OKI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N2 | sing | 1.37Å | 1.42Å | Aromatic |
| C1 | N3 | doub | 1.31Å | 1.35Å | Aromatic |
| C1 | C9 | sing | 1.48Å | 1.47Å | Aromatic |
| N2 | C5 | sing | 1.46Å | 1.44Å | |
| N2 | C6 | sing | 1.38Å | 1.41Å | Aromatic |
| N3 | C7 | sing | 1.36Å | 1.41Å | Aromatic |
| C4 | C5 | sing | 1.51Å | 1.56Å | |
| C4 | N8 | sing | 1.35Å | 1.37Å | |
| C4 | O10 | doub | 1.21Å | 1.24Å | |
| C5 | C11 | sing | 1.53Å | 1.54Å | |
| C6 | C7 | doub | 1.41Å | 1.45Å | Aromatic |
| C6 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C7 | C20 | sing | 1.40Å | 1.40Å | Aromatic |
| N8 | C15 | sing | 1.46Å | 1.45Å | |
| C9 | C12 | doub | 1.40Å | 1.40Å | Aromatic |
| C9 | C13 | sing | 1.40Å | 1.40Å | Aromatic |
| C11 | C21 | sing | 1.53Å | 1.52Å | |
| C11 | C22 | sing | 1.53Å | 1.52Å | |
| C12 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C14 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C17 | sing | 1.39Å | 1.40Å | Aromatic |
| C14 | CL18 | sing | 1.74Å | 1.70Å | |
| C15 | C23 | sing | 1.53Å | 1.54Å | |
| C15 | C24 | sing | 1.53Å | 1.54Å | |
| C19 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C26 | doub | 1.37Å | 1.39Å | Aromatic |
| C21 | C28 | sing | 1.53Å | 1.51Å | |
| C22 | C27 | sing | 1.53Å | 1.51Å | |
| C23 | C30 | sing | 1.53Å | 1.51Å | |
| C24 | C29 | sing | 1.53Å | 1.52Å | |
| C25 | C26 | sing | 1.39Å | 1.41Å | Aromatic |
| C27 | C31 | sing | 1.53Å | 1.51Å | |
| C28 | C31 | sing | 1.53Å | 1.51Å | |
| C29 | C32 | sing | 1.53Å | 1.51Å | |
| C30 | C32 | sing | 1.53Å | 1.52Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| N8 | HN8 | sing | 0.97Å | 1.00Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N2 | C1 | N3 | 112.8° | 109.8° |
| N2 | C1 | C9 | 122.2° | 125.1° |
| C1 | N2 | C5 | 126.1° | 126.4° |
| C1 | N2 | C6 | 106.2° | 107.2° |
| N3 | C1 | C9 | 125.0° | 125.1° |
| C1 | N3 | C7 | 105.6° | 109.6° |
| C1 | C9 | C12 | 120.2° | 120.1° |
| C1 | C9 | C13 | 119.7° | 120.1° |
| C5 | N2 | C6 | 127.7° | 126.4° |
| N2 | C5 | C4 | 110.3° | 109.5° |
| N2 | C5 | C11 | 115.0° | 109.5° |
| N2 | C5 | H5 | 104.9° | 109.5° |
| N2 | C6 | C7 | 105.8° | 106.2° |
| N2 | C6 | C19 | 132.9° | 133.9° |
| N3 | C7 | C6 | 109.6° | 107.2° |
| N3 | C7 | C20 | 130.9° | 133.4° |
