.0° | 120.0° |
| F17 | C16 | C15 | C11 | 177.3° | 179.9° |
| F17 | C16 | C15 | C14 | 177.4° | 179.8° |
| F17 | C16 | C11 | N6 | 0.4° | 0.4° |
| F17 | C16 | C11 | C12 | 179.4° | 179.4° |
| F17 | C16 | C15 | H7 | 2.6° | 0.1° |
| O5 | C4 | N3 | N6 | 178.6° | 179.7° |
| O5 | C4 | N3 | C2 | 3.6° | 0.3° |
| O5 | C4 | N6 | C11 | 1.7° | 0.3° |
| O5 | C4 | N3 | C8 | 178.2° | 179.7° |
| O5 | C4 | N6 | N7 | 178.4° | 179.7° |
| O19 | C18 | C14 | C15 | 4.8° | 9.9° |
| O19 | C18 | C14 | C20 | 172.1° | 179.9° |
| O19 | C18 | C14 | C13 | 173.2° | 170.2° |
| O19 | C18 | C20 | C26 | 33.9° | 21.4° |
| O19 | C18 | C20 | C21 | 163.5° | 141.1° |
| O19 | C18 | C20 | H22 | 82.7° | 99.9° |
| C16 | C15 | C14 | H7 | 180.0° | 179.9° |
| C16 | C15 | C14 | C18 | 178.7° | 178.9° |
| C16 | C15 | C14 | C13 | 0.6° | 1.2° |
| C15 | C16 | C11 | N6 | 177.7° | 179.8° |
| C15 | C16 | C11 | C12 | 2.1° | 0.4° |
| C14 | C15 | C16 | C11 | 0.1° | 0.3° |
| C15 | C14 | C18 | C13 | 178.0° | 179.9° |
| C15 | C14 | C18 | C20 | 177.0° | 170.2° |
| C15 | C14 | C13 | C12 | 3.0° | 1.3° |
| C15 | C14 | C13 | N22 | 179.7° | 178.6° |
| C31 | C30 | C29 | H15 | 180.0° | 179.8° |
| C31 | C30 | C29 | C28 | 3.1° | 0.2° |
| C30 | C31 | C26 | C20 | 178.1° | 180.0° |
| C30 | C31 | C26 | C27 | 1.1° | 0.1° |
| C30 | C31 | C32 | H16 | 91.1° | 90.0° |
| C30 | C31 | C32 | H17 | 148.9° | 149.9° |
| C30 | C31 | C32 | H18 | 28.9° | 30.0° |
| C31 | C30 | C29 | H27 | 176.9° | 179.9° |
| C29 | C30 | C31 | C26 | 3.6° | 0.2° |
| C30 | C29 | C28 | H27 | 180.0° | 179.7° |
| C30 | C29 | C28 | C27 | 0.1° | 0.0° |
| C30 | C29 | C28 | H26 | 179.9° | 180.0° |
| C16 | C11 | N6 | C4 | 43.1° | 95.2° |
| C16 | C11 | N6 | C12 | 179.8° | 179.8° |
| C16 | C11 | N6 | N7 | 136.8° | 84.8° |
| C16 | C11 | C12 | C13 | 4.6° | 0.3° |
| C16 | C11 | C12 | H6 | 175.4° | 179.7° |
| C11 | C16 | C15 | H7 | 179.9° | 179.8° |
| C31 | C26 | C20 | C18 | 41.0° | 120.0° |
| C31 | C26 | C20 | C27 | 179.3° | 179.9° |
| C31 | C26 | C20 | C21 | 90.3° | 122.3° |
| C31 | C26 | C27 | C28 | 2.0° | 0.3° |
| C31 | C26 | C27 | H14 | 178.0° | 180.0° |
| C26 | C31 | C30 | H15 | 176.4° | 180.0° |
| C26 | C31 | C32 | H16 | 91.9° | 89.8° |
| C26 | C31 | C32 | H17 | 28.1° | 30.3° |
| C26 | C31 | C32 | H18 | 148.1° | 150.3° |
| C31 | C26 | C20 | H22 | 157.6° | 1.3° |
| C1 | C2 | N3 | C4 | 91.6° | 90.0° |
| C1 | C2 | N3 | H4 | 120.3° | 120.1° |
| C1 | C2 | N3 | H5 | 120.3° | 120.0° |
| C1 | C2 | N3 | C8 | 86.3° | 89.9° |
| C2 | C1 | H1 | H2 | 120.0° | 119.9° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| C1 | C2 | H4 | H5 | 119.0° | 120.0° |
| C4 | N3 | C2 | C8 | 177.9° | 179.9° |
| N3 | C4 | N6 | C11 | 179.7° | 180.0° |
| N3 | C4 | N6 | N7 | 0.2° | 0.0° |
| C4 | N3 | C8 | N7 | 0.5° | 0.1° |
| C4 | N3 | C8 | C9 | 177.0° | 180.0° |
| C4 | N3 | C2 | H4 | 28.7° | 30.1° |
