A1IPZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | doub | 1.22Å | 1.26Å | |
| C1 | O2 | sing | 1.35Å | 1.26Å | |
| C1 | C2 | sing | 1.48Å | 1.50Å | |
| C2 | C3 | doub | 1.40Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | C5 | doub | 1.40Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.48Å | 1.47Å | |
| C6 | N1 | doub | 1.31Å | 1.32Å | Aromatic |
| N1 | N2 | sing | 1.40Å | 1.38Å | Aromatic |
| N2 | C7 | sing | 1.35Å | 1.39Å | |
| C7 | O3 | doub | 1.22Å | 1.21Å | |
| C7 | C8 | sing | 1.48Å | 1.49Å | |
| C8 | C9 | doub | 1.40Å | 1.39Å | Aromatic |
| C9 | CL1 | sing | 1.74Å | 1.74Å | |
| C9 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | C11 | doub | 1.38Å | 1.37Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.51Å | 1.50Å | |
| C14 | F1 | sing | 1.40Å | 1.33Å | |
| C14 | F2 | sing | 1.40Å | 1.32Å | |
| C14 | F3 | sing | 1.40Å | 1.33Å | |
| N2 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| C17 | C18 | doub | 1.39Å | 1.40Å | Aromatic |
| C18 | CL2 | sing | 1.74Å | 1.74Å | |
| C18 | C19 | sing | 1.38Å | 1.37Å | Aromatic |
| C19 | C20 | doub | 1.40Å | 1.39Å | Aromatic |
| C5 | C21 | sing | 1.40Å | 1.40Å | Aromatic |
| C21 | O4 | sing | 1.36Å | 1.37Å | |
| O4 | C22 | sing | 1.43Å | 1.44Å | |
| C22 | C23 | sing | 1.53Å | 1.51Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C24 | C25 | sing | 1.53Å | 1.52Å | |
| C25 | O5 | sing | 1.43Å | 1.43Å | |
| O5 | C26 | sing | 1.43Å | 1.43Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C21 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | C28 | sing | 1.40Å | 1.39Å | Aromatic |
| C6 | C20 | sing | 1.47Å | 1.43Å | Aromatic |
| C23 | C27 | sing | 1.53Å | 1.52Å | |
| C8 | C13 | sing | 1.40Å | 1.40Å | Aromatic |
| C15 | C20 | sing | 1.41Å | 1.40Å | Aromatic |
| O2 | H21 | sing | 0.97Å | 0.95Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C10 | H3 | sing | 1.08Å | 1.08Å | |
| C11 | H4 | sing | 1.08Å | 1.08Å | |
| C12 | H5 | sing | 1.08Å | 1.08Å | |
| C16 | H6 | sing | 1.08Å | 1.08Å | |
| C17 | H7 | sing | 1.08Å | 1.08Å | |
| C19 | H8 | sing | 1.08Å | 1.08Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C22 | H9 | sing | 1.09Å | 1.10Å | |
| C23 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H16 | sing | 1.09Å | 1.10Å | |
| C26 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C28 | H20 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | O2 | 124.9° | 120.0° |
| O1 | C1 | C2 | 117.3° | 120.0° |
| O2 | C1 | C2 | 117.7° | 120.0° |
| C1 | O2 | H21 | 109.5° | 117.0° |
| C1 | C2 | C3 | 120.3° | 120.0° |
| C1 | C2 | C28 | 119.8° | 120.0° |