| C5 | C4 | N8 | 115.6° | 120.1° |
| C5 | C4 | O10 | 122.3° | 120.0° |
| C4 | C5 | C11 | 109.1° | 109.4° |
| C4 | C5 | H5 | 111.3° | 109.5° |
| N8 | C4 | O10 | 122.1° | 120.0° |
| C4 | N8 | C15 | 123.6° | 120.0° |
| C4 | N8 | HN8 | 118.2° | 119.9° |
| C5 | C11 | C21 | 111.2° | 109.4° |
| C5 | C11 | C22 | 109.0° | 109.5° |
| C11 | C5 | H5 | 106.1° | 109.5° |
| C5 | C11 | H11 | 109.1° | 109.5° |
| C7 | C6 | C19 | 121.4° | 119.8° |
| C6 | C7 | C20 | 119.4° | 119.4° |
| C6 | C19 | C25 | 117.4° | 119.7° |
| C6 | C19 | H19 | 121.3° | 120.2° |
| C7 | C20 | C26 | 117.9° | 119.9° |
| C7 | C20 | H20 | 121.0° | 120.1° |
| N8 | C15 | C23 | 111.9° | 109.5° |
| N8 | C15 | C24 | 111.7° | 109.5° |
| C15 | N8 | HN8 | 118.2° | 120.0° |
| N8 | C15 | H15 | 105.6° | 109.5° |
| C12 | C9 | C13 | 120.0° | 119.8° |
| C9 | C12 | C16 | 120.4° | 119.9° |
| C9 | C12 | H12 | 119.8° | 120.1° |
| C9 | C13 | C17 | 119.9° | 119.9° |
| C9 | C13 | H13 | 120.0° | 120.1° |
| C21 | C11 | C22 | 110.9° | 109.5° |
| C11 | C21 | C28 | 111.8° | 109.5° |
| C21 | C11 | H11 | 107.2° | 109.5° |
| C11 | C21 | H21 | 108.7° | 109.5° |
| C11 | C21 | H21A | 108.7° | 109.5° |
| C11 | C22 | C27 | 110.1° | 109.4° |
| C22 | C11 | H11 | 109.5° | 109.5° |
| C11 | C22 | H22 | 109.3° | 109.5° |
| C11 | C22 | H22A | 109.2° | 109.5° |
| C12 | C16 | C14 | 119.3° | 120.1° |
| C16 | C12 | H12 | 119.8° | 120.0° |
| C12 | C16 | H16 | 120.4° | 120.0° |
| C13 | C17 | C14 | 119.5° | 120.0° |
| C17 | C13 | H13 | 120.1° | 120.0° |
| C13 | C17 | H17 | 120.2° | 120.0° |
| C16 | C14 | C17 | 120.9° | 120.3° |
| C16 | C14 | CL18 | 119.4° | 119.9° |
| C14 | C16 | H16 | 120.3° | 119.9° |
| C17 | C14 | CL18 | 119.8° | 119.8° |
| C14 | C17 | H17 | 120.2° | 120.0° |
| C23 | C15 | C24 | 107.3° | 109.5° |
| C15 | C23 | C30 | 110.2° | 109.5° |
| C23 | C15 | H15 | 110.1° | 109.4° |
| C15 | C23 | H23 | 109.2° | 109.5° |
| C15 | C23 | H23A | 109.2° | 109.5° |
| C15 | C24 | C29 | 111.0° | 109.5° |
| C24 | C15 | H15 | 110.3° | 109.4° |
| C15 | C24 | H24 | 109.0° | 109.5° |
| C15 | C24 | H24A | 109.0° | 109.5° |
| C19 | C25 | C26 | 121.5° | 120.4° |
| C25 | C19 | H19 | 121.3° | 120.1° |
| C19 | C25 | H25 | 119.2° | 119.8° |
| C20 | C26 | C25 | 122.3° | 120.7° |
| C26 | C20 | H20 | 121.1° | 120.0° |
