DQX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F1 | C2 | sing | 1.35Å | 1.33Å | |
| C2 | C3 | doub | 1.39Å | 1.41Å | Aromatic |
| C2 | C8 | sing | 1.38Å | 1.40Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.41Å | Aromatic |
| C3 | C48 | sing | 1.51Å | 1.54Å | |
| C4 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | F47 | sing | 1.35Å | 1.34Å | |
| C5 | C7 | sing | 1.39Å | 1.40Å | Aromatic |
| C7 | C8 | doub | 1.39Å | 1.40Å | Aromatic |
| C7 | C10 | sing | 1.48Å | 1.49Å | Aromatic |
| C10 | C11 | doub | 1.42Å | 1.41Å | Aromatic |
| C10 | C22 | sing | 1.38Å | 1.41Å | Aromatic |
| C11 | N12 | sing | 1.33Å | 1.37Å | Aromatic |
| C11 | C17 | sing | 1.42Å | 1.41Å | Aromatic |
| N12 | C13 | doub | 1.32Å | 1.36Å | Aromatic |
| C13 | C14 | sing | 1.41Å | 1.40Å | Aromatic |
| C13 | C24 | sing | 1.48Å | 1.52Å | Aromatic |
| C14 | N16 | doub | 1.31Å | 1.35Å | Aromatic |
| N16 | C17 | sing | 1.34Å | 1.35Å | Aromatic |
| C17 | C18 | doub | 1.40Å | 1.40Å | Aromatic |
| C18 | C20 | sing | 1.36Å | 1.40Å | Aromatic |
| C20 | C22 | doub | 1.39Å | 1.41Å | Aromatic |
| C24 | C25 | doub | 1.37Å | 1.36Å | Aromatic |
| C24 | C29 | sing | 1.41Å | 1.46Å | Aromatic |
| C25 | N27 | sing | 1.35Å | 1.31Å | Aromatic |
| N27 | N28 | sing | 1.40Å | 1.35Å | Aromatic |
| N27 | C31 | sing | 1.46Å | 1.46Å | |
| N28 | C29 | doub | 1.31Å | 1.27Å | Aromatic |
| C31 | C33 | sing | 1.53Å | 1.56Å | |
| C31 | C44 | sing | 1.53Å | 1.55Å | |
| C33 | C36 | sing | 1.53Å | 1.55Å | |
| C36 | N39 | sing | 1.47Å | 1.48Å | |
| N39 | C41 | sing | 1.47Å | 1.49Å | |
| C41 | C44 | sing | 1.53Å | 1.56Å | |
| C48 | N51 | sing | 1.47Å | 1.51Å | |
| N51 | C52 | sing | 1.47Å | 1.50Å | |
| N51 | C62 | sing | 1.47Å | 1.50Å | |
| C52 | C55 | sing | 1.53Å | 1.55Å | |
| C55 | O58 | sing | 1.43Å | 1.44Å | |
| O58 | C59 | sing | 1.43Å | 1.44Å | |
| C59 | C62 | sing | 1.53Å | 1.55Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| N39 | HN39 | sing | 1.01Å | 1.00Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C41 | H41A | sing | 1.09Å | 1.10Å | |
| C44 | H44 | sing | 1.09Å | 1.10Å | |
| C44 | H44A | sing | 1.09Å | 1.10Å | |
| C48 | H48 | sing | 1.09Å | 1.10Å | |
| C48 | H48A | sing | 1.09Å | 1.10Å | |
| C52 | H52 | sing | 1.09Å | 1.10Å | |
| C52 | H52A | sing | 1.09Å | 1.10Å | |
| C55 | H55 | sing | 1.09Å | 1.10Å | |
| C55 | H55A | sing | 1.09Å | 1.10Å | |
| C59 | H59 | sing | 1.09Å | 1.10Å | |
| C59 | H59A | sing | 1.09Å | 1.10Å | |
| C62 | H62 | sing | 1.09Å | 1.10Å | |
| C62 | H62A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F1 | C2 | C3 | 121.6° | 119.9° |
