A1I6O
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.50Å | |
| C2 | N1 | sing | 1.46Å | 1.46Å | |
| N1 | C3 | sing | 1.35Å | 1.34Å | |
| C3 | O1 | doub | 1.22Å | 1.23Å | |
| C3 | C4 | sing | 1.48Å | 1.50Å | |
| C4 | C5 | doub | 1.40Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | C7 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.51Å | 1.50Å | |
| C9 | O2 | sing | 1.43Å | 1.43Å | |
| O2 | C10 | sing | 1.36Å | 1.36Å | |
| C10 | C11 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.48Å | 1.50Å | |
| C13 | O3 | doub | 1.22Å | 1.26Å | |
| C13 | O4 | sing | 1.35Å | 1.26Å | |
| C12 | C14 | doub | 1.40Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | C16 | doub | 1.40Å | 1.40Å | Aromatic |
| C16 | C17 | sing | 1.48Å | 1.47Å | |
| C17 | N2 | doub | 1.31Å | 1.32Å | Aromatic |
| N2 | N3 | sing | 1.40Å | 1.38Å | Aromatic |
| N3 | C18 | sing | 1.35Å | 1.39Å | |
| C18 | O5 | doub | 1.22Å | 1.21Å | |
| C18 | C19 | sing | 1.48Å | 1.49Å | |
| C19 | C20 | doub | 1.40Å | 1.39Å | Aromatic |
| C20 | CL1 | sing | 1.74Å | 1.75Å | |
| C20 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C25 | sing | 1.51Å | 1.51Å | |
| C25 | F1 | sing | 1.40Å | 1.32Å | |
| C25 | F2 | sing | 1.40Å | 1.34Å | |
| C25 | F3 | sing | 1.40Å | 1.33Å | |
| N3 | C26 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | doub | 1.39Å | 1.39Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.38Å | Aromatic |
| C28 | C29 | doub | 1.39Å | 1.40Å | Aromatic |
| C29 | CL2 | sing | 1.74Å | 1.74Å | |
| C29 | C30 | sing | 1.38Å | 1.37Å | Aromatic |
| C30 | C31 | doub | 1.40Å | 1.40Å | Aromatic |
| C8 | C32 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C32 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | C16 | sing | 1.40Å | 1.40Å | Aromatic |
| C17 | C31 | sing | 1.47Å | 1.43Å | Aromatic |
| C19 | C24 | sing | 1.40Å | 1.40Å | Aromatic |
| C26 | C31 | sing | 1.41Å | 1.40Å | Aromatic |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.08Å | 1.08Å | |
| C6 | H8 | sing | 1.08Å | 1.08Å | |
| C7 | H9 | sing | 1.08Å | 1.08Å | |
| N1 | H6 | sing | 0.97Å | 1.00Å | |
| C11 | H12 | sing | 1.08Å | 1.08Å | |
| C14 | H13 | sing | 1.08Å | 1.08Å | |
| C15 | H14 | sing | 1.08Å | 1.08Å | |
| C21 | H15 | sing | 1.08Å | 1.08Å | |
| C22 | H16 | sing | 1.08Å | 1.08Å | |
| C23 | H17 | sing | 1.08Å | 1.08Å | |
| C27 | H18 | sing | 1.08Å | 1.08Å | |
| C28 | H19 | sing | 1.08Å | 1.08Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| C32 | H21 | sing | 1.08Å | 1.08Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| O4 | H22 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | N1 | 112.5° | 109.4° |