| C20 | C26 | H26 | 118.8° | 119.7° |
| C21 | C28 | C31 | 112.2° | 109.4° |
| C28 | C21 | H21 | 108.7° | 109.4° |
| C28 | C21 | H21A | 108.7° | 109.4° |
| C21 | C28 | H28 | 108.6° | 109.5° |
| C21 | C28 | H28A | 108.6° | 109.5° |
| C22 | C27 | C31 | 111.0° | 109.5° |
| C27 | C22 | H22 | 109.2° | 109.5° |
| C27 | C22 | H22A | 109.3° | 109.5° |
| C22 | C27 | H27 | 109.0° | 109.4° |
| C22 | C27 | H27A | 109.0° | 109.4° |
| C23 | C30 | C32 | 110.4° | 109.5° |
| C30 | C23 | H23 | 109.2° | 109.5° |
| C30 | C23 | H23A | 109.2° | 109.5° |
| C23 | C30 | H30 | 109.2° | 109.4° |
| C23 | C30 | H30A | 109.2° | 109.5° |
| C24 | C29 | C32 | 110.8° | 109.4° |
| C29 | C24 | H24 | 109.0° | 109.5° |
| C29 | C24 | H24A | 109.0° | 109.5° |
| C24 | C29 | H29 | 109.0° | 109.5° |
| C24 | C29 | H29A | 109.0° | 109.5° |
| C26 | C25 | H25 | 119.2° | 119.8° |
| C25 | C26 | H26 | 118.9° | 119.7° |
| C27 | C31 | C28 | 110.8° | 109.5° |
| C31 | C27 | H27 | 109.0° | 109.5° |
| C31 | C27 | H27A | 109.0° | 109.5° |
| C27 | C31 | H31 | 109.0° | 109.5° |
| C27 | C31 | H31A | 109.0° | 109.5° |
| C31 | C28 | H28 | 108.6° | 109.5° |
| C31 | C28 | H28A | 108.6° | 109.5° |
| C28 | C31 | H31 | 109.0° | 109.4° |
| C28 | C31 | H31A | 109.0° | 109.5° |
| C29 | C32 | C30 | 111.7° | 109.5° |
| C32 | C29 | H29 | 109.1° | 109.5° |
| C32 | C29 | H29A | 109.0° | 109.5° |
| C29 | C32 | H32 | 108.7° | 109.4° |
| C29 | C32 | H32A | 108.7° | 109.5° |
| C32 | C30 | H30 | 109.2° | 109.5° |
| C32 | C30 | H30A | 109.2° | 109.5° |
| C30 | C32 | H32 | 108.7° | 109.5° |
| C30 | C32 | H32A | 108.7° | 109.5° |
| H21 | C21 | H21A | 110.2° | 109.4° |
| H22 | C22 | H22A | 109.7° | 109.5° |
| H23 | C23 | H23A | 109.7° | 109.4° |
| H24 | C24 | H24A | 110.0° | 109.4° |
| H27 | C27 | H27A | 109.9° | 109.5° |
| H28 | C28 | H28A | 110.4° | 109.5° |
| H29 | C29 | H29A | 109.9° | 109.5° |
| H30 | C30 | H30A | 109.8° | 109.5° |
| H31 | C31 | H31A | 110.0° | 109.5° |
| H32 | C32 | H32A | 110.2° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N2 | C1 | N3 | C9 | 179.0° | 179.8° |
| C1 | N2 | C5 | C6 | 178.9° | 179.9° |
| N2 | C1 | N3 | C7 | 0.3° | 0.1° |
| C1 | N2 | C5 | C4 | 120.0° | 66.4° |
| C1 | N2 | C5 | C11 | 116.1° | 173.7° |
| C1 | N2 | C6 | C7 | 0.0° | 0.0° |