| F1 | C2 | C8 | 117.5° | 120.0° |
| C3 | C2 | C8 | 120.9° | 120.1° |
| C2 | C3 | C4 | 119.3° | 120.2° |
| C2 | C3 | C48 | 120.9° | 119.9° |
| C2 | C8 | C7 | 119.4° | 119.9° |
| C2 | C8 | H8 | 120.3° | 120.0° |
| C4 | C3 | C48 | 119.9° | 119.9° |
| C3 | C4 | C5 | 119.6° | 120.1° |
| C3 | C4 | F47 | 121.8° | 119.9° |
| C3 | C48 | N51 | 110.0° | 109.5° |
| C3 | C48 | H48 | 109.3° | 109.5° |
| C3 | C48 | H48A | 109.3° | 109.5° |
| C5 | C4 | F47 | 118.6° | 119.9° |
| C4 | C5 | C7 | 121.0° | 119.9° |
| C4 | C5 | H5 | 119.5° | 120.1° |
| C5 | C7 | C8 | 119.8° | 119.8° |
| C5 | C7 | C10 | 116.2° | 120.1° |
| C7 | C5 | H5 | 119.5° | 120.1° |
| C8 | C7 | C10 | 124.0° | 120.1° |
| C7 | C8 | H8 | 120.3° | 120.1° |
| C7 | C10 | C11 | 122.7° | 120.3° |
| C7 | C10 | C22 | 117.3° | 120.4° |
| C11 | C10 | C22 | 119.9° | 119.4° |
| C10 | C11 | N12 | 121.6° | 121.0° |
| C10 | C11 | C17 | 119.0° | 119.2° |
| C10 | C22 | C20 | 120.4° | 120.7° |
| C10 | C22 | H22 | 119.8° | 119.6° |
| N12 | C11 | C17 | 119.4° | 119.8° |
| C11 | N12 | C13 | 120.4° | 119.7° |
| C11 | C17 | N16 | 119.9° | 119.7° |
| C11 | C17 | C18 | 121.1° | 119.4° |
| N12 | C13 | C14 | 119.1° | 120.4° |
| N12 | C13 | C24 | 119.0° | 119.8° |
| C14 | C13 | C24 | 121.9° | 119.8° |
| C13 | C14 | N16 | 121.2° | 120.6° |
| C13 | C14 | H14 | 119.4° | 119.7° |
| C13 | C24 | C25 | 130.6° | 126.3° |
| C13 | C24 | C29 | 122.7° | 126.3° |
| C14 | N16 | C17 | 120.1° | 119.9° |
| N16 | C14 | H14 | 119.4° | 119.7° |
| N16 | C17 | C18 | 119.0° | 120.9° |
| C17 | C18 | C20 | 119.6° | 120.2° |
| C17 | C18 | H18 | 120.2° | 119.9° |
| C18 | C20 | C22 | 119.9° | 121.1° |
| C20 | C18 | H18 | 120.2° | 119.9° |
| C18 | C20 | H20 | 120.1° | 119.4° |
| C22 | C20 | H20 | 120.0° | 119.4° |
| C20 | C22 | H22 | 119.8° | 119.7° |
| C25 | C24 | C29 | 106.7° | 107.5° |
| C24 | C25 | N27 | 106.9° | 107.6° |
| C24 | C25 | H25 | 126.5° | 126.2° |
| C24 | C29 | N28 | 104.9° | 108.0° |
| C24 | C29 | H29 | 127.6° | 126.0° |
| C25 | N27 | N28 | 110.0° | 108.3° |
| C25 | N27 | C31 | 130.8° | 125.8° |
| N27 | C25 | H25 | 126.6° | 126.2° |
| N28 | N27 | C31 | 119.2° | 125.9° |
| N27 | N28 | C29 | 111.5° | 108.6° |
| N27 | C31 | C33 | 109.9° | 109.6° |
| N27 | C31 | C44 | 115.2° | 109.6° |
| N27 | C31 | H31 | 106.7° | 109.5° |
| N28 | C29 | H29 | 127.6° | 126.0° |
| C33 | C31 | C44 | 113.7° | 109.2° |
| C31 | C33 | C36 | 111.8° | 109.3° |
| C33 | C31 | H31 | 108.5° | 109.5° |
| C31 | C33 | H33 | 108.7° | 109.6° |
| C31 | C33 | H33A | 108.7° | 109.5° |