| C4 | N3 | C2 | H5 | 148.0° | 150.0° |
| N6 | C4 | N3 | C2 | 177.8° | 180.0° |
| C4 | N6 | C11 | N7 | 179.9° | 180.0° |
| C4 | N6 | C11 | C12 | 137.1° | 85.0° |
| N6 | C4 | N3 | C8 | 0.4° | 0.1° |
| C4 | N6 | N7 | C8 | 0.1° | 0.0° |
| C14 | C18 | C20 | C26 | 153.7° | 158.5° |
| C14 | C18 | C20 | C21 | 24.2° | 38.8° |
| C18 | C14 | C13 | C12 | 179.0° | 178.8° |
| C18 | C14 | C13 | N22 | 1.6° | 1.3° |
| C18 | C14 | C15 | H7 | 1.4° | 1.0° |
| C14 | C18 | C20 | H22 | 89.6° | 80.2° |
| C20 | C18 | C14 | C13 | 1.1° | 9.8° |
| C18 | C20 | C26 | C21 | 131.3° | 117.7° |
| C18 | C20 | C26 | H22 | 116.6° | 121.3° |
| C18 | C20 | C26 | C27 | 139.8° | 60.1° |
| C18 | C20 | C21 | H22 | 113.8° | 119.2° |
| C18 | C20 | C21 | N22 | 46.0° | 61.9° |
| C18 | C20 | C21 | H8 | 166.7° | 58.2° |
| C18 | C20 | C21 | H9 | 74.8° | 178.1° |
| C2 | N3 | C8 | N7 | 177.7° | 180.0° |
| C2 | N3 | C8 | C9 | 4.8° | 0.1° |
| N3 | C2 | C1 | H1 | 180.0° | 180.0° |
| N3 | C2 | C1 | H2 | 60.0° | 60.0° |
| N3 | C2 | C1 | H3 | 60.0° | 59.9° |
| N3 | C2 | H4 | H5 | 119.0° | 119.9° |
| C14 | C13 | C12 | C11 | 5.0° | 0.5° |
| C14 | C13 | C12 | N22 | 177.3° | 179.9° |
| C14 | C13 | N22 | C21 | 20.7° | 25.5° |
| C14 | C13 | N22 | C23 | 179.2° | 151.7° |
| C14 | C13 | C12 | H6 | 175.0° | 179.5° |
| C13 | C14 | C15 | H7 | 179.4° | 178.9° |
| C29 | C28 | C27 | C26 | 2.6° | 0.3° |
| C29 | C28 | C27 | H26 | 180.0° | 180.0° |
| C29 | C28 | C27 | H14 | 177.4° | 179.9° |
| C28 | C29 | C30 | H15 | 176.9° | 179.9° |
| N6 | C11 | C12 | C13 | 175.2° | 179.9° |
| C11 | N6 | N7 | C8 | 180.0° | 180.0° |
| N6 | C11 | C12 | H6 | 4.8° | 0.1° |
| C12 | C11 | N6 | N7 | 43.0° | 95.0° |
| C11 | C12 | C13 | H6 | 180.0° | 180.0° |
| C11 | C12 | C13 | N22 | 177.7° | 179.3° |
| N3 | C8 | N7 | N6 | 0.4° | 0.0° |
| N3 | C8 | N7 | C9 | 177.7° | 180.0° |
| N3 | C8 | C9 | O10 | 60.7° | 179.9° |
| C8 | N3 | C2 | H4 | 153.4° | 150.0° |
| C8 | N3 | C2 | H5 | 34.0° | 30.1° |
| N3 | C8 | C9 | H19 | 179.1° | 60.0° |
| N3 | C8 | C9 | H20 | 59.6° | 60.1° |
| C26 | C20 | C21 | H22 | 112.1° | 121.3° |
| C20 | C26 | C27 | C28 | 178.7° | 179.7° |
| C26 | C20 | C21 | N22 | 179.9° | 178.6° |
| C26 | C20 | C21 | H8 | 59.1° | 61.3° |
| C26 | C20 | C21 | H9 | 59.4° | 58.6° |
| C20 | C26 | C27 | H14 | 1.3° | 0.1° |
| C27 | C26 | C20 | C21 | 89.0° | 57.6° |
| C26 | C27 | C28 | H14 | 180.0° | 179.6° |
| C27 | C26 | C20 | H22 | 23.1° | 178.6° |
| C26 | C27 | C28 | H26 | 177.4° | 179.7° |
| N6 | N7 | C8 | C9 | 177.3° | 180.0° |
| C20 | C21 | N22 | C13 | 45.1° | 56.6° |
| C20 | C21 | N22 | H8 | 120.8° | 120.1° |
| C20 | C21 | N22 | H9 | 120.8° | 120.0° |
| C20 | C21 | N22 | C23 | 155.2° | 177.1° |
| C20 | C21 | H8 | H9 | 117.6° | 119.8° |
| C12 | C13 | N22 | C21 | 156.6° | 154.7° |
| C12 | C13 | N22 | C23 | 3.6° | 28.4° |
| C13 | N22 | C21 | C23 | 159.7° | 126.3° |
