A1IQ3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | sing | 1.43Å | 1.43Å | |
| O1 | C2 | sing | 1.36Å | 1.37Å | |
| C2 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | C7 | sing | 1.51Å | 1.50Å | |
| C7 | O2 | sing | 1.43Å | 1.44Å | |
| O2 | C8 | sing | 1.36Å | 1.36Å | |
| C8 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| C9 | C10 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.48Å | 1.51Å | |
| C11 | O3 | doub | 1.22Å | 1.25Å | |
| C11 | O4 | sing | 1.35Å | 1.25Å | |
| C10 | C12 | doub | 1.40Å | 1.38Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | doub | 1.40Å | 1.40Å | Aromatic |
| C14 | C15 | sing | 1.48Å | 1.47Å | |
| C15 | N1 | doub | 1.31Å | 1.33Å | Aromatic |
| N1 | N2 | sing | 1.40Å | 1.39Å | Aromatic |
| N2 | C16 | sing | 1.35Å | 1.41Å | |
| C16 | O5 | doub | 1.22Å | 1.21Å | |
| C16 | C17 | sing | 1.48Å | 1.49Å | |
| C17 | C18 | doub | 1.40Å | 1.39Å | Aromatic |
| C18 | CL1 | sing | 1.74Å | 1.73Å | |
| C18 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.50Å | |
| C23 | F1 | sing | 1.40Å | 1.32Å | |
| C23 | F2 | sing | 1.40Å | 1.33Å | |
| C23 | F3 | sing | 1.40Å | 1.33Å | |
| N2 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | C25 | doub | 1.39Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| C26 | C27 | doub | 1.39Å | 1.40Å | Aromatic |
| C27 | CL2 | sing | 1.74Å | 1.75Å | |
| C27 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C28 | C29 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | C30 | sing | 1.39Å | 1.38Å | Aromatic |
| C8 | C14 | sing | 1.40Å | 1.41Å | Aromatic |
| C15 | C29 | sing | 1.47Å | 1.43Å | Aromatic |
| C17 | C22 | sing | 1.40Å | 1.40Å | Aromatic |
| C24 | C29 | sing | 1.41Å | 1.41Å | Aromatic |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C4 | H5 | sing | 1.08Å | 1.08Å | |
| C3 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C5 | H6 | sing | 1.08Å | 1.08Å | |
| C26 | H16 | sing | 1.08Å | 1.08Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.08Å | 1.08Å | |
| C19 | H12 | sing | 1.08Å | 1.08Å | |
| C20 | H13 | sing | 1.08Å | 1.08Å | |
| C21 | H14 | sing | 1.08Å | 1.08Å | |
| C28 | H17 | sing | 1.08Å | 1.08Å | |
| C30 | H18 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| O4 | H19 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | O1 | C2 | 117.9° | 117.0° |