| C2 | C3 | C4 | 120.2° | 120.1° |
| C3 | C2 | C28 | 119.9° | 120.0° |
| C2 | C3 | H1 | 119.9° | 120.0° |
| C3 | C4 | C5 | 120.6° | 120.1° |
| C3 | C4 | H2 | 119.7° | 119.9° |
| C4 | C3 | H1 | 119.9° | 119.9° |
| C4 | C5 | C6 | 117.1° | 120.0° |
| C4 | C5 | C21 | 118.9° | 120.0° |
| C5 | C4 | H2 | 119.7° | 120.0° |
| C5 | C6 | N1 | 120.5° | 126.1° |
| C6 | C5 | C21 | 123.7° | 120.0° |
| C5 | C6 | C20 | 129.3° | 126.2° |
| C6 | N1 | N2 | 107.4° | 110.0° |
| N1 | C6 | C20 | 109.7° | 107.6° |
| N1 | N2 | C7 | 119.4° | 125.4° |
| N1 | N2 | C15 | 110.9° | 109.2° |
| N2 | C7 | O3 | 119.5° | 120.0° |
| N2 | C7 | C8 | 117.0° | 120.0° |
| C7 | N2 | C15 | 129.5° | 125.4° |
| O3 | C7 | C8 | 123.4° | 120.1° |
| C7 | C8 | C9 | 119.3° | 120.2° |
| C7 | C8 | C13 | 121.9° | 120.2° |
| C8 | C9 | CL1 | 121.2° | 120.1° |
| C8 | C9 | C10 | 121.2° | 119.8° |
| C9 | C8 | C13 | 118.7° | 119.7° |
| CL1 | C9 | C10 | 117.6° | 120.1° |
| C9 | C10 | C11 | 119.5° | 120.2° |
| C9 | C10 | H3 | 120.2° | 119.9° |
| C10 | C11 | C12 | 120.5° | 120.3° |
| C11 | C10 | H3 | 120.3° | 120.0° |
| C10 | C11 | H4 | 119.7° | 119.8° |
| C11 | C12 | C13 | 120.4° | 120.2° |
| C12 | C11 | H4 | 119.8° | 119.9° |
| C11 | C12 | H5 | 119.8° | 119.9° |
| C12 | C13 | C14 | 118.7° | 120.0° |
| C12 | C13 | C8 | 119.7° | 119.9° |
| C13 | C12 | H5 | 119.8° | 119.9° |
| C13 | C14 | F1 | 112.0° | 109.5° |
| C13 | C14 | F2 | 112.3° | 109.4° |
| C13 | C14 | F3 | 112.7° | 109.4° |
| C14 | C13 | C8 | 121.6° | 120.1° |
| F1 | C14 | F2 | 107.6° | 109.5° |
| F1 | C14 | F3 | 104.4° | 109.5° |
| F2 | C14 | F3 | 107.4° | 109.5° |
| N2 | C15 | C16 | 133.0° | 133.6° |
| N2 | C15 | C20 | 105.0° | 106.8° |
| C15 | C16 | C17 | 117.6° | 119.9° |
| C16 | C15 | C20 | 122.0° | 119.6° |
| C15 | C16 | H6 | 121.2° | 120.0° |
| C16 | C17 | C18 | 120.1° | 120.6° |
| C17 | C16 | H6 | 121.2° | 120.1° |
| C16 | C17 | H7 | 119.9° | 119.7° |
| C17 | C18 | CL2 | 119.2° | 119.8° |
| C17 | C18 | C19 | 123.0° | 120.4° |
| C18 | C17 | H7 | 119.9° | 119.7° |
| CL2 | C18 | C19 | 117.8° | 119.8° |
| C18 | C19 | C20 | 117.3° | 119.7° |
| C18 | C19 | H8 | 121.3° | 120.2° |
| C19 | C20 | C6 | 133.1° | 133.8° |
| C19 | C20 | C15 | 120.0° | 119.9° |
| C20 | C19 | H8 | 121.3° | 120.1° |
| C5 | C21 | O4 | 122.4° | 120.0° |
| C5 | C21 | C28 | 120.1° | 119.9° |
| C21 | O4 | C22 | 114.4° | 117.0° |
| O4 | C21 | C28 | 117.5° | 120.1° |
| O4 | C22 | C23 | 111.3° | 109.5° |
| O4 | C22 | H10 | 109.0° | 109.5° |
| O4 | C22 | H9 | 109.0° | 109.5° |
| C22 | C23 | C24 | 112.4° | 109.5° |
| C22 | C23 | C27 | 114.9° | 109.5° |