| C2 | C1 | H3 | 109.5° | 109.4° |
| C2 | C1 | H2 | 109.5° | 109.4° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C1 | C2 | H5 | 108.7° | 109.5° |
| C1 | C2 | H4 | 108.7° | 109.5° |
| C2 | N1 | C3 | 122.5° | 120.0° |
| N1 | C2 | H5 | 108.7° | 109.5° |
| N1 | C2 | H4 | 108.7° | 109.5° |
| C2 | N1 | H6 | 118.7° | 120.0° |
| N1 | C3 | O1 | 122.2° | 120.0° |
| N1 | C3 | C4 | 117.0° | 120.0° |
| C3 | N1 | H6 | 118.8° | 120.0° |
| O1 | C3 | C4 | 120.8° | 120.0° |
| C3 | C4 | C5 | 119.8° | 120.2° |
| C3 | C4 | C32 | 120.9° | 120.1° |
| C4 | C5 | C6 | 120.1° | 119.9° |
| C5 | C4 | C32 | 119.4° | 119.7° |
| C4 | C5 | H7 | 120.0° | 120.0° |
| C5 | C6 | C7 | 120.0° | 120.2° |
| C6 | C5 | H7 | 119.9° | 120.2° |
| C5 | C6 | H8 | 120.0° | 119.9° |
| C6 | C7 | C8 | 120.8° | 120.3° |
| C7 | C6 | H8 | 120.0° | 119.9° |
| C6 | C7 | H9 | 119.6° | 119.8° |
| C7 | C8 | C9 | 120.7° | 119.9° |
| C7 | C8 | C32 | 118.8° | 120.1° |
| C8 | C7 | H9 | 119.6° | 119.9° |
| C8 | C9 | O2 | 110.3° | 109.5° |
| C9 | C8 | C32 | 120.5° | 119.9° |
| C8 | C9 | H10 | 109.3° | 109.5° |
| C8 | C9 | H11 | 109.3° | 109.5° |
| C9 | O2 | C10 | 118.0° | 117.0° |
| O2 | C9 | H10 | 109.3° | 109.4° |
| O2 | C9 | H11 | 109.2° | 109.5° |
| O2 | C10 | C11 | 120.9° | 120.1° |
| O2 | C10 | C16 | 118.9° | 120.0° |
| C10 | C11 | C12 | 120.4° | 119.9° |
| C11 | C10 | C16 | 120.1° | 119.9° |
| C10 | C11 | H12 | 119.8° | 120.0° |
| C11 | C12 | C13 | 119.3° | 120.0° |
| C11 | C12 | C14 | 119.9° | 120.0° |
| C12 | C11 | H12 | 119.8° | 120.0° |
| C12 | C13 | O3 | 117.9° | 120.0° |
| C12 | C13 | O4 | 116.9° | 120.0° |
| C13 | C12 | C14 | 120.7° | 120.0° |
| O3 | C13 | O4 | 125.1° | 120.0° |
| C13 | O4 | H22 | 109.5° | 117.0° |
| C12 | C14 | C15 | 120.0° | 120.1° |
| C12 | C14 | H13 | 120.0° | 119.9° |
| C14 | C15 | C16 | 120.7° | 120.1° |
| C15 | C14 | H13 | 120.0° | 120.0° |
| C14 | C15 | H14 | 119.6° | 119.9° |
| C15 | C16 | C17 | 118.7° | 120.0° |
| C15 | C16 | C10 | 118.8° | 120.0° |
| C16 | C15 | H14 | 119.6° | 120.0° |
| C16 | C17 | N2 | 120.2° | 126.1° |
| C17 | C16 | C10 | 122.2° | 120.0° |
| C16 | C17 | C31 | 129.7° | 126.2° |
| C17 | N2 | N3 | 107.1° | 110.0° |
| N2 | C17 | C31 | 109.8° | 107.7° |
| N2 | N3 | C18 | 120.8° | 125.4° |
| N2 | N3 | C26 | 111.1° | 109.2° |
| N3 | C18 | O5 | 120.0° | 120.0° |
| N3 | C18 | C19 | 117.3° | 120.0° |
| C18 | N3 | C26 | 128.0° | 125.4° |
| O5 | C18 | C19 | 122.7° | 120.0° |
| C18 | C19 | C20 | 118.9° | 120.2° |
| C18 | C19 | C24 | 121.2° | 120.1° |
| C19 | C20 | CL1 | 120.7° | 120.1° |
| C19 | C20 | C21 | 120.8° | 119.8° |
| C20 | C19 | C24 | 119.9° | 119.7° |