| O1 | C1 | H3 | 109.5° | 109.5° |
| O1 | C1 | H2 | 109.5° | 109.5° |
| O1 | C1 | H1 | 109.5° | 109.5° |
| O1 | C2 | C3 | 118.1° | 120.1° |
| O1 | C2 | C30 | 122.1° | 120.0° |
| C2 | C3 | C4 | 119.9° | 120.0° |
| C3 | C2 | C30 | 119.8° | 119.9° |
| C2 | C3 | H4 | 120.1° | 120.0° |
| C3 | C4 | C5 | 120.5° | 120.1° |
| C3 | C4 | H5 | 119.8° | 120.0° |
| C4 | C3 | H4 | 120.1° | 120.0° |
| C4 | C5 | C6 | 120.2° | 120.1° |
| C5 | C4 | H5 | 119.8° | 119.9° |
| C4 | C5 | H6 | 119.9° | 120.0° |
| C5 | C6 | C7 | 120.8° | 120.0° |
| C5 | C6 | C30 | 119.4° | 120.1° |
| C6 | C5 | H6 | 119.9° | 119.9° |
| C6 | C7 | O2 | 111.8° | 109.5° |
| C7 | C6 | C30 | 119.8° | 119.9° |
| C6 | C7 | H7 | 108.9° | 109.5° |
| C6 | C7 | H8 | 108.9° | 109.5° |
| C7 | O2 | C8 | 117.4° | 117.0° |
| O2 | C7 | H7 | 108.9° | 109.5° |
| O2 | C7 | H8 | 108.9° | 109.4° |
| O2 | C8 | C9 | 120.4° | 120.0° |
| O2 | C8 | C14 | 119.2° | 120.1° |
| C8 | C9 | C10 | 120.6° | 119.9° |
| C9 | C8 | C14 | 120.2° | 119.9° |
| C8 | C9 | H9 | 119.7° | 120.0° |
| C9 | C10 | C11 | 120.3° | 120.0° |
| C9 | C10 | C12 | 119.4° | 120.0° |
| C10 | C9 | H9 | 119.7° | 120.1° |
| C10 | C11 | O3 | 119.1° | 120.0° |
| C10 | C11 | O4 | 117.7° | 120.0° |
| C11 | C10 | C12 | 120.3° | 120.0° |
| O3 | C11 | O4 | 123.2° | 120.0° |
| C11 | O4 | H19 | 109.5° | 117.1° |
| C10 | C12 | C13 | 120.2° | 120.1° |
| C10 | C12 | H10 | 119.9° | 119.9° |
| C12 | C13 | C14 | 121.3° | 120.1° |
| C13 | C12 | H10 | 119.9° | 120.0° |
| C12 | C13 | H11 | 119.4° | 120.0° |
| C13 | C14 | C15 | 118.2° | 120.0° |
| C13 | C14 | C8 | 118.2° | 120.0° |
| C14 | C13 | H11 | 119.4° | 120.0° |
| C14 | C15 | N1 | 119.6° | 126.2° |
| C15 | C14 | C8 | 123.3° | 120.0° |
| C14 | C15 | C29 | 130.4° | 126.2° |
| C15 | N1 | N2 | 107.5° | 110.0° |
| N1 | C15 | C29 | 109.8° | 107.7° |
| N1 | N2 | C16 | 121.2° | 125.4° |
| N1 | N2 | C24 | 110.4° | 109.2° |
| N2 | C16 | O5 | 120.9° | 120.0° |
| N2 | C16 | C17 | 117.4° | 120.0° |
| C16 | N2 | C24 | 128.3° | 125.4° |
| O5 | C16 | C17 | 121.7° | 120.0° |
| C16 | C17 | C18 | 118.8° | 120.2° |
| C16 | C17 | C22 | 122.1° | 120.2° |
| C17 | C18 | CL1 | 120.4° | 120.1° |
| C17 | C18 | C19 | 121.3° | 119.8° |
| C18 | C17 | C22 | 119.1° | 119.7° |
| CL1 | C18 | C19 | 118.3° | 120.1° |
| C18 | C19 | C20 | 119.2° | 120.1° |
| C18 | C19 | H12 | 120.4° | 120.0° |
