A1IK6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.47Å | |
| C2 | O1 | sing | 1.45Å | 1.46Å | |
| O1 | C3 | sing | 1.35Å | 1.33Å | |
| C5 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
| C5 | C4 | sing | 1.40Å | 1.38Å | Aromatic |
| C3 | O2 | doub | 1.21Å | 1.20Å | |
| C3 | C4 | sing | 1.48Å | 1.47Å | |
| C6 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | C32 | doub | 1.40Å | 1.39Å | Aromatic |
| C7 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| C32 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.51Å | 1.50Å | |
| CL2 | C29 | sing | 1.74Å | 1.75Å | |
| C9 | O3 | sing | 1.43Å | 1.43Å | |
| C29 | C30 | doub | 1.38Å | 1.37Å | Aromatic |
| C29 | C28 | sing | 1.39Å | 1.40Å | Aromatic |
| O3 | C10 | sing | 1.36Å | 1.36Å | |
| C30 | C31 | sing | 1.40Å | 1.40Å | Aromatic |
| O4 | C13 | doub | 1.22Å | 1.24Å | |
| C28 | C27 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | C16 | sing | 1.40Å | 1.40Å | Aromatic |
| C13 | C12 | sing | 1.48Å | 1.49Å | |
| C13 | O5 | sing | 1.35Å | 1.24Å | |
| C12 | C14 | doub | 1.40Å | 1.38Å | Aromatic |
| C31 | C17 | sing | 1.47Å | 1.39Å | Aromatic |
| C31 | C26 | doub | 1.41Å | 1.41Å | Aromatic |
| C27 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | C17 | sing | 1.48Å | 1.47Å | |
| C16 | C15 | doub | 1.40Å | 1.39Å | Aromatic |
| C17 | N1 | doub | 1.31Å | 1.33Å | Aromatic |
| C26 | N2 | sing | 1.38Å | 1.38Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| N1 | N2 | sing | 1.40Å | 1.37Å | Aromatic |
| N2 | C18 | sing | 1.35Å | 1.41Å | |
| O6 | C18 | doub | 1.22Å | 1.21Å | |
| C18 | C19 | sing | 1.48Å | 1.49Å | |
| F1 | C25 | sing | 1.40Å | 1.31Å | |
| F2 | C25 | sing | 1.40Å | 1.31Å | |
| C25 | F3 | sing | 1.40Å | 1.32Å | |
| C25 | C24 | sing | 1.51Å | 1.49Å | |
| C19 | C24 | doub | 1.40Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.40Å | 1.39Å | Aromatic |
| CL1 | C20 | sing | 1.74Å | 1.74Å | |
| C24 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.37Å | Aromatic |
| C14 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C11 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | H5 | sing | 1.08Å | 1.08Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C1 | H8 | sing | 1.09Å | 1.10Å | |
| C1 | H9 | sing | 1.09Å | 1.10Å | |
| C1 | H10 | sing | 1.09Å | 1.10Å | |
| C15 | H11 | sing | 1.08Å | 1.08Å | |
| C2 | H12 | sing | 1.09Å | 1.10Å | |
| C2 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.08Å | 1.08Å | |
| C22 | H15 | sing | 1.08Å | 1.08Å | |
| C23 | H16 | sing | 1.08Å | 1.08Å | |
| C27 | H17 | sing | 1.08Å | 1.08Å | |