| CL1 | C20 | C21 | 118.4° | 120.1° |
| C20 | C21 | C22 | 119.2° | 120.1° |
| C20 | C21 | H15 | 120.4° | 119.9° |
| C21 | C22 | C23 | 120.7° | 120.4° |
| C22 | C21 | H15 | 120.4° | 119.9° |
| C21 | C22 | H16 | 119.7° | 119.8° |
| C22 | C23 | C24 | 120.6° | 120.2° |
| C23 | C22 | H16 | 119.6° | 119.8° |
| C22 | C23 | H17 | 119.7° | 120.0° |
| C23 | C24 | C25 | 119.7° | 120.1° |
| C23 | C24 | C19 | 118.7° | 119.8° |
| C24 | C23 | H17 | 119.7° | 119.9° |
| C24 | C25 | F1 | 113.1° | 109.5° |
| C24 | C25 | F2 | 113.1° | 109.5° |
| C24 | C25 | F3 | 112.9° | 109.5° |
| C25 | C24 | C19 | 121.6° | 120.1° |
| F1 | C25 | F2 | 105.0° | 109.5° |
| F1 | C25 | F3 | 105.8° | 109.4° |
| F2 | C25 | F3 | 106.2° | 109.4° |
| N3 | C26 | C27 | 132.8° | 133.6° |
| N3 | C26 | C31 | 105.1° | 106.9° |
| C26 | C27 | C28 | 117.7° | 119.9° |
| C27 | C26 | C31 | 122.2° | 119.6° |
| C26 | C27 | H18 | 121.1° | 120.0° |
| C27 | C28 | C29 | 119.9° | 120.6° |
| C28 | C27 | H18 | 121.1° | 120.1° |
| C27 | C28 | H19 | 120.0° | 119.7° |
| C28 | C29 | CL2 | 118.7° | 119.8° |
| C28 | C29 | C30 | 123.1° | 120.4° |
| C29 | C28 | H19 | 120.1° | 119.7° |
| CL2 | C29 | C30 | 118.1° | 119.8° |
| C29 | C30 | C31 | 117.5° | 119.7° |
| C29 | C30 | H20 | 121.3° | 120.2° |
| C30 | C31 | C17 | 133.6° | 133.8° |
| C30 | C31 | C26 | 119.6° | 119.9° |
| C31 | C30 | H20 | 121.2° | 120.1° |
| C8 | C32 | C4 | 120.9° | 119.9° |
| C8 | C32 | H21 | 119.5° | 120.1° |
| C4 | C32 | H21 | 119.5° | 120.0° |
| C17 | C31 | C26 | 106.8° | 106.3° |
| H3 | C1 | H2 | 109.5° | 109.5° |
| H3 | C1 | H1 | 109.4° | 109.5° |
| H2 | C1 | H1 | 109.5° | 109.5° |
| H5 | C2 | H4 | 109.5° | 109.4° |
| H10 | C9 | H11 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | N1 | H5 | 120.4° | 120.0° |
| C1 | C2 | N1 | H4 | 120.4° | 120.0° |
| C1 | C2 | N1 | C3 | 164.0° | 180.0° |
| C2 | C1 | H3 | H2 | 120.0° | 119.9° |
| C2 | C1 | H3 | H1 | 120.0° | 120.0° |
| C2 | C1 | H2 | H1 | 120.0° | 120.0° |
| C1 | C2 | H5 | H4 | 118.6° | 120.0° |
| C1 | C2 | N1 | H6 | 16.0° | 0.1° |
| C2 | N1 | C3 | H6 | 180.0° | 179.9° |
| C2 | N1 | C3 | O1 | 2.8° | 0.0° |
| C2 | N1 | C3 | C4 | 176.9° | 180.0° |
| N1 | C2 | C1 | H3 | 180.0° | 180.0° |
| N1 | C2 | C1 | H2 | 60.0° | 60.1° |
| N1 | C2 | C1 | H1 | 60.0° | 60.0° |
| N1 | C2 | H5 | H4 | 118.6° | 120.0° |
| N1 | C3 | O1 | C4 | 179.7° | 180.0° |
| N1 | C3 | C4 | C5 | 161.5° | 0.0° |
| N1 | C3 | C4 | C32 | 18.8° | 179.7° |
| C3 | N1 | C2 | H5 | 75.6° | 60.0° |
| C3 | N1 | C2 | H4 | 43.6° | 60.0° |
| O1 | C3 | C4 | C5 | 18.8° | 180.0° |
| O1 | C3 | C4 | C32 | 161.0° | 0.3° |
| O1 | C3 | N1 | H6 | 177.2° | 180.0° |