| C19 | C20 | C21 | 120.4° | 120.3° |
| C20 | C19 | H12 | 120.4° | 119.9° |
| C19 | C20 | H13 | 119.8° | 119.9° |
| C20 | C21 | C22 | 120.8° | 120.2° |
| C21 | C20 | H13 | 119.8° | 119.8° |
| C20 | C21 | H14 | 119.6° | 119.9° |
| C21 | C22 | C23 | 119.2° | 120.0° |
| C21 | C22 | C17 | 119.1° | 119.9° |
| C22 | C21 | H14 | 119.6° | 119.9° |
| C22 | C23 | F1 | 113.2° | 109.5° |
| C22 | C23 | F2 | 112.9° | 109.4° |
| C22 | C23 | F3 | 112.2° | 109.4° |
| C23 | C22 | C17 | 121.7° | 120.1° |
| F1 | C23 | F2 | 104.3° | 109.5° |
| F1 | C23 | F3 | 106.0° | 109.5° |
| F2 | C23 | F3 | 107.7° | 109.5° |
| N2 | C24 | C25 | 132.5° | 133.6° |
| N2 | C24 | C29 | 105.7° | 106.8° |
| C24 | C25 | C26 | 117.8° | 119.9° |
| C25 | C24 | C29 | 121.8° | 119.6° |
| C24 | C25 | H15 | 121.1° | 120.0° |
| C25 | C26 | C27 | 120.5° | 120.6° |
| C25 | C26 | H16 | 119.7° | 119.7° |
| C26 | C25 | H15 | 121.1° | 120.1° |
| C26 | C27 | CL2 | 118.5° | 119.8° |
| C26 | C27 | C28 | 122.6° | 120.4° |
| C27 | C26 | H16 | 119.8° | 119.7° |
| CL2 | C27 | C28 | 119.0° | 119.8° |
| C27 | C28 | C29 | 117.6° | 119.7° |
| C27 | C28 | H17 | 121.2° | 120.2° |
| C28 | C29 | C15 | 133.8° | 133.9° |
| C28 | C29 | C24 | 119.7° | 119.8° |
| C29 | C28 | H17 | 121.2° | 120.1° |
| C6 | C30 | C2 | 120.3° | 119.9° |
| C6 | C30 | H18 | 119.9° | 120.0° |
| C2 | C30 | H18 | 119.8° | 120.0° |
| C15 | C29 | C24 | 106.5° | 106.3° |
| H7 | C7 | H8 | 109.5° | 109.5° |
| H3 | C1 | H2 | 109.5° | 109.4° |
| H3 | C1 | H1 | 109.5° | 109.5° |
| H2 | C1 | H1 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | O1 | C2 | C3 | 149.5° | 0.0° |
| C1 | O1 | C2 | C30 | 30.1° | 180.0° |
| O1 | C1 | H3 | H2 | 120.0° | 120.0° |
| O1 | C1 | H3 | H1 | 120.0° | 120.0° |
| O1 | C1 | H2 | H1 | 120.0° | 120.0° |
| O1 | C2 | C3 | C30 | 179.6° | 179.9° |
| O1 | C2 | C3 | C4 | 179.5° | 180.0° |
| O1 | C2 | C30 | C6 | 179.8° | 179.7° |
| O1 | C2 | C3 | H4 | 0.5° | 0.1° |
| C2 | O1 | C1 | H3 | 180.0° | 60.0° |
| C2 | O1 | C1 | H2 | 60.0° | 59.9° |
| C2 | O1 | C1 | H1 | 60.0° | 180.0° |
| O1 | C2 | C30 | H18 | 0.2° | 0.1° |
| C2 | C3 | C4 | H4 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.6° | 0.0° |
| C3 | C2 | C30 | C6 | 0.2° | 0.2° |
| C2 | C3 | C4 | H5 | 179.4° | 179.7° |
| C3 | C2 | C30 | H18 | 179.8° | 180.0° |
| C3 | C4 | C5 | H5 | 180.0° | 179.7° |