| C28 | H18 | sing | 1.08Å | 1.08Å | |
| C30 | H19 | sing | 1.08Å | 1.08Å | |
| C32 | H20 | sing | 1.08Å | 1.08Å | |
| O5 | H21 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | O1 | 108.3° | 109.5° |
| C2 | C1 | H8 | 109.5° | 109.5° |
| C2 | C1 | H9 | 109.5° | 109.5° |
| C2 | C1 | H10 | 109.5° | 109.4° |
| C1 | C2 | H12 | 109.8° | 109.4° |
| C1 | C2 | H13 | 109.8° | 109.5° |
| C2 | O1 | C3 | 116.3° | 117.0° |
| O1 | C2 | H12 | 109.8° | 109.5° |
| O1 | C2 | H13 | 109.8° | 109.5° |
| O1 | C3 | O2 | 123.4° | 120.0° |
| O1 | C3 | C4 | 112.3° | 120.0° |
| C6 | C5 | C4 | 120.1° | 119.8° |
| C5 | C6 | C7 | 120.0° | 120.2° |
| C6 | C5 | H2 | 119.9° | 120.1° |
| C5 | C6 | H3 | 120.0° | 119.9° |
| C5 | C4 | C3 | 120.8° | 120.2° |
| C5 | C4 | C32 | 119.4° | 119.7° |
| C4 | C5 | H2 | 119.9° | 120.1° |
| O2 | C3 | C4 | 124.3° | 120.0° |
| C3 | C4 | C32 | 119.8° | 120.1° |
| C6 | C7 | C8 | 120.6° | 120.3° |
| C7 | C6 | H3 | 120.0° | 119.9° |
| C6 | C7 | H5 | 119.7° | 119.9° |
| C4 | C32 | C8 | 120.9° | 119.9° |
| C4 | C32 | H20 | 119.6° | 120.1° |
| C7 | C8 | C32 | 119.0° | 120.1° |
| C7 | C8 | C9 | 120.7° | 119.9° |
| C8 | C7 | H5 | 119.7° | 119.9° |
| C32 | C8 | C9 | 120.3° | 120.0° |
| C8 | C32 | H20 | 119.6° | 120.1° |
| C8 | C9 | O3 | 110.1° | 109.5° |
| C8 | C9 | H6 | 109.3° | 109.4° |
| C8 | C9 | H7 | 109.3° | 109.5° |
| CL2 | C29 | C30 | 118.7° | 119.8° |
| CL2 | C29 | C28 | 118.5° | 119.8° |
| C9 | O3 | C10 | 117.7° | 117.0° |
| O3 | C9 | H6 | 109.3° | 109.5° |
| O3 | C9 | H7 | 109.3° | 109.5° |
| C30 | C29 | C28 | 122.7° | 120.4° |
| C29 | C30 | C31 | 117.6° | 119.7° |
| C29 | C30 | H19 | 121.2° | 120.2° |
| C29 | C28 | C27 | 120.3° | 120.6° |
| C29 | C28 | H18 | 119.9° | 119.7° |
| O3 | C10 | C11 | 120.6° | 120.0° |
| O3 | C10 | C16 | 119.1° | 120.1° |
| C30 | C31 | C17 | 133.4° | 133.8° |
| C30 | C31 | C26 | 119.7° | 119.9° |
| C31 | C30 | H19 | 121.2° | 120.1° |
| O4 | C13 | C12 | 117.7° | 120.0° |
| O4 | C13 | O5 | 124.5° | 120.0° |
| C28 | C27 | C26 | 117.9° | 119.9° |
| C28 | C27 | H17 | 121.1° | 120.1° |
| C27 | C28 | H18 | 119.8° | 119.7° |
| C10 | C11 | C12 | 120.2° | 119.9° |
| C11 | C10 | C16 | 120.3° | 119.9° |
| C10 | C11 | H4 | 119.9° | 120.0° |
| C11 | C12 | C13 | 119.6° | 120.0° |
| C11 | C12 | C14 | 119.9° | 120.0° |
| C12 | C11 | H4 | 119.9° | 120.0° |
| C10 | C16 | C17 | 122.2° | 120.0° |
| C10 | C16 | C15 | 118.7° | 120.0° |
| C12 | C13 | O5 | 117.8° | 120.0° |
| C13 | C12 | C14 | 120.5° | 120.0° |
| C13 | O5 | H21 | 109.5° | 117.0° |
| C12 | C14 | C15 | 120.2° | 120.1° |
| C12 | C14 | H1 | 119.9° | 120.0° |