| C31 | C44 | C41 | 110.0° | 109.3° |
| C44 | C31 | H31 | 102.2° | 109.5° |
| C31 | C44 | H44 | 109.3° | 109.5° |
| C31 | C44 | H44A | 109.3° | 109.5° |
| C33 | C36 | N39 | 108.3° | 109.6° |
| C36 | C33 | H33 | 108.7° | 109.5° |
| C36 | C33 | H33A | 108.7° | 109.4° |
| C33 | C36 | H36 | 109.8° | 109.4° |
| C33 | C36 | H36A | 109.9° | 109.5° |
| C36 | N39 | C41 | 114.2° | 111.2° |
| N39 | C36 | H36 | 109.9° | 109.4° |
| N39 | C36 | H36A | 109.9° | 109.5° |
| C36 | N39 | HN39 | 107.9° | 111.0° |
| N39 | C41 | C44 | 108.8° | 109.5° |
| C41 | N39 | HN39 | 107.9° | 111.0° |
| N39 | C41 | H41 | 109.7° | 109.5° |
| N39 | C41 | H41A | 109.7° | 109.5° |
| C44 | C41 | H41 | 109.7° | 109.5° |
| C44 | C41 | H41A | 109.7° | 109.5° |
| C41 | C44 | H44 | 109.3° | 109.5° |
| C41 | C44 | H44A | 109.3° | 109.5° |
| C48 | N51 | C52 | 114.2° | 111.0° |
| C48 | N51 | C62 | 116.8° | 110.9° |
| N51 | C48 | H48 | 109.3° | 109.5° |
| N51 | C48 | H48A | 109.3° | 109.4° |
| C52 | N51 | C62 | 114.0° | 110.7° |
| N51 | C52 | C55 | 113.2° | 109.3° |
| N51 | C52 | H52 | 108.3° | 109.5° |
| N51 | C52 | H52A | 108.3° | 109.5° |
| N51 | C62 | C59 | 111.7° | 109.2° |
| N51 | C62 | H62 | 108.7° | 109.5° |
| N51 | C62 | H62A | 108.7° | 109.5° |
| C52 | C55 | O58 | 110.2° | 109.3° |
| C55 | C52 | H52 | 108.2° | 109.5° |
| C55 | C52 | H52A | 108.2° | 109.5° |
| C52 | C55 | H55 | 109.2° | 109.5° |
| C52 | C55 | H55A | 109.2° | 109.6° |
| C55 | O58 | C59 | 111.4° | 113.7° |
| O58 | C55 | H55 | 109.3° | 109.5° |
| O58 | C55 | H55A | 109.2° | 109.5° |
| O58 | C59 | C62 | 109.2° | 109.2° |
| O58 | C59 | H59 | 109.6° | 109.5° |
| O58 | C59 | H59A | 109.6° | 109.5° |
| C62 | C59 | H59 | 109.6° | 109.5° |
| C62 | C59 | H59A | 109.6° | 109.5° |
| C59 | C62 | H62 | 108.7° | 109.5° |
| C59 | C62 | H62A | 108.7° | 109.5° |
| H33 | C33 | H33A | 110.2° | 109.5° |
| H36 | C36 | H36A | 109.1° | 109.4° |
| H41 | C41 | H41A | 109.2° | 109.4° |
| H44 | C44 | H44A | 109.7° | 109.5° |
| H48 | C48 | H48A | 109.6° | 109.5° |
| H52 | C52 | H52A | 110.6° | 109.5° |
| H55 | C55 | H55A | 109.7° | 109.5° |
| H59 | C59 | H59A | 109.4° | 109.5° |
| H62 | C62 | H62A | 110.2° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F1 | C2 | C3 | C8 | 178.9° | 179.7° |
| F1 | C2 | C3 | C4 | 179.8° | 180.0° |
| F1 | C2 | C3 | C48 | 0.1° | 0.0° |
| F1 | C2 | C8 | C7 | 178.9° | 179.7° |
| F1 | C2 | C8 | H8 | 1.1° | 0.0° |
| C2 | C3 | C4 | C48 | 179.7° | 180.0° |
| C2 | C3 | C4 | C5 | 1.1° | 0.0° |
| C2 | C3 | C4 | F47 | 179.0° | 180.0° |
| C3 | C2 | C8 | C7 | 0.0° | 0.6° |