| C13 | N22 | C23 | C25 | 108.9° | 67.7° |
| C13 | N22 | C23 | C24 | 134.0° | 172.3° |
| N22 | C13 | C12 | H6 | 2.3° | 0.7° |
| C13 | N22 | C21 | H8 | 165.9° | 63.4° |
| C13 | N22 | C21 | H9 | 75.6° | 176.6° |
| C13 | N22 | C23 | H10 | 12.8° | 52.3° |
| C27 | C28 | C29 | H27 | 179.9° | 179.7° |
| C21 | N22 | C23 | C25 | 50.5° | 60.1° |
| C21 | N22 | C23 | C24 | 66.5° | 59.9° |
| N22 | C21 | H8 | H9 | 117.6° | 119.9° |
| C21 | N22 | C23 | H10 | 172.3° | 179.9° |
| N22 | C21 | C20 | H22 | 67.8° | 57.3° |
| N7 | C8 | C9 | O10 | 122.1° | 0.0° |
| N7 | C8 | C9 | H19 | 1.9° | 119.9° |
| N7 | C8 | C9 | H20 | 117.7° | 120.0° |
| C8 | C9 | O10 | H19 | 120.2° | 120.0° |
| C8 | C9 | O10 | H20 | 120.2° | 120.0° |
| C8 | C9 | H19 | H20 | 119.3° | 120.1° |
| C8 | C9 | O10 | H21 | 180.0° | 180.0° |
| N22 | C23 | C25 | C24 | 118.6° | 119.9° |
| N22 | C23 | C25 | H10 | 121.5° | 120.0° |
| N22 | C23 | C24 | H10 | 121.1° | 120.1° |
| C23 | N22 | C21 | H8 | 34.4° | 62.8° |
| C23 | N22 | C21 | H9 | 84.1° | 57.1° |
| N22 | C23 | C24 | H11 | 180.0° | 66.3° |
| N22 | C23 | C24 | H12 | 60.0° | 173.7° |
| N22 | C23 | C24 | H13 | 60.0° | 53.7° |
| N22 | C23 | C25 | H23 | 180.0° | 60.1° |
| N22 | C23 | C25 | H24 | 60.0° | 180.0° |
| N22 | C23 | C25 | H25 | 60.0° | 60.0° |
| O10 | C9 | H19 | H20 | 119.3° | 120.0° |
| C25 | C23 | C24 | H10 | 120.1° | 120.0° |
| C25 | C23 | C24 | H11 | 61.2° | 53.7° |
| C25 | C23 | C24 | H12 | 178.8° | 66.3° |
| C25 | C23 | C24 | H13 | 58.8° | 173.7° |
| C23 | C25 | H23 | H24 | 120.0° | 119.9° |
| C23 | C25 | H23 | H25 | 120.0° | 120.0° |
| C23 | C25 | H24 | H25 | 120.0° | 120.0° |
| C23 | C24 | H11 | H12 | 120.0° | 120.0° |
| C23 | C24 | H11 | H13 | 120.0° | 120.0° |
| C23 | C24 | H12 | H13 | 120.0° | 120.0° |
| C24 | C23 | C25 | H23 | 61.4° | 180.0° |
| C24 | C23 | C25 | H24 | 58.6° | 60.0° |
| C24 | C23 | C25 | H25 | 178.5° | 60.0° |
| H1 | C1 | H2 | H3 | 120.0° | 120.1° |
| H1 | C1 | C2 | H4 | 59.7° | 60.0° |
| H1 | C1 | C2 | H5 | 59.6° | 60.1° |
| H2 | C1 | C2 | H4 | 60.3° | 60.0° |
| H2 | C1 | C2 | H5 | 179.7° | 180.0° |
| H3 | C1 | C2 | H4 | 179.7° | 180.0° |
| H3 | C1 | C2 | H5 | 60.4° | 60.0° |
| H8 | C21 | C20 | H22 | 53.0° | 177.4° |
| H9 | C21 | C20 | H22 | 171.4° | 62.7° |
| H10 | C23 | C24 | H11 | 59.0° | 173.7° |
| H10 | C23 | C24 | H12 | 61.1° | 53.7° |
| H10 | C23 | C24 | H13 | 179.0° | 66.3° |
| H10 | C23 | C25 | H23 | 58.5° | 60.0° |
| H10 | C23 | C25 | H24 | 178.5° | 60.0° |
| H10 | C23 | C25 | H25 | 61.5° | NaN° |
| H11 | C24 | H12 | H13 | 120.0° | 120.0° |
| H14 | C27 | C28 | H26 | 2.6° | 0.1° |
| H15 | C30 | C29 | H27 | 3.1° | 0.2° |
| H16 | C32 | H17 | H18 | 120.0° | 120.0° |
| H19 | C9 | O10 | H21 | 59.8° | 60.1° |
| H20 | C9 | O10 | H21 | 59.8° | 59.9° |
| H23 | C25 | H24 | H25 | 120.0° | 120.1° |
| H26 | C28 | C29 | H27 | 0.1° | 0.3° |