| C17 | C31 | C26 | 106.8° | 106.3° |
| C31 | C17 | C16 | 130.5° | 126.2° |
| C31 | C17 | N1 | 110.0° | 107.6° |
| C31 | C26 | C27 | 121.8° | 119.6° |
| C31 | C26 | N2 | 105.5° | 106.9° |
| C27 | C26 | N2 | 132.7° | 133.6° |
| C26 | C27 | H17 | 121.1° | 120.0° |
| C17 | C16 | C15 | 119.0° | 120.0° |
| C16 | C17 | N1 | 119.3° | 126.2° |
| C16 | C15 | C14 | 120.7° | 120.1° |
| C16 | C15 | H11 | 119.7° | 119.9° |
| C17 | N1 | N2 | 107.6° | 110.0° |
| C26 | N2 | N1 | 110.1° | 109.2° |
| C26 | N2 | C18 | 129.4° | 125.4° |
| C15 | C14 | H1 | 119.9° | 119.9° |
| C14 | C15 | H11 | 119.6° | 120.0° |
| N1 | N2 | C18 | 120.5° | 125.4° |
| N2 | C18 | O6 | 120.4° | 120.0° |
| N2 | C18 | C19 | 118.1° | 120.0° |
| O6 | C18 | C19 | 121.6° | 120.0° |
| C18 | C19 | C24 | 122.1° | 120.2° |
| C18 | C19 | C20 | 118.6° | 120.1° |
| F1 | C25 | F2 | 105.9° | 109.5° |
| F1 | C25 | F3 | 105.8° | 109.5° |
| F1 | C25 | C24 | 113.1° | 109.4° |
| F2 | C25 | F3 | 105.8° | 109.5° |
| F2 | C25 | C24 | 112.4° | 109.4° |
| F3 | C25 | C24 | 113.2° | 109.5° |
| C25 | C24 | C19 | 122.1° | 120.0° |
| C25 | C24 | C23 | 118.9° | 120.1° |
| C24 | C19 | C20 | 119.3° | 119.6° |
| C19 | C24 | C23 | 119.0° | 119.9° |
| C19 | C20 | CL1 | 120.8° | 120.1° |
| C19 | C20 | C21 | 121.0° | 119.8° |
| CL1 | C20 | C21 | 118.2° | 120.1° |
| C24 | C23 | C22 | 120.6° | 120.2° |
| C24 | C23 | H16 | 119.7° | 119.9° |
| C20 | C21 | C22 | 119.4° | 120.2° |
| C20 | C21 | H14 | 120.3° | 119.9° |
| C23 | C22 | C21 | 120.7° | 120.3° |
| C23 | C22 | H15 | 119.7° | 119.8° |
| C22 | C23 | H16 | 119.7° | 119.9° |
| C22 | C21 | H14 | 120.3° | 119.9° |
| C21 | C22 | H15 | 119.7° | 119.9° |
| H6 | C9 | H7 | 109.5° | 109.5° |
| H8 | C1 | H9 | 109.5° | 109.5° |
| H8 | C1 | H10 | 109.5° | 109.5° |
| H9 | C1 | H10 | 109.5° | 109.4° |
| H12 | C2 | H13 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | O1 | H12 | 119.8° | 120.0° |
| C1 | C2 | O1 | H13 | 119.8° | 120.0° |
| C1 | C2 | O1 | C3 | 123.1° | 180.0° |
| C2 | C1 | H8 | H9 | 120.0° | 120.0° |
| C2 | C1 | H8 | H10 | 120.0° | 120.0° |
| C2 | C1 | H9 | H10 | 120.0° | 119.9° |
| C1 | C2 | H12 | H13 | 120.6° | 120.0° |
| C2 | O1 | C3 | O2 | 15.4° | 0.1° |
| C2 | O1 | C3 | C4 | 165.2° | 180.0° |
| O1 | C2 | C1 | H8 | 180.0° | 180.0° |
| O1 | C2 | C1 | H9 | 60.0° | 60.0° |
| O1 | C2 | C1 | H10 | 60.0° | 60.0° |
| O1 | C2 | H12 | H13 | 120.6° | 120.0° |
| O1 | C3 | C4 | C5 | 1.8° | 0.3° |
| O1 | C3 | O2 | C4 | 179.3° | 180.0° |
| O1 | C3 | C4 | C32 | 178.6° | 180.0° |
| C3 | O1 | C2 | H12 | 117.1° | 60.0° |
| C3 | O1 | C2 | H13 | 3.2° | 60.0° |