| C2 | C3 | C48 | N51 | 90.8° | 90.0° |
| C3 | C2 | C8 | H8 | 180.0° | 179.8° |
| C2 | C3 | C48 | H48 | 29.2° | 150.0° |
| C2 | C3 | C48 | H48A | 149.2° | 30.0° |
| C8 | C2 | C3 | C4 | 0.9° | 0.3° |
| C8 | C2 | C3 | C48 | 178.8° | 179.7° |
| C2 | C8 | C7 | C5 | 0.7° | 0.5° |
| C2 | C8 | C7 | H8 | 180.0° | 179.7° |
| C2 | C8 | C7 | C10 | 179.5° | 179.7° |
| C3 | C4 | C5 | F47 | 179.9° | 180.0° |
| C3 | C4 | C5 | C7 | 0.4° | 0.0° |
| C4 | C3 | C48 | N51 | 88.9° | 90.1° |
| C3 | C4 | C5 | H5 | 179.6° | 180.0° |
| C4 | C3 | C48 | H48 | 151.1° | 29.9° |
| C4 | C3 | C48 | H48A | 31.1° | 150.0° |
| C48 | C3 | C4 | C5 | 178.6° | 180.0° |
| C48 | C3 | C4 | F47 | 1.3° | 0.1° |
| C3 | C48 | N51 | H48 | 120.0° | 120.1° |
| C3 | C48 | N51 | H48A | 120.0° | 120.0° |
| C3 | C48 | N51 | C52 | 70.7° | 170.0° |
| C3 | C48 | N51 | C62 | 65.9° | 66.4° |
| C3 | C48 | H48 | H48A | 119.8° | 120.0° |
| C4 | C5 | C7 | H5 | 180.0° | 180.0° |
| C4 | C5 | C7 | C8 | 0.5° | 0.2° |
| C4 | C5 | C7 | C10 | 179.3° | 180.0° |
| F47 | C4 | C5 | C7 | 179.7° | 179.9° |
| F47 | C4 | C5 | H5 | 0.3° | 0.1° |
| C5 | C7 | C8 | C10 | 178.8° | 179.8° |
| C5 | C7 | C10 | C11 | 130.2° | 130.0° |
| C5 | C7 | C10 | C22 | 48.2° | 50.2° |
| C5 | C7 | C8 | H8 | 179.3° | 179.8° |
| C8 | C7 | C10 | C11 | 48.6° | 49.8° |
| C8 | C7 | C10 | C22 | 133.0° | 130.0° |
| C8 | C7 | C5 | H5 | 179.5° | 179.8° |
| C7 | C10 | C11 | C22 | 178.3° | 179.8° |
| C7 | C10 | C11 | N12 | 1.5° | 0.1° |
| C7 | C10 | C11 | C17 | 178.2° | 180.0° |
| C7 | C10 | C22 | C20 | 177.9° | 179.7° |
| C10 | C7 | C5 | H5 | 0.7° | 0.0° |
| C10 | C7 | C8 | H8 | 0.5° | 0.0° |
| C7 | C10 | C22 | H22 | 2.2° | 0.0° |
| C10 | C11 | N12 | C17 | 179.7° | 180.0° |
| C10 | C11 | N12 | C13 | 179.7° | 180.0° |
| C10 | C11 | C17 | N16 | 179.6° | 180.0° |
| C10 | C11 | C17 | C18 | 0.0° | 0.0° |
| C11 | C10 | C22 | C20 | 0.6° | 0.6° |
| C11 | C10 | C22 | H22 | 179.4° | 179.7° |
| C22 | C10 | C11 | N12 | 179.8° | 179.7° |
| C22 | C10 | C11 | C17 | 0.1° | 0.3° |
| C10 | C22 | C20 | C18 | 0.9° | 0.6° |
| C10 | C22 | C20 | H22 | 180.0° | 179.7° |
| C10 | C22 | C20 | H20 | 179.0° | 179.7° |
| C11 | N12 | C13 | C14 | 0.5° | 0.0° |
| C11 | N12 | C13 | C24 | 178.8° | 180.0° |
| N12 | C11 | C17 | N16 | 0.1° | 0.0° |
| N12 | C11 | C17 | C18 | 179.8° | 180.0° |
| C17 | C11 | N12 | C13 | 0.5° | 0.0° |
| C11 | C17 | N16 | C14 | 0.8° | 0.0° |
| C11 | C17 | N16 | C18 | 179.7° | 180.0° |
| C11 | C17 | C18 | C20 | 0.4° | 0.0° |
| C11 | C17 | C18 | H18 | 179.6° | 180.0° |
| N12 | C13 | C14 | C24 | 179.2° | 179.9° |