| C1 | N2 | C6 | C19 | 179.7° | 179.9° |
| N2 | C1 | C9 | C12 | 83.3° | 146.9° |
| N2 | C1 | C9 | C13 | 96.1° | 33.4° |
| C1 | N2 | C5 | H5 | 0.0° | 53.7° |
| N3 | C1 | N2 | C5 | 179.3° | 179.9° |
| N3 | C1 | N2 | C6 | 0.2° | 0.1° |
| C1 | N3 | C7 | C6 | 0.3° | 0.0° |
| C1 | N3 | C7 | C20 | 179.8° | 179.9° |
| N3 | C1 | C9 | C12 | 95.6° | 33.4° |
| N3 | C1 | C9 | C13 | 85.0° | 146.4° |
| C9 | C1 | N2 | C5 | 1.6° | 0.1° |
| C9 | C1 | N2 | C6 | 179.3° | 179.7° |
| C9 | C1 | N3 | C7 | 179.3° | 179.7° |
| C1 | C9 | C12 | C13 | 179.4° | 179.7° |
| C1 | C9 | C12 | C16 | 179.8° | 179.9° |
| C1 | C9 | C13 | C17 | 179.7° | 180.0° |
| C1 | C9 | C12 | H12 | 0.2° | 0.0° |
| C1 | C9 | C13 | H13 | 0.3° | 0.0° |
| N2 | C5 | C4 | C11 | 127.3° | 120.0° |
| N2 | C5 | C4 | H5 | 116.0° | 120.1° |
| N2 | C5 | C4 | N8 | 58.9° | 148.8° |
| N2 | C5 | C4 | O10 | 121.9° | 31.1° |
| N2 | C5 | C11 | H5 | 115.5° | 120.1° |
| C5 | N2 | C6 | C7 | 179.1° | 179.9° |
| C5 | N2 | C6 | C19 | 0.6° | 0.0° |
| N2 | C5 | C11 | C21 | 30.4° | 66.2° |
| N2 | C5 | C11 | C22 | 153.0° | 173.8° |
| N2 | C5 | C11 | H11 | 87.6° | 53.7° |
| N2 | C6 | C7 | N3 | 0.1° | 0.0° |
| C6 | N2 | C5 | C4 | 61.1° | 113.8° |
| C6 | N2 | C5 | C11 | 62.8° | 6.2° |
| N2 | C6 | C7 | C19 | 179.8° | 180.0° |
| N2 | C6 | C7 | C20 | 179.9° | 179.9° |
| N2 | C6 | C19 | C25 | 179.7° | 180.0° |
| C6 | N2 | C5 | H5 | 178.9° | 126.2° |
| N2 | C6 | C19 | H19 | 0.3° | 0.1° |
| N3 | C7 | C6 | C20 | 179.9° | 179.9° |
| N3 | C7 | C6 | C19 | 179.9° | 180.0° |
| N3 | C7 | C20 | C26 | 179.9° | 180.0° |
| N3 | C7 | C20 | H20 | 0.1° | 0.2° |
| C5 | C4 | N8 | O10 | 179.3° | 179.9° |
| C4 | C5 | C11 | H5 | 120.0° | 119.9° |
| C5 | C4 | N8 | C15 | 174.5° | 174.9° |
| C4 | C5 | C11 | C21 | 154.9° | 173.8° |
| C4 | C5 | C11 | C22 | 82.5° | 53.8° |
| C5 | C4 | N8 | HN8 | 5.5° | 5.0° |
| C4 | C5 | C11 | H11 | 36.9° | 66.2° |
| N8 | C4 | C5 | C11 | 173.9° | 91.2° |
| C4 | N8 | C15 | HN8 | 180.0° | 179.9° |
| C4 | N8 | C15 | C23 | 161.3° | 155.0° |
| C4 | N8 | C15 | C24 | 78.4° | 85.0° |
| N8 | C4 | C5 | H5 | 57.1° | 28.7° |
| C4 | N8 | C15 | H15 | 41.5° | 35.0° |
| O10 | C4 | C5 | C11 | 5.4° | 88.9° |
| O10 | C4 | N8 | C15 | 6.3° | 5.2° |
| O10 | C4 | C5 | H5 | 122.2° | 151.2° |
| O10 | C4 | N8 | HN8 | 173.8° | 174.9° |