| C23 | C22 | H10 | 109.0° | 109.5° |
| C23 | C22 | H9 | 109.0° | 109.5° |
| C22 | C23 | H11 | 106.5° | 109.6° |
| C23 | C24 | C25 | 108.4° | 109.1° |
| C24 | C23 | C27 | 109.6° | 109.0° |
| C24 | C23 | H11 | 106.5° | 109.6° |
| C23 | C24 | H12 | 109.7° | 109.5° |
| C23 | C24 | H13 | 109.7° | 109.5° |
| C24 | C25 | O5 | 112.6° | 109.4° |
| C25 | C24 | H12 | 109.7° | 109.5° |
| C25 | C24 | H13 | 109.7° | 109.5° |
| C24 | C25 | H15 | 108.7° | 109.5° |
| C24 | C25 | H14 | 108.7° | 109.5° |
| C25 | O5 | C26 | 116.2° | 114.1° |
| O5 | C25 | H15 | 108.7° | 109.4° |
| O5 | C25 | H14 | 108.7° | 109.5° |
| O5 | C26 | C27 | 113.2° | 109.4° |
| O5 | C26 | H16 | 108.5° | 109.5° |
| O5 | C26 | H17 | 108.5° | 109.5° |
| C26 | C27 | C23 | 110.2° | 109.1° |
| C27 | C26 | H16 | 108.5° | 109.5° |
| C27 | C26 | H17 | 108.6° | 109.4° |
| C26 | C27 | H19 | 109.3° | 109.5° |
| C26 | C27 | H18 | 109.3° | 109.5° |
| C21 | C28 | C2 | 120.3° | 119.9° |
| C21 | C28 | H20 | 119.8° | 120.1° |
| C2 | C28 | H20 | 119.8° | 120.0° |
| C6 | C20 | C15 | 106.9° | 106.3° |
| C27 | C23 | H11 | 106.4° | 109.6° |
| C23 | C27 | H19 | 109.3° | 109.5° |
| C23 | C27 | H18 | 109.3° | 109.5° |
| H10 | C22 | H9 | 109.4° | 109.4° |
| H12 | C24 | H13 | 109.5° | 109.6° |
| H15 | C25 | H14 | 109.5° | 109.4° |
| H16 | C26 | H17 | 109.4° | 109.5° |
| H19 | C27 | H18 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | O2 | C2 | 176.5° | 179.9° |
| O1 | C1 | C2 | C3 | 7.1° | 179.9° |
| O1 | C1 | C2 | C28 | 171.0° | 0.1° |
| O1 | C1 | O2 | H21 | 0.0° | 0.0° |
| O2 | C1 | C2 | C3 | 176.1° | 0.0° |
| O2 | C1 | C2 | C28 | 5.8° | 180.0° |
| C1 | C2 | C3 | C28 | 178.1° | 180.0° |
| C1 | C2 | C3 | C4 | 178.9° | 179.9° |
| C1 | C2 | C28 | C21 | 179.7° | 179.7° |
| C2 | C1 | O2 | H21 | 176.6° | 180.0° |
| C1 | C2 | C3 | H1 | 1.1° | 0.0° |
| C1 | C2 | C28 | H20 | 0.3° | 0.0° |
| C2 | C3 | C4 | H1 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 0.9° | 0.0° |
| C3 | C2 | C28 | C21 | 1.6° | 0.3° |
| C2 | C3 | C4 | H2 | 179.1° | 180.0° |
| C3 | C2 | C28 | H20 | 178.4° | 180.0° |
| C3 | C4 | C5 | H2 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 176.4° | 180.0° |
| C3 | C4 | C5 | C21 | 1.7° | 0.3° |
| C4 | C3 | C2 | C28 | 0.8° | 0.0° |
| C4 | C5 | C6 | C21 | 174.5° | 179.7° |
| C4 | C5 | C6 | N1 | 43.4° | 130.5° |
| C4 | C5 | C21 | O4 | 177.9° | 179.8° |
| C4 | C5 | C21 | C28 | 0.9° | 0.6° |
| C4 | C5 | C6 | C20 | 127.2° | 49.9° |
| C5 | C4 | C3 | H1 | 179.1° | 180.0° |
| C5 | C6 | N1 | C20 | 172.3° | 179.7° |
| C5 | C6 | N1 | N2 | 176.6° | 179.7° |