| C3 | C4 | C5 | C6 | 0.6° | 0.3° |
| C4 | C3 | C2 | C30 | 0.1° | 0.0° |
| C3 | C4 | C5 | H6 | 179.4° | 179.8° |
| C4 | C5 | C6 | H6 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 179.6° | 179.9° |
| C4 | C5 | C6 | C30 | 0.3° | 0.5° |
| C5 | C4 | C3 | H4 | 179.5° | 180.0° |
| C5 | C6 | C7 | C30 | 179.3° | 179.4° |
| C5 | C6 | C7 | O2 | 53.2° | 95.0° |
| C5 | C6 | C30 | C2 | 0.1° | 0.5° |
| C6 | C5 | C4 | H5 | 179.4° | 180.0° |
| C5 | C6 | C7 | H7 | 173.5° | 145.0° |
| C5 | C6 | C7 | H8 | 67.2° | 24.9° |
| C5 | C6 | C30 | H18 | 179.8° | 179.7° |
| C6 | C7 | O2 | H7 | 120.4° | 120.0° |
| C6 | C7 | O2 | H8 | 120.3° | 120.0° |
| C6 | C7 | O2 | C8 | 167.7° | 175.0° |
| C7 | C6 | C30 | C2 | 179.2° | 179.9° |
| C6 | C7 | H7 | H8 | 118.9° | 120.0° |
| C7 | C6 | C5 | H6 | 0.4° | 0.1° |
| C7 | C6 | C30 | H18 | 0.8° | 0.3° |
| C7 | O2 | C8 | C9 | 14.5° | 5.1° |
| O2 | C7 | C6 | C30 | 126.1° | 85.6° |
| C7 | O2 | C8 | C14 | 160.2° | 174.9° |
| O2 | C7 | H7 | H8 | 118.9° | 120.0° |
| O2 | C8 | C9 | C14 | 174.7° | 180.0° |
| O2 | C8 | C9 | C10 | 178.3° | 180.0° |
| O2 | C8 | C14 | C13 | 179.6° | 179.7° |
| O2 | C8 | C14 | C15 | 7.0° | 0.0° |
| C8 | O2 | C7 | H7 | 47.4° | 55.0° |
| C8 | O2 | C7 | H8 | 71.9° | 65.0° |
| O2 | C8 | C9 | H9 | 1.7° | 0.0° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C8 | C9 | C10 | C11 | 178.1° | 180.0° |
| C8 | C9 | C10 | C12 | 0.8° | 0.3° |
| C9 | C8 | C14 | C13 | 4.8° | 0.3° |
| C9 | C8 | C14 | C15 | 178.2° | 180.0° |
| C9 | C10 | C11 | C12 | 178.9° | 179.7° |
| C9 | C10 | C11 | O3 | 25.8° | 0.3° |
| C9 | C10 | C11 | O4 | 152.4° | 179.7° |
| C9 | C10 | C12 | C13 | 0.7° | 0.3° |
| C10 | C9 | C8 | C14 | 3.6° | 0.0° |
| C9 | C10 | C12 | H10 | 179.3° | 179.7° |
| C10 | C11 | O3 | O4 | 178.1° | 180.0° |
| C11 | C10 | C12 | C13 | 179.5° | 180.0° |
| C11 | C10 | C12 | H10 | 0.4° | 0.0° |
| C11 | C10 | C9 | H9 | 1.9° | 0.0° |
| C10 | C11 | O4 | H19 | 178.1° | 180.0° |
| O3 | C11 | C10 | C12 | 155.4° | 180.0° |
| O3 | C11 | O4 | H19 | 0.0° | 0.0° |
| O4 | C11 | C10 | C12 | 26.4° | 0.0° |
| C10 | C12 | C13 | H10 | 180.0° | 179.9° |
| C10 | C12 | C13 | C14 | 0.7° | 0.1° |
| C10 | C12 | C13 | H11 | 179.3° | 180.0° |
| C12 | C10 | C9 | H9 | 179.2° | 179.7° |
| C12 | C13 | C14 | H11 | 180.0° | 180.0° |
| C12 | C13 | C14 | C15 | 177.2° | 180.0° |
| C12 | C13 | C14 | C8 | 3.4° | 0.3° |