| C5 | C11 | C21 | C22 | 121.5° | 120.0° |
| C5 | C11 | C21 | H11 | 119.1° | 120.0° |
| C5 | C11 | C22 | H11 | 119.2° | 120.0° |
| C5 | C11 | C21 | C28 | 175.6° | 180.0° |
| C5 | C11 | C22 | C27 | 179.7° | 180.0° |
| C5 | C11 | C21 | H21 | 55.6° | 60.0° |
| C5 | C11 | C21 | H21A | 64.4° | 60.0° |
| C5 | C11 | C22 | H22 | 60.3° | 60.0° |
| C5 | C11 | C22 | H22A | 59.7° | 60.0° |
| C7 | C6 | C19 | C25 | 0.1° | 0.0° |
| C6 | C7 | C20 | C26 | 0.2° | 0.1° |
| C7 | C6 | C19 | H19 | 180.0° | 180.0° |
| C6 | C7 | C20 | H20 | 179.8° | 179.9° |
| C19 | C6 | C7 | C20 | 0.2° | 0.1° |
| C6 | C19 | C25 | H19 | 180.0° | 179.9° |
| C6 | C19 | C25 | C26 | 0.0° | 0.0° |
| C6 | C19 | C25 | H25 | 180.0° | 180.0° |
| C7 | C20 | C26 | H20 | 180.0° | 179.8° |
| C7 | C20 | C26 | C25 | 0.1° | 0.0° |
| C7 | C20 | C26 | H26 | 179.9° | 179.9° |
| N8 | C15 | C23 | C24 | 122.8° | 120.0° |
| N8 | C15 | C23 | H15 | 117.1° | 120.1° |
| N8 | C15 | C24 | H15 | 117.1° | 120.0° |
| N8 | C15 | C23 | C30 | 176.3° | 180.0° |
| N8 | C15 | C24 | C29 | 177.3° | 180.0° |
| N8 | C15 | C23 | H23 | 63.7° | 60.0° |
| N8 | C15 | C23 | H23A | 56.3° | 60.0° |
| N8 | C15 | C24 | H24 | 57.3° | 60.0° |
| N8 | C15 | C24 | H24A | 62.7° | 60.0° |
| C9 | C12 | C16 | H12 | 180.0° | 180.0° |
| C12 | C9 | C13 | C17 | 0.3° | 0.2° |
| C9 | C12 | C16 | C14 | 0.3° | 0.0° |
| C12 | C9 | C13 | H13 | 179.7° | 179.7° |
| C9 | C12 | C16 | H16 | 179.7° | 179.9° |
| C13 | C9 | C12 | C16 | 0.4° | 0.2° |
| C9 | C13 | C17 | H13 | 180.0° | 180.0° |
| C9 | C13 | C17 | C14 | 0.2° | 0.0° |
| C13 | C9 | C12 | H12 | 179.6° | 179.8° |
| C9 | C13 | C17 | H17 | 179.8° | 180.0° |
| C21 | C11 | C22 | H11 | 118.0° | 120.0° |
| C11 | C21 | C28 | H21 | 120.0° | 120.0° |
| C11 | C21 | C28 | H21A | 120.0° | 120.0° |
| C21 | C11 | C22 | C27 | 56.9° | 60.0° |
| C11 | C21 | C28 | C31 | 52.8° | 60.0° |
| C21 | C11 | C5 | H5 | 85.1° | 53.8° |
| C11 | C21 | H21 | H21A | 119.0° | 120.1° |
| C21 | C11 | C22 | H22 | 176.9° | 180.0° |
| C21 | C11 | C22 | H22A | 63.1° | 60.0° |
| C11 | C21 | C28 | H28 | 172.8° | 180.0° |
| C11 | C21 | C28 | H28A | 67.2° | 60.0° |
| C22 | C11 | C21 | C28 | 54.1° | 60.0° |
| C11 | C22 | C27 | H22 | 120.0° | 120.0° |
| C11 | C22 | C27 | H22A | 120.0° | 120.0° |