| C5 | C6 | C20 | C19 | 6.4° | 0.3° |
| C6 | C5 | C21 | O4 | 3.5° | 0.1° |
| C6 | C5 | C21 | C28 | 175.2° | 179.7° |
| C5 | C6 | C20 | C15 | 174.7° | 179.7° |
| C6 | C5 | C4 | H2 | 3.6° | 0.0° |
| C6 | N1 | N2 | C7 | 178.9° | 180.0° |
| C6 | N1 | N2 | C15 | 3.8° | 0.1° |
| N1 | C6 | C20 | C19 | 177.9° | 180.0° |
| N1 | C6 | C5 | C21 | 142.1° | 49.2° |
| N1 | C6 | C20 | C15 | 3.2° | 0.0° |
| N1 | N2 | C7 | C15 | 174.1° | 179.9° |
| N1 | N2 | C7 | O3 | 164.0° | 85.6° |
| N1 | N2 | C7 | C8 | 18.6° | 94.4° |
| N1 | N2 | C15 | C16 | 178.6° | 180.0° |
| N2 | N1 | C6 | C20 | 4.2° | 0.0° |
| N1 | N2 | C15 | C20 | 1.8° | 0.0° |
| N2 | C7 | O3 | C8 | 177.2° | 180.0° |
| N2 | C7 | C8 | C9 | 59.9° | 6.2° |
| C7 | N2 | C15 | C16 | 4.0° | 0.0° |
| N2 | C7 | C8 | C13 | 120.5° | 173.3° |
| C7 | N2 | C15 | C20 | 176.3° | 180.0° |
| O3 | C7 | C8 | C9 | 117.4° | 173.8° |
| O3 | C7 | N2 | C15 | 21.9° | 94.3° |
| O3 | C7 | C8 | C13 | 62.2° | 6.7° |
| C7 | C8 | C9 | C13 | 179.6° | 179.5° |
| C7 | C8 | C9 | CL1 | 0.8° | 0.0° |
| C7 | C8 | C9 | C10 | 179.7° | 180.0° |
| C7 | C8 | C13 | C12 | 178.7° | 179.8° |
| C7 | C8 | C13 | C14 | 1.2° | 0.3° |
| C8 | C7 | N2 | C15 | 155.5° | 85.7° |
| C8 | C9 | CL1 | C10 | 179.5° | 180.0° |
| C8 | C9 | C10 | C11 | 0.5° | 0.6° |
| C9 | C8 | C13 | C12 | 0.9° | 0.3° |
| C9 | C8 | C13 | C14 | 178.4° | 179.7° |
| C8 | C9 | C10 | H3 | 179.5° | 179.8° |
| CL1 | C9 | C10 | C11 | 180.0° | 179.5° |
| CL1 | C9 | C8 | C13 | 179.5° | 179.5° |
| CL1 | C9 | C10 | H3 | 0.0° | 0.2° |
| C9 | C10 | C11 | H3 | 180.0° | 179.7° |
| C9 | C10 | C11 | C12 | 0.0° | 0.3° |
| C10 | C9 | C8 | C13 | 0.1° | 0.6° |
| C9 | C10 | C11 | H4 | 180.0° | 179.8° |
| C10 | C11 | C12 | H4 | 180.0° | 179.9° |
| C10 | C11 | C12 | C13 | 1.0° | 0.0° |
| C10 | C11 | C12 | H5 | 179.0° | 179.9° |
| C11 | C12 | C13 | H5 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 179.1° | 180.0° |
| C11 | C12 | C13 | C8 | 1.4° | 0.0° |
| C12 | C11 | C10 | H3 | 180.0° | 180.0° |
| C12 | C13 | C14 | C8 | 177.6° | 180.0° |
| C12 | C13 | C14 | F1 | 101.5° | 0.0° |
| C12 | C13 | C14 | F2 | 137.3° | 120.0° |
| C12 | C13 | C14 | F3 | 15.8° | 120.0° |
| C13 | C12 | C11 | H4 | 179.0° | 180.0° |
| C13 | C14 | F1 | F2 | 123.9° | 120.0° |
| C13 | C14 | F1 | F3 | 122.2° | 120.0° |
| C13 | C14 | F2 | F3 | 124.4° | 120.0° |
| C14 | C13 | C12 | H5 | 0.9° | 0.0° |
| F1 | C14 | F2 | F3 | 111.8° | 120.1° |
| F1 | C14 | C13 | C8 | 76.1° | 180.0° |
| F2 | C14 | C13 | C8 | 45.2° | 60.1° |
| F3 | C14 | C13 | C8 | 166.6° | 59.9° |
| N2 | C15 | C16 | C20 | 179.6° | 180.0° |