| C6 | C5 | C4 | H2 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 179.6° | 179.7° |
| C5 | C6 | C7 | H3 | 180.0° | 180.0° |
| C6 | C5 | C4 | C32 | 0.0° | 0.0° |
| C5 | C6 | C7 | C8 | 0.2° | 0.0° |
| C5 | C6 | C7 | H5 | 179.8° | 180.0° |
| C5 | C4 | C3 | O2 | 177.5° | 179.7° |
| C5 | C4 | C3 | C32 | 179.6° | 179.7° |
| C4 | C5 | C6 | C7 | 0.0° | 0.0° |
| C5 | C4 | C32 | C8 | 0.2° | 0.0° |
| C4 | C5 | C6 | H3 | 180.0° | 180.0° |
| C5 | C4 | C32 | H20 | 179.8° | 180.0° |
| O2 | C3 | C4 | C32 | 2.1° | 0.0° |
| C3 | C4 | C32 | C8 | 179.8° | 179.7° |
| C3 | C4 | C5 | H2 | 0.4° | 0.3° |
| C3 | C4 | C32 | H20 | 0.2° | 0.3° |
| C6 | C7 | C8 | H5 | 180.0° | 180.0° |
| C6 | C7 | C8 | C32 | 0.4° | 0.0° |
| C6 | C7 | C8 | C9 | 179.7° | 180.0° |
| C7 | C6 | C5 | H2 | 180.0° | 180.0° |
| C4 | C32 | C8 | C7 | 0.4° | 0.0° |
| C4 | C32 | C8 | H20 | 180.0° | 180.0° |
| C4 | C32 | C8 | C9 | 179.7° | 180.0° |
| C32 | C4 | C5 | H2 | 180.0° | 180.0° |
| C7 | C8 | C32 | C9 | 179.3° | 180.0° |
| C7 | C8 | C9 | O3 | 64.3° | 85.0° |
| C8 | C7 | C6 | H3 | 179.8° | 180.0° |
| C7 | C8 | C9 | H6 | 175.6° | 155.0° |
| C7 | C8 | C9 | H7 | 55.8° | 35.0° |
| C7 | C8 | C32 | H20 | 179.6° | 180.0° |
| C32 | C8 | C9 | O3 | 116.4° | 95.0° |
| C32 | C8 | C7 | H5 | 179.7° | 180.0° |
| C32 | C8 | C9 | H6 | 3.7° | 25.0° |
| C32 | C8 | C9 | H7 | 123.5° | 145.0° |
| C8 | C9 | O3 | H6 | 120.1° | 119.9° |
| C8 | C9 | O3 | H7 | 120.1° | 120.0° |
| C8 | C9 | O3 | C10 | 178.3° | 175.2° |
| C9 | C8 | C7 | H5 | 0.4° | 0.0° |
| C8 | C9 | H6 | H7 | 119.7° | 120.0° |
| C9 | C8 | C32 | H20 | 0.4° | 0.0° |
| CL2 | C29 | C30 | C28 | 179.7° | 179.9° |
| CL2 | C29 | C30 | C31 | 179.9° | 180.0° |
| CL2 | C29 | C28 | C27 | 179.8° | 180.0° |
| CL2 | C29 | C28 | H18 | 0.2° | 0.1° |
| CL2 | C29 | C30 | H19 | 0.1° | 0.1° |
| C9 | O3 | C10 | C11 | 6.4° | 5.0° |
| C9 | O3 | C10 | C16 | 174.7° | 174.2° |
| O3 | C9 | H6 | H7 | 119.7° | 120.1° |
| C29 | C30 | C31 | H19 | 180.0° | 179.9° |
| C30 | C29 | C28 | C27 | 0.5° | 0.0° |
| C29 | C30 | C31 | C17 | 178.4° | 180.0° |
| C29 | C30 | C31 | C26 | 0.1° | 0.0° |
| C30 | C29 | C28 | H18 | 179.5° | 180.0° |
| C28 | C29 | C30 | C31 | 0.2° | 0.1° |
| C29 | C28 | C27 | H18 | 180.0° | 180.0° |
| C29 | C28 | C27 | C26 | 0.5° | 0.0° |
| C29 | C28 | C27 | H17 | 179.4° | 180.0° |
| C28 | C29 | C30 | H19 | 179.8° | 180.0° |
| O3 | C10 | C11 | C16 | 178.9° | 179.2° |
| O3 | C10 | C11 | C12 | 179.8° | 179.9° |
| O3 | C10 | C16 | C17 | 3.3° | 0.8° |
| O3 | C10 | C16 | C15 | 179.1° | 179.8° |
| O3 | C10 | C11 | H4 | 0.2° | 0.8° |
| C10 | O3 | C9 | H6 | 58.2° | 64.8° |