| C11 | C22 | C27 | C31 | 58.8° | 60.0° |
| C22 | C11 | C5 | H5 | 37.5° | 66.2° |
| C22 | C11 | C21 | H21 | 65.9° | 60.0° |
| C22 | C11 | C21 | H21A | 174.1° | 180.0° |
| C11 | C22 | H22 | H22A | 119.7° | 120.0° |
| C11 | C22 | C27 | H27 | 61.2° | 60.0° |
| C11 | C22 | C27 | H27A | 178.8° | 180.0° |
| C12 | C16 | C14 | H16 | 180.0° | 179.9° |
| C12 | C16 | C14 | C17 | 0.1° | 0.2° |
| C12 | C16 | C14 | CL18 | 179.9° | 180.0° |
| C13 | C17 | C14 | C16 | 0.1° | 0.2° |
| C13 | C17 | C14 | H17 | 180.0° | 180.0° |
| C13 | C17 | C14 | CL18 | 179.9° | 180.0° |
| C16 | C14 | C17 | CL18 | 180.0° | 179.8° |
| C14 | C16 | C12 | H12 | 179.7° | 180.0° |
| C16 | C14 | C17 | H17 | 180.0° | 179.7° |
| C14 | C17 | C13 | H13 | 179.9° | 179.9° |
| C17 | C14 | C16 | H16 | 179.9° | 179.8° |
| CL18 | C14 | C16 | H16 | 0.1° | 0.1° |
| CL18 | C14 | C17 | H17 | 0.1° | 0.0° |
| C23 | C15 | C24 | H15 | 119.9° | 119.9° |
| C15 | C23 | C30 | H23 | 120.0° | 120.0° |
| C15 | C23 | C30 | H23A | 120.0° | 120.0° |
| C23 | C15 | C24 | C29 | 59.7° | 60.0° |
| C15 | C23 | C30 | C32 | 59.7° | 60.0° |
| C23 | C15 | N8 | HN8 | 18.7° | 25.0° |
| C15 | C23 | H23 | H23A | 119.7° | 120.0° |
| C23 | C15 | C24 | H24 | 179.7° | 180.0° |
| C23 | C15 | C24 | H24A | 60.3° | 60.0° |
| C15 | C23 | C30 | H30 | 179.7° | 180.0° |
| C15 | C23 | C30 | H30A | 60.4° | 60.0° |
| C24 | C15 | C23 | C30 | 60.9° | 60.0° |
| C15 | C24 | C29 | H24 | 120.0° | 120.0° |
| C15 | C24 | C29 | H24A | 120.0° | 120.0° |
| C15 | C24 | C29 | C32 | 57.2° | 60.0° |
| C24 | C15 | N8 | HN8 | 101.6° | 95.0° |
| C24 | C15 | C23 | H23 | 59.1° | 60.0° |
| C24 | C15 | C23 | H23A | 179.1° | 180.0° |
| C15 | C24 | H24 | H24A | 119.4° | 120.0° |
| C15 | C24 | C29 | H29 | 62.8° | 60.0° |
| C15 | C24 | C29 | H29A | 177.2° | 180.0° |
| C19 | C25 | C26 | C20 | 0.0° | 0.0° |
| C19 | C25 | C26 | H25 | 180.0° | 180.0° |
| C19 | C25 | C26 | H26 | 180.0° | 180.0° |
| C20 | C26 | C25 | H26 | 180.0° | 180.0° |
| C20 | C26 | C25 | H25 | 180.0° | 180.0° |
| C21 | C28 | C31 | C27 | 54.0° | 60.0° |
| C21 | C28 | C31 | H28 | 120.0° | 120.0° |
| C21 | C28 | C31 | H28A | 120.0° | 120.0° |
| C28 | C21 | C11 | H11 | 65.3° | 60.0° |
| C28 | C21 | H21 | H21A | 119.0° | 119.9° |
| C21 | C28 | H28 | H28A | 118.9° | 120.0° |