| C3 | C4 | C5 | C32 | 179.8° | 179.7° |
| C3 | C4 | C5 | C6 | 179.9° | 180.0° |
| C3 | C4 | C32 | C8 | 179.7° | 179.7° |
| C3 | C4 | C5 | H7 | 0.1° | 0.0° |
| C4 | C3 | N1 | H6 | 3.0° | 0.1° |
| C3 | C4 | C32 | H21 | 0.3° | 0.1° |
| C4 | C5 | C6 | H7 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 0.4° | 0.1° |
| C5 | C4 | C32 | C8 | 0.5° | 0.6° |
| C4 | C5 | C6 | H8 | 179.6° | 180.0° |
| C5 | C4 | C32 | H21 | 179.5° | 179.8° |
| C5 | C6 | C7 | H8 | 180.0° | 179.9° |
| C5 | C6 | C7 | C8 | 0.7° | 0.1° |
| C6 | C5 | C4 | C32 | 0.2° | 0.3° |
| C5 | C6 | C7 | H9 | 179.3° | 180.0° |
| C6 | C7 | C8 | H9 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 179.3° | 180.0° |
| C6 | C7 | C8 | C32 | 0.4° | 0.3° |
| C7 | C6 | C5 | H7 | 179.6° | 180.0° |
| C7 | C8 | C9 | C32 | 178.9° | 179.7° |
| C7 | C8 | C9 | O2 | 60.0° | 95.0° |
| C7 | C8 | C32 | C4 | 0.2° | 0.6° |
| C8 | C7 | C6 | H8 | 179.3° | 180.0° |
| C7 | C8 | C32 | H21 | 179.7° | 179.8° |
| C7 | C8 | C9 | H10 | 179.9° | 145.0° |
| C7 | C8 | C9 | H11 | 60.1° | 25.0° |
| C8 | C9 | O2 | H10 | 120.1° | 120.0° |
| C8 | C9 | O2 | H11 | 120.1° | 120.0° |
| C8 | C9 | O2 | C10 | 174.7° | 175.2° |
| C9 | C8 | C32 | C4 | 178.7° | 179.7° |
| C9 | C8 | C7 | H9 | 0.7° | 0.1° |
| C9 | C8 | C32 | H21 | 1.3° | 0.1° |
| C8 | C9 | H10 | H11 | 119.6° | 120.0° |
| C9 | O2 | C10 | C11 | 1.0° | 5.0° |
| O2 | C9 | C8 | C32 | 121.1° | 84.7° |
| C9 | O2 | C10 | C16 | 175.1° | 175.3° |
| O2 | C9 | H10 | H11 | 119.6° | 120.0° |
| O2 | C10 | C11 | C16 | 176.1° | 179.7° |
| O2 | C10 | C11 | C12 | 178.4° | 179.7° |
| O2 | C10 | C16 | C15 | 180.0° | 179.7° |
| O2 | C10 | C16 | C17 | 7.2° | 0.3° |
| O2 | C10 | C11 | H12 | 1.6° | 0.3° |
| C10 | O2 | C9 | H10 | 54.5° | 64.7° |
| C10 | O2 | C9 | H11 | 65.2° | 55.2° |
| C10 | C11 | C12 | H12 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 178.9° | 180.0° |
| C10 | C11 | C12 | C14 | 0.4° | 0.0° |
| C11 | C10 | C16 | C15 | 3.8° | 0.0° |
| C11 | C10 | C16 | C17 | 176.6° | 180.0° |
| C11 | C12 | C13 | C14 | 179.3° | 180.0° |
| C11 | C12 | C13 | O3 | 177.1° | 0.0° |
| C11 | C12 | C13 | O4 | 0.2° | 180.0° |
| C11 | C12 | C14 | C15 | 0.1° | 0.1° |
| C12 | C11 | C10 | C16 | 2.3° | 0.0° |
| C11 | C12 | C14 | H13 | 179.9° | 180.0° |
| C12 | C13 | O3 | O4 | 177.1° | 180.0° |
| C13 | C12 | C14 | C15 | 179.2° | 179.9° |
| C13 | C12 | C11 | H12 | 1.1° | 0.1° |
| C13 | C12 | C14 | H13 | 0.8° | 0.0° |
| C12 | C13 | O4 | H22 | 177.1° | 180.0° |
| O3 | C13 | C12 | C14 | 2.2° | 180.0° |
| O3 | C13 | O4 | H22 | 0.0° | 0.0° |
| O4 | C13 | C12 | C14 | 179.5° | 0.0° |
| C12 | C14 | C15 | H13 | 180.0° | 180.0° |