| C10 | O3 | C9 | H7 | 61.6° | 55.2° |
| C30 | C31 | C17 | C26 | 178.4° | 180.0° |
| C30 | C31 | C26 | C27 | 0.0° | 0.0° |
| C30 | C31 | C17 | C16 | 4.9° | 0.0° |
| C30 | C31 | C17 | N1 | 179.9° | 180.0° |
| C30 | C31 | C26 | N2 | 179.5° | 180.0° |
| O4 | C13 | C12 | C11 | 7.3° | 0.0° |
| O4 | C13 | C12 | O5 | 178.9° | 180.0° |
| O4 | C13 | C12 | C14 | 173.4° | 180.0° |
| O4 | C13 | O5 | H21 | 0.0° | 0.0° |
| C28 | C27 | C26 | C31 | 0.3° | 0.0° |
| C28 | C27 | C26 | H17 | 180.0° | 180.0° |
| C28 | C27 | C26 | N2 | 179.6° | 180.0° |
| C10 | C11 | C12 | H4 | 180.0° | 179.1° |
| C10 | C11 | C12 | C13 | 179.6° | 179.4° |
| C10 | C11 | C12 | C14 | 0.3° | 0.6° |
| C11 | C10 | C16 | C17 | 177.7° | 180.0° |
| C11 | C10 | C16 | C15 | 2.0° | 0.6° |
| C12 | C11 | C10 | C16 | 0.9° | 0.8° |
| C11 | C12 | C13 | C14 | 179.3° | 180.0° |
| C11 | C12 | C13 | O5 | 171.6° | 180.0° |
| C11 | C12 | C14 | C15 | 0.3° | 0.1° |
| C11 | C12 | C14 | H1 | 179.7° | 179.7° |
| C10 | C16 | C17 | C31 | 51.8° | 138.7° |
| C10 | C16 | C17 | C15 | 175.8° | 179.4° |
| C10 | C16 | C17 | N1 | 133.6° | 41.3° |
| C10 | C16 | C15 | C14 | 1.9° | 0.0° |
| C16 | C10 | C11 | H4 | 179.1° | 179.9° |
| C10 | C16 | C15 | H11 | 178.1° | 180.0° |
| C13 | C12 | C14 | C15 | 179.6° | 179.9° |
| C13 | C12 | C14 | H1 | 0.4° | 0.3° |
| C13 | C12 | C11 | H4 | 0.5° | 0.3° |
| C12 | C13 | O5 | H21 | 178.8° | 180.0° |
| O5 | C13 | C12 | C14 | 7.7° | 0.0° |
| C12 | C14 | C15 | C16 | 0.8° | 0.2° |
| C12 | C14 | C15 | H1 | 180.0° | 179.8° |
| C14 | C12 | C11 | H4 | 179.8° | 179.7° |
| C12 | C14 | C15 | H11 | 179.2° | 179.7° |
| C17 | C31 | C26 | C27 | 178.7° | 180.0° |
| C31 | C17 | C16 | N1 | 174.6° | 180.0° |
| C31 | C17 | C16 | C15 | 124.0° | 41.9° |
| C17 | C31 | C26 | N2 | 0.8° | 0.0° |
| C31 | C17 | N1 | N2 | 1.9° | 0.0° |
| C17 | C31 | C30 | H19 | 1.6° | 0.0° |
| C31 | C26 | C27 | N2 | 179.3° | 180.0° |
| C26 | C31 | C17 | C16 | 176.7° | 180.0° |
| C26 | C31 | C17 | N1 | 1.7° | 0.0° |
| C31 | C26 | N2 | N1 | 0.4° | 0.0° |
| C31 | C26 | N2 | C18 | 178.5° | 180.0° |
| C31 | C26 | C27 | H17 | 179.7° | 180.0° |
| C26 | C31 | C30 | H19 | 179.9° | 180.0° |
| C27 | C26 | N2 | N1 | 179.8° | 180.0° |
| C27 | C26 | N2 | C18 | 2.1° | 0.0° |
| C26 | C27 | C28 | H18 | 179.5° | 180.0° |
| C17 | C16 | C15 | C14 | 177.8° | 179.4° |
| C16 | C17 | N1 | N2 | 177.5° | 180.0° |
| C17 | C16 | C15 | H11 | 2.2° | 0.6° |
| C15 | C16 | C17 | N1 | 50.6° | 138.1° |
| C16 | C15 | C14 | H11 | 180.0° | 179.9° |
| C16 | C15 | C14 | H1 | 179.2° | 180.0° |
| C17 | N1 | N2 | C26 | 1.4° | 0.0° |
| C17 | N1 | N2 | C18 | 179.8° | 180.0° |