| C21 | C28 | C31 | H31 | 174.0° | 180.0° |
| C21 | C28 | C31 | H31A | 65.9° | 60.0° |
| C22 | C27 | C31 | H27 | 120.0° | 120.0° |
| C22 | C27 | C31 | H27A | 120.0° | 120.0° |
| C22 | C27 | C31 | C28 | 57.2° | 60.0° |
| C27 | C22 | C11 | H11 | 61.1° | 60.0° |
| C27 | C22 | H22 | H22A | 119.8° | 120.0° |
| C22 | C27 | H27 | H27A | 119.4° | 119.9° |
| C22 | C27 | C31 | H31 | 177.2° | 180.0° |
| C22 | C27 | C31 | H31A | 62.8° | 60.0° |
| C23 | C30 | C32 | C29 | 55.9° | 60.0° |
| C23 | C30 | C32 | H30 | 120.0° | 120.0° |
| C23 | C30 | C32 | H30A | 120.0° | 120.0° |
| C30 | C23 | C15 | H15 | 59.2° | 59.9° |
| C30 | C23 | H23 | H23A | 119.7° | 120.0° |
| C23 | C30 | H30 | H30A | 119.6° | 120.0° |
| C23 | C30 | C32 | H32 | 175.9° | 180.0° |
| C23 | C30 | C32 | H32A | 64.1° | 60.0° |
| C24 | C29 | C32 | H29 | 120.0° | 120.0° |
| C24 | C29 | C32 | H29A | 120.0° | 120.0° |
| C24 | C29 | C32 | C30 | 54.5° | 60.0° |
| C29 | C24 | C15 | H15 | 60.2° | 59.9° |
| C29 | C24 | H24 | H24A | 119.4° | 119.9° |
| C24 | C29 | H29 | H29A | 119.4° | 120.1° |
| C24 | C29 | C32 | H32 | 174.5° | 180.0° |
| C24 | C29 | C32 | H32A | 65.5° | 60.0° |
| C26 | C25 | C19 | H19 | 180.0° | 179.9° |
| C25 | C26 | C20 | H20 | 179.9° | 179.9° |
| C27 | C31 | C28 | H31 | 120.0° | 120.0° |
| C27 | C31 | C28 | H31A | 120.0° | 120.0° |
| C31 | C27 | C22 | H22 | 178.8° | 180.0° |
| C31 | C27 | C22 | H22A | 61.2° | 60.0° |
| C31 | C27 | H27 | H27A | 119.4° | 120.1° |
| C27 | C31 | C28 | H28 | 174.0° | 180.0° |
| C27 | C31 | C28 | H28A | 66.0° | 60.0° |
| C27 | C31 | H31 | H31A | 119.4° | 120.0° |
| C31 | C28 | C21 | H21 | 67.2° | 60.0° |
| C31 | C28 | C21 | H21A | 172.8° | 180.0° |
| C28 | C31 | C27 | H27 | 62.8° | 60.0° |
| C28 | C31 | C27 | H27A | 177.2° | 180.0° |
| C31 | C28 | H28 | H28A | 118.9° | 120.0° |
| C28 | C31 | H31 | H31A | 119.5° | 120.0° |
| C29 | C32 | C30 | H32 | 120.0° | 120.0° |
| C29 | C32 | C30 | H32A | 120.0° | 120.0° |
| C32 | C29 | C24 | H24 | 177.2° | 180.0° |
| C32 | C29 | C24 | H24A | 62.8° | 60.0° |
| C32 | C29 | H29 | H29A | 119.5° | 120.0° |
| C29 | C32 | C30 | H30 | 175.9° | 180.0° |
| C29 | C32 | C30 | H30A | 64.2° | 60.0° |
| C29 | C32 | H32 | H32A | 119.1° | 120.0° |
| C32 | C30 | C23 | H23 | 60.3° | 60.0° |