| C12 | C14 | C15 | C16 | 1.7° | 0.1° |
| C14 | C12 | C11 | H12 | 179.6° | 179.9° |
| C12 | C14 | C15 | H14 | 178.3° | 180.0° |
| C14 | C15 | C16 | H14 | 180.0° | 179.9° |
| C14 | C15 | C16 | C17 | 176.6° | 179.9° |
| C14 | C15 | C16 | C10 | 3.5° | 0.0° |
| C15 | C16 | C17 | C10 | 172.8° | 180.0° |
| C15 | C16 | C17 | N2 | 44.9° | 138.1° |
| C15 | C16 | C17 | C31 | 127.8° | 42.0° |
| C16 | C15 | C14 | H13 | 178.3° | 180.0° |
| C16 | C17 | N2 | C31 | 174.0° | 180.0° |
| C16 | C17 | N2 | N3 | 176.9° | 179.9° |
| C16 | C17 | C31 | C30 | 5.6° | 0.1° |
| C16 | C17 | C31 | C26 | 175.5° | 180.0° |
| C17 | C16 | C15 | H14 | 3.4° | 0.0° |
| C17 | N2 | N3 | C18 | 179.1° | 180.0° |
| C17 | N2 | N3 | C26 | 2.7° | 0.0° |
| N2 | C17 | C31 | C30 | 178.9° | 179.9° |
| N2 | C17 | C16 | C10 | 142.3° | 41.9° |
| N2 | C17 | C31 | C26 | 2.2° | 0.0° |
| N2 | N3 | C18 | C26 | 175.7° | 180.0° |
| N2 | N3 | C18 | O5 | 163.8° | 96.1° |
| N2 | N3 | C18 | C19 | 17.8° | 83.9° |
| N2 | N3 | C26 | C27 | 179.0° | 180.0° |
| N3 | N2 | C17 | C31 | 2.9° | 0.0° |
| N2 | N3 | C26 | C31 | 1.2° | 0.1° |
| N3 | C18 | O5 | C19 | 178.4° | 180.0° |
| N3 | C18 | C19 | C20 | 57.4° | 4.7° |
| C18 | N3 | C26 | C27 | 3.0° | 0.0° |
| N3 | C18 | C19 | C24 | 122.8° | 175.5° |
| C18 | N3 | C26 | C31 | 177.3° | 180.0° |
| O5 | C18 | C19 | C20 | 121.0° | 175.3° |
| O5 | C18 | N3 | C26 | 20.5° | 84.0° |
| O5 | C18 | C19 | C24 | 58.8° | 4.5° |
| C18 | C19 | C20 | C24 | 179.8° | 179.7° |
| C18 | C19 | C20 | CL1 | 0.9° | 0.0° |
| C18 | C19 | C20 | C21 | 179.6° | 180.0° |
| C18 | C19 | C24 | C23 | 179.1° | 179.7° |
| C18 | C19 | C24 | C25 | 0.6° | 0.0° |
| C19 | C18 | N3 | C26 | 158.0° | 96.0° |
| C19 | C20 | CL1 | C21 | 179.5° | 179.9° |
| C19 | C20 | C21 | C22 | 0.1° | 0.1° |
| C20 | C19 | C24 | C23 | 0.7° | 0.6° |
| C20 | C19 | C24 | C25 | 179.2° | 179.7° |
| C19 | C20 | C21 | H15 | 179.9° | 180.0° |
| CL1 | C20 | C21 | C22 | 179.6° | 180.0° |
| CL1 | C20 | C19 | C24 | 179.3° | 179.8° |
| CL1 | C20 | C21 | H15 | 0.4° | 0.0° |
| C20 | C21 | C22 | H15 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 0.2° | 0.1° |
| C21 | C20 | C19 | C24 | 0.2° | 0.3° |
| C20 | C21 | C22 | H16 | 179.8° | 180.0° |
| C21 | C22 | C23 | H16 | 180.0° | 179.9° |
| C21 | C22 | C23 | C24 | 0.7° | 0.4° |
| C21 | C22 | C23 | H17 | 179.3° | 180.0° |
| C22 | C23 | C24 | H17 | 180.0° | 179.7° |
| C22 | C23 | C24 | C25 | 179.5° | 179.7° |
| C22 | C23 | C24 | C19 | 0.9° | 0.6° |
| C23 | C22 | C21 | H15 | 179.8° | 179.9° |
| C23 | C24 | C25 | C19 | 178.5° | 179.7° |
| C23 | C24 | C25 | F1 | 18.9° | 0.3° |
| C23 | C24 | C25 | F2 | 138.1° | 120.3° |