| N12 | C13 | C14 | N16 | 0.3° | 0.1° |
| N12 | C13 | C24 | C25 | 174.7° | 175.0° |
| N12 | C13 | C24 | C29 | 4.4° | 4.7° |
| N12 | C13 | C14 | H14 | 179.7° | 179.9° |
| C13 | C14 | N16 | H14 | 180.0° | 180.0° |
| C13 | C14 | N16 | C17 | 0.9° | 0.0° |
| C14 | C13 | C24 | C25 | 4.5° | 4.9° |
| C14 | C13 | C24 | C29 | 176.4° | 175.3° |
| C24 | C13 | C14 | N16 | 179.5° | 180.0° |
| C13 | C24 | C25 | C29 | 179.2° | 179.8° |
| C13 | C24 | C25 | N27 | 179.9° | 180.0° |
| C13 | C24 | C29 | N28 | 179.7° | 179.8° |
| C24 | C13 | C14 | H14 | 0.5° | 0.0° |
| C13 | C24 | C25 | H25 | 0.1° | 0.1° |
| C13 | C24 | C29 | H29 | 0.3° | 0.0° |
| C14 | N16 | C17 | C18 | 179.5° | 180.0° |
| N16 | C17 | C18 | C20 | 179.3° | 180.0° |
| C17 | N16 | C14 | H14 | 179.1° | 179.9° |
| N16 | C17 | C18 | H18 | 0.7° | 0.0° |
| C17 | C18 | C20 | H18 | 180.0° | 180.0° |
| C17 | C18 | C20 | C22 | 0.8° | 0.3° |
| C17 | C18 | C20 | H20 | 179.1° | 180.0° |
| C18 | C20 | C22 | H20 | 180.0° | 179.7° |
| C18 | C20 | C22 | H22 | 179.0° | 179.7° |
| C22 | C20 | C18 | H18 | 179.2° | 179.7° |
| C24 | C25 | N27 | H25 | 180.0° | 179.9° |
| C24 | C25 | N27 | N28 | 0.8° | 0.1° |
| C24 | C25 | N27 | C31 | 178.8° | 180.0° |
| C25 | C24 | C29 | N28 | 0.4° | 0.4° |
| C25 | C24 | C29 | H29 | 179.6° | 179.8° |
| C29 | C24 | C25 | N27 | 0.7° | 0.2° |
| C24 | C29 | N28 | N27 | 0.1° | 0.5° |
| C24 | C29 | N28 | H29 | 180.0° | 179.8° |
| C29 | C24 | C25 | H25 | 179.3° | 179.7° |
| C25 | N27 | N28 | C31 | 178.3° | 179.9° |
| C25 | N27 | N28 | C29 | 0.5° | 0.4° |
| C25 | N27 | C31 | C33 | 73.3° | 85.0° |
| C25 | N27 | C31 | C44 | 56.7° | 34.7° |
| C25 | N27 | C31 | H31 | 169.3° | 154.9° |
| N28 | N27 | C31 | C33 | 104.6° | 94.9° |
| N28 | N27 | C31 | C44 | 125.4° | 145.4° |
| N28 | N27 | C25 | H25 | 179.2° | 180.0° |
| N27 | N28 | C29 | H29 | 180.0° | 179.8° |
| N28 | N27 | C31 | H31 | 12.8° | 25.2° |
| C31 | N27 | N28 | C29 | 178.8° | 179.7° |
| N27 | C31 | C33 | C44 | 130.8° | 120.0° |
| N27 | C31 | C33 | H31 | 116.2° | 120.2° |
| N27 | C31 | C44 | H31 | 115.2° | 120.2° |
| N27 | C31 | C33 | C36 | 179.7° | 177.5° |
| N27 | C31 | C44 | C41 | 177.1° | 177.6° |
| C31 | N27 | C25 | H25 | 1.2° | 0.1° |
| N27 | C31 | C33 | H33 | 60.3° | 62.5° |
| N27 | C31 | C33 | H33A | 59.7° | 57.7° |
| N27 | C31 | C44 | H44 | 57.1° | 57.7° |
| N27 | C31 | C44 | H44A | 62.9° | 62.5° |
| C33 | C31 | C44 | H31 | 116.6° | 119.9° |
| C31 | C33 | C36 | H33 | 120.0° | 120.0° |
| C31 | C33 | C36 | H33A | 120.0° | 119.9° |
| C31 | C33 | C36 | N39 | 52.7° | 59.1° |