| C32 | C30 | C23 | H23A | 179.7° | 179.9° |
| C30 | C32 | C29 | H29 | 65.5° | 60.0° |
| C30 | C32 | C29 | H29A | 174.5° | 180.0° |
| C32 | C30 | H30 | H30A | 119.6° | 120.1° |
| C30 | C32 | H32 | H32A | 119.1° | 120.1° |
| H5 | C5 | C11 | H11 | 157.0° | 173.8° |
| HN8 | N8 | C15 | H15 | 138.5° | 145.0° |
| H11 | C11 | C21 | H21 | 174.7° | 180.0° |
| H11 | C11 | C21 | H21A | 54.7° | 60.0° |
| H11 | C11 | C22 | H22 | 58.9° | 60.0° |
| H11 | C11 | C22 | H22A | 178.9° | 180.0° |
| H12 | C12 | C16 | H16 | 0.2° | 0.1° |
| H13 | C13 | C17 | H17 | 0.1° | 0.0° |
| H15 | C15 | C23 | H23 | 179.2° | 179.9° |
| H15 | C15 | C23 | H23A | 60.8° | 60.1° |
| H15 | C15 | C24 | H24 | 59.8° | 60.1° |
| H15 | C15 | C24 | H24A | 179.8° | 180.0° |
| H19 | C19 | C25 | H25 | 0.0° | 0.1° |
| H20 | C20 | C26 | H26 | 0.1° | 0.1° |
| H21 | C21 | C28 | H28 | 52.8° | 60.0° |
| H21 | C21 | C28 | H28A | 172.8° | 180.0° |
| H21A | C21 | C28 | H28 | 67.2° | 59.9° |
| H21A | C21 | C28 | H28A | 52.8° | 60.1° |
| H22 | C22 | C27 | H27 | 58.8° | 60.0° |
| H22 | C22 | C27 | H27A | 61.2° | 60.0° |
| H22A | C22 | C27 | H27 | 178.8° | 180.0° |
| H22A | C22 | C27 | H27A | 58.8° | 60.0° |
| H23 | C23 | C30 | H30 | 59.7° | 60.0° |
| H23 | C23 | C30 | H30A | 179.7° | 180.0° |
| H23A | C23 | C30 | H30 | 60.3° | 59.9° |
| H23A | C23 | C30 | H30A | 59.6° | 60.0° |
| H24 | C24 | C29 | H29 | 57.2° | 60.1° |
| H24 | C24 | C29 | H29A | 62.8° | 60.0° |
| H24A | C24 | C29 | H29 | 177.2° | 180.0° |
| H24A | C24 | C29 | H29A | 57.2° | 59.9° |
| H25 | C25 | C26 | H26 | 0.0° | 0.0° |
| H27 | C27 | C31 | H31 | 57.2° | 60.0° |
| H27 | C27 | C31 | H31A | 177.2° | 180.0° |
| H27A | C27 | C31 | H31 | 62.8° | 60.0° |
| H27A | C27 | C31 | H31A | 57.2° | 60.0° |
| H28 | C28 | C31 | H31 | 66.0° | 60.0° |
| H28 | C28 | C31 | H31A | 54.1° | 60.0° |
| H28A | C28 | C31 | H31 | 54.0° | 60.0° |
| H28A | C28 | C31 | H31A | 174.1° | NaN° |
| H29 | C29 | C32 | H32 | 54.5° | 60.0° |
| H29 | C29 | C32 | H32A | 174.5° | NaN° |
| H29A | C29 | C32 | H32 | 65.5° | 60.0° |
| H29A | C29 | C32 | H32A | 54.5° | 60.0° |
| H30 | C30 | C32 | H32 | 64.1° | 60.1° |
| H30 | C30 | C32 | H32A | 55.9° | 60.0° |
| H30A | C30 | C32 | H32 | 55.8° | 60.0° |
| H30A | C30 | C32 | H32A | 175.8° | 180.0° |