| C13 | C14 | C15 | C8 | 173.4° | 179.7° |
| C13 | C14 | C15 | N1 | 41.2° | 130.5° |
| C13 | C14 | C15 | C29 | 133.1° | 49.7° |
| C14 | C13 | C12 | H10 | 179.3° | 180.0° |
| C14 | C15 | N1 | C29 | 175.4° | 179.8° |
| C14 | C15 | N1 | N2 | 177.3° | 179.8° |
| C14 | C15 | C29 | C28 | 4.2° | 0.3° |
| C14 | C15 | C29 | C24 | 175.9° | 179.8° |
| C15 | C14 | C13 | H11 | 2.8° | 0.0° |
| C15 | N1 | N2 | C16 | 179.9° | 179.9° |
| C15 | N1 | N2 | C24 | 2.0° | 0.0° |
| N1 | C15 | C29 | C28 | 179.0° | 180.0° |
| N1 | C15 | C14 | C8 | 145.4° | 49.8° |
| N1 | C15 | C29 | C24 | 1.1° | 0.0° |
| N1 | N2 | C16 | C24 | 177.5° | 179.9° |
| N1 | N2 | C16 | O5 | 165.1° | 94.2° |
| N1 | N2 | C16 | C17 | 15.8° | 85.9° |
| N1 | N2 | C24 | C25 | 179.2° | 180.0° |
| N2 | N1 | C15 | C29 | 1.8° | 0.0° |
| N1 | N2 | C24 | C29 | 1.3° | 0.0° |
| N2 | C16 | O5 | C17 | 179.1° | 180.0° |
| N2 | C16 | C17 | C18 | 57.3° | 4.6° |
| C16 | N2 | C24 | C25 | 1.5° | 0.1° |
| N2 | C16 | C17 | C22 | 122.3° | 175.4° |
| C16 | N2 | C24 | C29 | 179.0° | 179.9° |
| O5 | C16 | C17 | C18 | 121.8° | 175.4° |
| O5 | C16 | N2 | C24 | 17.4° | 85.8° |
| O5 | C16 | C17 | C22 | 58.6° | 4.6° |
| C16 | C17 | C18 | C22 | 179.6° | 180.0° |
| C16 | C17 | C18 | CL1 | 0.7° | 0.0° |
| C16 | C17 | C18 | C19 | 179.7° | 180.0° |
| C16 | C17 | C22 | C21 | 179.4° | 179.8° |
| C16 | C17 | C22 | C23 | 1.9° | 0.0° |
| C17 | C16 | N2 | C24 | 161.7° | 94.2° |
| C17 | C18 | CL1 | C19 | 179.1° | 180.0° |
| C17 | C18 | C19 | C20 | 0.6° | 0.1° |
| C18 | C17 | C22 | C21 | 1.0° | 0.2° |
| C18 | C17 | C22 | C23 | 178.5° | 180.0° |
| C17 | C18 | C19 | H12 | 179.4° | 179.9° |
| CL1 | C18 | C19 | C20 | 179.7° | 179.9° |
| CL1 | C18 | C17 | C22 | 178.9° | 180.0° |
| CL1 | C18 | C19 | H12 | 0.4° | 0.1° |
| C18 | C19 | C20 | H12 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 0.5° | 0.4° |
| C19 | C18 | C17 | C22 | 0.2° | 0.0° |
| C18 | C19 | C20 | H13 | 179.5° | 180.0° |
| C19 | C20 | C21 | H13 | 180.0° | 179.7° |
| C19 | C20 | C21 | C22 | 0.3° | 0.6° |
| C19 | C20 | C21 | H14 | 179.7° | 179.9° |
| C20 | C21 | C22 | H14 | 180.0° | 179.5° |
| C20 | C21 | C22 | C23 | 178.7° | 179.7° |
| C20 | C21 | C22 | C17 | 1.1° | 0.5° |
| C21 | C20 | C19 | H12 | 179.5° | 179.8° |
| C21 | C22 | C23 | C17 | 177.5° | 179.8° |
| C21 | C22 | C23 | F1 | 17.1° | 0.2° |