| N2 | C15 | C16 | C17 | 178.6° | 180.0° |
| N2 | C15 | C20 | C19 | 179.9° | 180.0° |
| N2 | C15 | C20 | C6 | 0.8° | 0.0° |
| N2 | C15 | C16 | H6 | 1.4° | 0.0° |
| C15 | C16 | C17 | H6 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 1.6° | 0.0° |
| C16 | C15 | C20 | C19 | 0.2° | 0.0° |
| C16 | C15 | C20 | C6 | 178.9° | 180.0° |
| C15 | C16 | C17 | H7 | 178.4° | 180.0° |
| C16 | C17 | C18 | H7 | 180.0° | 179.9° |
| C16 | C17 | C18 | CL2 | 179.4° | 180.0° |
| C16 | C17 | C18 | C19 | 0.2° | 0.0° |
| C17 | C16 | C15 | C20 | 1.8° | 0.0° |
| C17 | C18 | CL2 | C19 | 179.2° | 180.0° |
| C17 | C18 | C19 | C20 | 1.8° | 0.0° |
| C18 | C17 | C16 | H6 | 178.4° | 180.0° |
| C17 | C18 | C19 | H8 | 178.2° | 179.9° |
| CL2 | C18 | C19 | C20 | 179.0° | 179.9° |
| CL2 | C18 | C17 | H7 | 0.6° | 0.1° |
| CL2 | C18 | C19 | H8 | 1.0° | 0.1° |
| C18 | C19 | C20 | H8 | 180.0° | 179.9° |
| C18 | C19 | C20 | C6 | 179.6° | 180.0° |
| C18 | C19 | C20 | C15 | 1.6° | 0.1° |
| C19 | C18 | C17 | H7 | 179.8° | 179.9° |
| C19 | C20 | C6 | C15 | 178.9° | 180.0° |
| C5 | C21 | O4 | C28 | 178.8° | 179.6° |
| C5 | C21 | O4 | C22 | 144.7° | 175.0° |
| C5 | C21 | C28 | C2 | 0.8° | 0.7° |
| C21 | C5 | C6 | C20 | 47.2° | 130.4° |
| C21 | C5 | C4 | H2 | 178.3° | 179.7° |
| C5 | C21 | C28 | H20 | 179.2° | 179.7° |
| C21 | O4 | C22 | C23 | 167.6° | 175.0° |
| O4 | C21 | C28 | C2 | 179.6° | 179.7° |
| C21 | O4 | C22 | H10 | 47.3° | 65.0° |
| C21 | O4 | C22 | H9 | 72.1° | 55.0° |
| O4 | C21 | C28 | H20 | 0.4° | 0.1° |
| O4 | C22 | C23 | H10 | 120.3° | 120.0° |
| O4 | C22 | C23 | H9 | 120.3° | 120.0° |
| O4 | C22 | C23 | C24 | 135.9° | 178.6° |
| C22 | O4 | C21 | C28 | 36.6° | 5.4° |
| O4 | C22 | C23 | C27 | 9.8° | 61.9° |
| O4 | C22 | H10 | H9 | 119.2° | 120.0° |
| O4 | C22 | C23 | H11 | 107.8° | 58.4° |
| C22 | C23 | C24 | C27 | 129.0° | 119.8° |
| C22 | C23 | C24 | H11 | 116.3° | 120.2° |
| C22 | C23 | C24 | C25 | 172.0° | 176.8° |
| C22 | C23 | C27 | C26 | 175.8° | 176.9° |
| C22 | C23 | C27 | H11 | 117.6° | 120.2° |
| C23 | C22 | H10 | H9 | 119.2° | 120.0° |
| C22 | C23 | C24 | H12 | 52.2° | 63.3° |
| C22 | C23 | C24 | H13 | 68.1° | 56.9° |
| C22 | C23 | C27 | H19 | 55.6° | 57.0° |
| C22 | C23 | C27 | H18 | 64.1° | 63.2° |
| C23 | C24 | C25 | H12 | 119.8° | 119.8° |
| C23 | C24 | C25 | H13 | 119.8° | 119.9° |
| C23 | C24 | C25 | O5 | 56.0° | 57.7° |
| C24 | C23 | C27 | C26 | 56.6° | 57.0° |
| C24 | C23 | C27 | H11 | 114.7° | 119.9° |
| C24 | C23 | C22 | H10 | 103.8° | 58.6° |
| C24 | C23 | C22 | H9 | 15.6° | 61.4° |
| C23 | C24 | H12 | H13 | 120.5° | 120.2° |