| C33 | C31 | C44 | C41 | 49.0° | 57.6° |
| C31 | C33 | H33 | H33A | 119.0° | 120.1° |
| C31 | C33 | C36 | H36 | 67.3° | 60.9° |
| C31 | C33 | C36 | H36A | 172.7° | 179.2° |
| C33 | C31 | C44 | H44 | 71.0° | 62.3° |
| C33 | C31 | C44 | H44A | 169.0° | 177.6° |
| C44 | C31 | C33 | C36 | 48.9° | 57.6° |
| C31 | C44 | C41 | N39 | 54.1° | 59.1° |
| C31 | C44 | C41 | H44 | 120.0° | 119.9° |
| C31 | C44 | C41 | H44A | 120.0° | 120.0° |
| C44 | C31 | C33 | H33 | 168.9° | 177.6° |
| C44 | C31 | C33 | H33A | 71.1° | 62.3° |
| C31 | C44 | C41 | H41 | 65.9° | 60.9° |
| C31 | C44 | C41 | H41A | 174.1° | 179.2° |
| C31 | C44 | H44 | H44A | 119.8° | 120.1° |
| C33 | C36 | N39 | H36 | 120.0° | 120.0° |
| C33 | C36 | N39 | H36A | 120.0° | 120.1° |
| C33 | C36 | N39 | C41 | 62.6° | 61.7° |
| C36 | C33 | C31 | H31 | 64.0° | 62.3° |
| C36 | C33 | H33 | H33A | 119.0° | 120.0° |
| C33 | C36 | H36 | H36A | 120.5° | 120.0° |
| C33 | C36 | N39 | HN39 | 177.4° | 174.2° |
| C36 | N39 | C41 | HN39 | 120.0° | 124.2° |
| C36 | N39 | C41 | C44 | 64.0° | 61.7° |
| N39 | C36 | C33 | H33 | 172.7° | 179.1° |
| N39 | C36 | C33 | H33A | 67.3° | 60.8° |
| N39 | C36 | H36 | H36A | 120.5° | 120.0° |
| C36 | N39 | C41 | H41 | 56.0° | 58.3° |
| C36 | N39 | C41 | H41A | 176.0° | 178.2° |
| N39 | C41 | C44 | H41 | 120.0° | 120.0° |
| N39 | C41 | C44 | H41A | 120.0° | 120.1° |
| C41 | N39 | C36 | H36 | 57.4° | 58.3° |
| C41 | N39 | C36 | H36A | 177.4° | 178.2° |
| N39 | C41 | H41 | H41A | 120.3° | 120.0° |
| N39 | C41 | C44 | H44 | 65.9° | 60.8° |
| N39 | C41 | C44 | H44A | 174.1° | 179.1° |
| C41 | C44 | C31 | H31 | 67.7° | 62.3° |
| C44 | C41 | N39 | HN39 | 176.0° | 174.1° |
| C44 | C41 | H41 | H41A | 120.2° | 120.0° |
| C41 | C44 | H44 | H44A | 119.8° | 120.1° |
| C48 | N51 | C52 | C62 | 137.8° | 123.7° |
| C48 | N51 | C52 | C55 | 179.6° | 177.6° |
| C48 | N51 | C62 | C59 | 178.4° | 177.6° |
| N51 | C48 | H48 | H48A | 119.8° | 119.9° |
| C48 | N51 | C52 | H52 | 60.3° | 62.4° |
| C48 | N51 | C52 | H52A | 59.6° | 57.7° |
| C48 | N51 | C62 | H62 | 58.4° | 57.7° |
| C48 | N51 | C62 | H62A | 61.6° | 62.5° |
| N51 | C52 | C55 | H52 | 120.0° | 120.0° |
| N51 | C52 | C55 | H52A | 120.0° | 119.9° |
| N51 | C52 | C55 | O58 | 49.8° | 56.9° |
| C52 | N51 | C62 | C59 | 45.0° | 58.6° |
| C52 | N51 | C48 | H48 | 49.3° | 69.9° |
| C52 | N51 | C48 | H48A | 169.3° | 50.0° |
| N51 | C52 | H52 | H52A | 118.5° | 120.0° |
| N51 | C52 | C55 | H55 | 169.9° | 176.8° |
| N51 | C52 | C55 | H55A | 70.2° | 63.1° |
| C52 | N51 | C62 | H62 | 165.0° | 178.5° |