| C26 | N2 | N1 | C18 | 178.4° | 180.0° |
| C26 | N2 | C18 | O6 | 24.9° | 94.4° |
| C26 | N2 | C18 | C19 | 154.8° | 85.6° |
| N2 | C26 | C27 | H17 | 0.4° | 0.0° |
| N1 | N2 | C18 | O6 | 157.1° | 85.6° |
| N1 | N2 | C18 | C19 | 23.2° | 94.4° |
| N2 | C18 | O6 | C19 | 179.7° | 180.0° |
| N2 | C18 | C19 | C24 | 56.3° | 173.8° |
| N2 | C18 | C19 | C20 | 123.6° | 6.5° |
| O6 | C18 | C19 | C24 | 123.3° | 6.2° |
| O6 | C18 | C19 | C20 | 56.7° | 173.5° |
| C18 | C19 | C24 | C25 | 0.5° | 0.0° |
| C18 | C19 | C24 | C20 | 179.9° | 179.7° |
| C18 | C19 | C20 | CL1 | 0.3° | 0.0° |
| C18 | C19 | C24 | C23 | 179.7° | 179.8° |
| C18 | C19 | C20 | C21 | 179.6° | 180.0° |
| F1 | C25 | F2 | F3 | 112.0° | 120.0° |
| F1 | C25 | F2 | C24 | 124.0° | 120.0° |
| F1 | C25 | F3 | C24 | 124.4° | 120.0° |
| F1 | C25 | C24 | C19 | 88.1° | 60.0° |
| F1 | C25 | C24 | C23 | 92.2° | 120.3° |
| F2 | C25 | F3 | C24 | 123.5° | 120.0° |
| F2 | C25 | C24 | C19 | 31.8° | 60.0° |
| F2 | C25 | C24 | C23 | 147.9° | 119.8° |
| F3 | C25 | C24 | C19 | 151.6° | 180.0° |
| F3 | C25 | C24 | C23 | 28.1° | 0.2° |
| C25 | C24 | C19 | C23 | 179.7° | 179.8° |
| C25 | C24 | C19 | C20 | 179.5° | 179.7° |
| C25 | C24 | C23 | C22 | 179.8° | 179.7° |
| C25 | C24 | C23 | H16 | 0.2° | 0.1° |
| C24 | C19 | C20 | CL1 | 179.8° | 179.8° |
| C24 | C19 | C20 | C21 | 0.4° | 0.3° |
| C19 | C24 | C23 | C22 | 0.1° | 0.5° |
| C19 | C24 | C23 | H16 | 179.9° | 179.7° |
| C19 | C20 | CL1 | C21 | 179.9° | 180.0° |
| C20 | C19 | C24 | C23 | 0.2° | 0.5° |
| C19 | C20 | C21 | C22 | 0.2° | 0.0° |
| C19 | C20 | C21 | H14 | 179.8° | 180.0° |
| CL1 | C20 | C21 | C22 | 179.9° | 180.0° |
| CL1 | C20 | C21 | H14 | 0.0° | 0.0° |
| C24 | C23 | C22 | H16 | 180.0° | 179.8° |
| C24 | C23 | C22 | C21 | 0.3° | 0.3° |
| C24 | C23 | C22 | H15 | 179.7° | 179.8° |
| C20 | C21 | C22 | C23 | 0.1° | 0.0° |
| C20 | C21 | C22 | H14 | 180.0° | 180.0° |
| C20 | C21 | C22 | H15 | 179.9° | 180.0° |
| C23 | C22 | C21 | H15 | 180.0° | 179.9° |
| C23 | C22 | C21 | H14 | 179.8° | 180.0° |
| C21 | C22 | C23 | H16 | 179.7° | 179.9° |
| H1 | C14 | C15 | H11 | 0.8° | 0.1° |
| H2 | C5 | C6 | H3 | 0.0° | 0.0° |
| H3 | C6 | C7 | H5 | 0.1° | 0.0° |
| H8 | C1 | H9 | H10 | 120.0° | 120.0° |
| H8 | C1 | C2 | H12 | 60.2° | 60.0° |
| H8 | C1 | C2 | H13 | 60.2° | 60.0° |
| H9 | C1 | C2 | H12 | 59.8° | 60.1° |
| H9 | C1 | C2 | H13 | 179.8° | NaN° |
| H10 | C1 | C2 | H12 | 179.8° | NaN° |
| H10 | C1 | C2 | H13 | 59.8° | 60.1° |
| H14 | C21 | C22 | H15 | 0.1° | 0.1° |
| H15 | C22 | C23 | H16 | 0.3° | 0.0° |
| H17 | C27 | C28 | H18 | 0.5° | 0.0° |