| C21 | C22 | C23 | F2 | 135.3° | 119.8° |
| C21 | C22 | C23 | F3 | 102.8° | 120.3° |
| C22 | C21 | C20 | H13 | 179.7° | 179.8° |
| C22 | C23 | F1 | F2 | 123.1° | 120.0° |
| C22 | C23 | F1 | F3 | 123.4° | 120.0° |
| C22 | C23 | F2 | F3 | 124.4° | 119.9° |
| C23 | C22 | C21 | H14 | 1.3° | 0.2° |
| F1 | C23 | F2 | F3 | 112.4° | 120.0° |
| F1 | C23 | C22 | C17 | 165.4° | 179.9° |
| F2 | C23 | C22 | C17 | 47.2° | 60.0° |
| F3 | C23 | C22 | C17 | 74.7° | 59.9° |
| N2 | C24 | C25 | C29 | 179.5° | 180.0° |
| N2 | C24 | C25 | C26 | 178.8° | 180.0° |
| N2 | C24 | C29 | C28 | 179.8° | 180.0° |
| N2 | C24 | C29 | C15 | 0.2° | 0.0° |
| N2 | C24 | C25 | H15 | 1.1° | 0.1° |
| C24 | C25 | C26 | H15 | 180.0° | 180.0° |
| C24 | C25 | C26 | C27 | 2.3° | 0.0° |
| C25 | C24 | C29 | C28 | 0.2° | 0.0° |
| C25 | C24 | C29 | C15 | 179.7° | 180.0° |
| C24 | C25 | C26 | H16 | 177.6° | 179.9° |
| C25 | C26 | C27 | H16 | 180.0° | 179.9° |
| C25 | C26 | C27 | CL2 | 178.7° | 180.0° |
| C25 | C26 | C27 | C28 | 1.6° | 0.1° |
| C26 | C25 | C24 | C29 | 1.7° | 0.0° |
| C26 | C27 | CL2 | C28 | 179.7° | 179.9° |
| C26 | C27 | C28 | C29 | 0.0° | 0.1° |
| C27 | C26 | C25 | H15 | 177.7° | 179.9° |
| C26 | C27 | C28 | H17 | 180.0° | 179.9° |
| CL2 | C27 | C28 | C29 | 179.7° | 180.0° |
| CL2 | C27 | C26 | H16 | 1.3° | 0.1° |
| CL2 | C27 | C28 | H17 | 0.3° | 0.0° |
| C27 | C28 | C29 | H17 | 180.0° | 180.0° |
| C27 | C28 | C29 | C15 | 179.4° | 180.0° |
| C27 | C28 | C29 | C24 | 0.6° | 0.1° |
| C28 | C27 | C26 | H16 | 178.4° | 180.0° |
| C28 | C29 | C15 | C24 | 179.9° | 180.0° |
| C6 | C30 | C2 | H18 | 180.0° | 179.7° |
| C30 | C6 | C7 | H7 | 5.8° | 34.4° |
| C30 | C6 | C7 | H8 | 113.5° | 154.4° |
| C30 | C6 | C5 | H6 | 179.7° | 179.5° |
| C30 | C2 | C3 | H4 | 179.9° | 180.0° |
| C8 | C14 | C15 | C29 | 40.3° | 129.9° |
| C8 | C14 | C13 | H11 | 176.6° | 179.7° |
| C14 | C8 | C9 | H9 | 176.5° | 180.0° |
| C15 | C29 | C28 | H17 | 0.5° | 0.0° |
| C17 | C22 | C21 | H14 | 178.9° | 180.0° |
| C29 | C24 | C25 | H15 | 178.3° | 180.0° |
| C24 | C29 | C28 | H17 | 179.4° | 180.0° |
| H10 | C12 | C13 | H11 | 0.7° | 0.0° |
| H5 | C4 | C3 | H4 | 0.6° | 0.3° |
| H5 | C4 | C5 | H6 | 0.6° | 0.0° |
| H16 | C26 | C25 | H15 | 2.3° | 0.0° |
| H3 | C1 | H2 | H1 | 120.0° | 120.0° |
| H12 | C19 | C20 | H13 | 0.5° | 0.1° |
| H13 | C20 | C21 | H14 | 0.4° | 0.3° |