| C52 | N51 | C62 | H62A | 75.0° | 61.3° |
| C62 | N51 | C52 | C55 | 42.6° | 58.7° |
| N51 | C62 | C59 | O58 | 55.1° | 56.8° |
| N51 | C62 | C59 | H62 | 120.0° | 119.9° |
| N51 | C62 | C59 | H62A | 120.0° | 119.9° |
| C62 | N51 | C48 | H48 | 174.1° | 53.7° |
| C62 | N51 | C48 | H48A | 54.1° | 173.7° |
| C62 | N51 | C52 | H52 | 77.4° | 61.3° |
| C62 | N51 | C52 | H52A | 162.6° | 178.6° |
| N51 | C62 | C59 | H59 | 175.1° | 176.8° |
| N51 | C62 | C59 | H59A | 65.0° | 63.1° |
| N51 | C62 | H62 | H62A | 119.1° | 120.2° |
| C52 | C55 | O58 | H55 | 120.0° | 119.9° |
| C52 | C55 | O58 | H55A | 120.0° | 120.0° |
| C52 | C55 | O58 | C59 | 62.1° | 58.7° |
| C55 | C52 | H52 | H52A | 118.4° | 120.1° |
| C52 | C55 | H55 | H55A | 119.7° | 120.1° |
| C55 | O58 | C59 | C62 | 64.9° | 58.7° |
| O58 | C55 | C52 | H52 | 70.2° | 63.1° |
| O58 | C55 | C52 | H52A | 169.9° | 176.8° |
| O58 | C55 | H55 | H55A | 119.7° | 120.1° |
| C55 | O58 | C59 | H59 | 175.1° | 178.6° |
| C55 | O58 | C59 | H59A | 55.1° | 61.3° |
| O58 | C59 | C62 | H59 | 120.0° | 119.9° |
| O58 | C59 | C62 | H59A | 120.0° | 119.9° |
| C59 | O58 | C55 | H55 | 177.9° | 178.6° |
| C59 | O58 | C55 | H55A | 57.9° | 61.3° |
| O58 | C59 | H59 | H59A | 120.1° | 120.1° |
| O58 | C59 | C62 | H62 | 175.0° | 176.8° |
| O58 | C59 | C62 | H62A | 64.9° | 63.1° |
| C62 | C59 | H59 | H59A | 120.1° | 120.1° |
| C59 | C62 | H62 | H62A | 119.1° | 120.1° |
| H18 | C18 | C20 | H20 | 0.9° | 0.0° |
| H20 | C20 | C22 | H22 | 1.0° | 0.0° |
| H31 | C31 | C33 | H33 | 56.0° | 57.7° |
| H31 | C31 | C33 | H33A | 176.0° | 177.8° |
| H31 | C31 | C44 | H44 | 172.3° | 177.8° |
| H31 | C31 | C44 | H44A | 52.3° | 57.7° |
| H33 | C33 | C36 | H36 | 52.7° | 59.2° |
| H33 | C33 | C36 | H36A | 67.3° | 60.8° |
| H33A | C33 | C36 | H36 | 172.7° | 179.3° |
| H33A | C33 | C36 | H36A | 52.7° | 59.3° |
| H36 | C36 | N39 | HN39 | 62.7° | 65.9° |
| H36A | C36 | N39 | HN39 | 57.4° | 54.1° |
| HN39 | N39 | C41 | H41 | 64.0° | 65.9° |
| HN39 | N39 | C41 | H41A | 56.0° | 54.1° |
| H41 | C41 | C44 | H44 | 174.1° | 179.2° |
| H41 | C41 | C44 | H44A | 54.1° | 59.1° |
| H41A | C41 | C44 | H44 | 54.1° | 59.3° |
| H41A | C41 | C44 | H44A | 65.9° | 60.8° |
| H52 | C52 | C55 | H55 | 49.8° | 56.9° |
| H52 | C52 | C55 | H55A | 169.8° | 177.0° |
| H52A | C52 | C55 | H55 | 70.1° | 63.3° |
| H52A | C52 | C55 | H55A | 49.9° | 56.8° |
| H59 | C59 | C62 | H62 | 65.0° | 63.3° |
| H59 | C59 | C62 | H62A | 55.1° | 56.9° |
| H59A | C59 | C62 | H62 | 55.0° | 56.8° |
| H59A | C59 | C62 | H62A | 175.0° | 177.0° |