| C23 | C24 | C25 | H15 | 64.4° | 177.6° |
| C23 | C24 | C25 | H14 | 176.5° | 62.4° |
| C24 | C23 | C27 | H19 | 176.8° | 62.9° |
| C24 | C23 | C27 | H18 | 63.5° | 176.9° |
| C24 | C25 | O5 | H15 | 120.4° | 120.0° |
| C24 | C25 | O5 | H14 | 120.5° | 120.1° |
| C24 | C25 | O5 | C26 | 51.7° | 61.2° |
| C25 | C24 | C23 | C27 | 59.0° | 57.0° |
| C25 | C24 | C23 | H11 | 55.7° | 62.9° |
| C25 | C24 | H12 | H13 | 120.5° | 120.2° |
| C24 | C25 | H15 | H14 | 118.6° | 120.1° |
| C25 | O5 | C26 | C27 | 48.6° | 61.2° |
| O5 | C25 | C24 | H12 | 175.8° | 177.5° |
| O5 | C25 | C24 | H13 | 63.8° | 62.2° |
| O5 | C25 | H15 | H14 | 118.6° | 120.0° |
| C25 | O5 | C26 | H16 | 72.0° | 58.8° |
| C25 | O5 | C26 | H17 | 169.1° | 178.9° |
| O5 | C26 | C27 | H16 | 120.6° | 120.0° |
| O5 | C26 | C27 | H17 | 120.6° | 119.9° |
| O5 | C26 | C27 | C23 | 50.3° | 57.6° |
| C26 | O5 | C25 | H15 | 68.7° | 178.8° |
| C26 | O5 | C25 | H14 | 172.2° | 58.8° |
| O5 | C26 | H16 | H17 | 118.3° | 120.0° |
| O5 | C26 | C27 | H19 | 170.4° | 62.2° |
| O5 | C26 | C27 | H18 | 69.8° | 177.5° |
| C26 | C27 | C23 | H19 | 120.1° | 119.9° |
| C26 | C27 | C23 | H18 | 120.1° | 119.9° |
| C26 | C27 | C23 | H11 | 58.1° | 62.9° |
| C27 | C26 | H16 | H17 | 118.3° | 120.0° |
| C26 | C27 | H19 | H18 | 119.6° | 120.2° |
| C21 | C28 | C2 | H20 | 180.0° | 179.7° |
| C28 | C2 | C3 | H1 | 179.2° | 179.9° |
| C6 | C20 | C19 | H8 | 0.4° | 0.1° |
| C27 | C23 | C22 | H10 | 130.0° | 178.1° |
| C27 | C23 | C22 | H9 | 110.5° | 58.1° |
| C27 | C23 | C24 | H12 | 178.8° | 176.8° |
| C27 | C23 | C24 | H13 | 60.9° | 62.9° |
| C23 | C27 | C26 | H16 | 70.3° | 62.4° |
| C23 | C27 | C26 | H17 | 170.9° | 177.6° |
| C23 | C27 | H19 | H18 | 119.6° | 120.2° |
| C8 | C13 | C12 | H5 | 178.6° | 179.9° |
| C20 | C15 | C16 | H6 | 178.2° | 180.0° |
| C15 | C20 | C19 | H8 | 178.4° | 179.9° |
| H2 | C4 | C3 | H1 | 0.9° | 0.0° |
| H3 | C10 | C11 | H4 | 0.0° | 0.1° |
| H4 | C11 | C12 | H5 | 1.0° | 0.0° |
| H6 | C16 | C17 | H7 | 1.6° | 0.0° |
| H10 | C22 | C23 | H11 | 12.5° | 61.6° |
| H9 | C22 | C23 | H11 | 131.9° | 178.4° |
| H11 | C23 | C24 | H12 | 64.1° | 56.9° |
| H11 | C23 | C24 | H13 | 175.6° | 177.2° |
| H11 | C23 | C27 | H19 | 62.0° | 177.2° |
| H11 | C23 | C27 | H18 | 178.2° | 57.0° |
| H12 | C24 | C25 | H15 | 55.4° | 62.5° |
| H12 | C24 | C25 | H14 | 63.7° | 57.5° |
| H13 | C24 | C25 | H15 | 175.7° | 57.7° |
| H13 | C24 | C25 | H14 | 56.6° | 177.7° |
| H16 | C26 | C27 | H19 | 49.9° | 177.7° |
| H16 | C26 | C27 | H18 | 169.6° | 57.5° |
| H17 | C26 | C27 | H19 | 69.0° | 57.7° |
| H17 | C26 | C27 | H18 | 50.7° | 62.5° |