| C23 | C24 | C25 | F3 | 101.3° | 119.7° |
| C24 | C23 | C22 | H16 | 179.3° | 179.7° |
| C24 | C25 | F1 | F2 | 123.7° | 120.0° |
| C24 | C25 | F1 | F3 | 124.2° | 120.0° |
| C24 | C25 | F2 | F3 | 124.4° | 120.0° |
| C25 | C24 | C23 | H17 | 0.5° | 0.0° |
| F1 | C25 | F2 | F3 | 111.8° | 120.0° |
| F1 | C25 | C24 | C19 | 162.6° | 180.0° |
| F2 | C25 | C24 | C19 | 43.4° | 60.0° |
| F3 | C25 | C24 | C19 | 77.2° | 60.0° |
| N3 | C26 | C27 | C31 | 179.7° | 180.0° |
| N3 | C26 | C27 | C28 | 179.2° | 180.0° |
| N3 | C26 | C31 | C30 | 179.6° | 180.0° |
| N3 | C26 | C31 | C17 | 0.5° | 0.0° |
| N3 | C26 | C27 | H18 | 0.8° | 0.1° |
| C26 | C27 | C28 | H18 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 1.4° | 0.0° |
| C27 | C26 | C31 | C30 | 0.1° | 0.1° |
| C27 | C26 | C31 | C17 | 179.2° | 180.0° |
| C26 | C27 | C28 | H19 | 178.6° | 180.0° |
| C27 | C28 | C29 | H19 | 180.0° | 180.0° |
| C27 | C28 | C29 | CL2 | 179.9° | 180.0° |
| C27 | C28 | C29 | C30 | 0.6° | 0.0° |
| C28 | C27 | C26 | C31 | 1.1° | 0.0° |
| C28 | C29 | CL2 | C30 | 179.5° | 179.9° |
| C28 | C29 | C30 | C31 | 0.7° | 0.0° |
| C29 | C28 | C27 | H18 | 178.6° | 179.9° |
| C28 | C29 | C30 | H20 | 179.4° | 180.0° |
| CL2 | C29 | C30 | C31 | 178.9° | 179.9° |
| CL2 | C29 | C28 | H19 | 0.1° | 0.1° |
| CL2 | C29 | C30 | H20 | 1.1° | 0.1° |
| C29 | C30 | C31 | H20 | 180.0° | 180.0° |
| C29 | C30 | C31 | C17 | 179.8° | 179.9° |
| C29 | C30 | C31 | C26 | 1.0° | 0.0° |
| C30 | C29 | C28 | H19 | 179.4° | 180.0° |
| C30 | C31 | C17 | C26 | 178.9° | 179.9° |
| C8 | C32 | C4 | H21 | 180.0° | 179.6° |
| C32 | C8 | C7 | H9 | 179.7° | 179.6° |
| C32 | C8 | C9 | H10 | 1.0° | 35.3° |
| C32 | C8 | C9 | H11 | 118.8° | 155.3° |
| C32 | C4 | C5 | H7 | 179.8° | 179.7° |
| C10 | C16 | C17 | C31 | 45.1° | 138.0° |
| C16 | C10 | C11 | H12 | 177.7° | 180.0° |
| C10 | C16 | C15 | H14 | 176.5° | 180.0° |
| C17 | C31 | C30 | H20 | 0.2° | 0.0° |
| C19 | C24 | C23 | H17 | 179.1° | 179.7° |
| C31 | C26 | C27 | H18 | 178.9° | 179.9° |
| C26 | C31 | C30 | H20 | 179.0° | 180.0° |
| H3 | C1 | H2 | H1 | 119.9° | 120.1° |
| H3 | C1 | C2 | H5 | 59.6° | 60.0° |
| H3 | C1 | C2 | H4 | 59.5° | 60.0° |
| H2 | C1 | C2 | H5 | 60.5° | 60.0° |
| H2 | C1 | C2 | H4 | 179.6° | 180.0° |
| H1 | C1 | C2 | H5 | 179.5° | 180.0° |
| H1 | C1 | C2 | H4 | 60.4° | 60.0° |
| H5 | C2 | N1 | H6 | 104.5° | 120.0° |
| H4 | C2 | N1 | H6 | 136.4° | 120.0° |
| H7 | C5 | C6 | H8 | 0.4° | 0.1° |
| H8 | C6 | C7 | H9 | 0.6° | 0.1° |
| H13 | C14 | C15 | H14 | 1.7° | 0.1° |
| H15 | C21 | C22 | H16 | 0.2° | 0.0° |
| H16 | C22 | C23 | H17 | 0.7° | 0.0° |
| H18 | C27 | C28 | H19 | 1.4° | 0.1° |
