A1JMO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F1 | C2 | sing | 1.40Å | 1.33Å | |
| C2 | F3 | sing | 1.40Å | 1.33Å | |
| C2 | F4 | sing | 1.40Å | 1.32Å | |
| C2 | C5 | sing | 1.53Å | 1.50Å | |
| C5 | N6 | sing | 1.46Å | 1.47Å | |
| N6 | C7 | sing | 1.38Å | 1.38Å | Aromatic |
| C7 | C8 | doub | 1.41Å | 1.40Å | Aromatic |
| C8 | C9 | sing | 1.40Å | 1.40Å | Aromatic |
| C9 | N10 | sing | 1.39Å | 1.37Å | |
| N10 | C11 | sing | 1.47Å | 1.45Å | |
| C11 | C12 | sing | 1.53Å | 1.52Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C13 | N14 | sing | 1.47Å | 1.49Å | |
| N14 | C15 | sing | 1.47Å | 1.49Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| N14 | C17 | sing | 1.47Å | 1.49Å | |
| C9 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.39Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C8 | C21 | sing | 1.46Å | 1.43Å | Aromatic |
| C21 | C22 | doub | 1.36Å | 1.38Å | Aromatic |
| C22 | C23 | sing | 1.43Å | 1.43Å | |
| C23 | C24 | trip | 1.17Å | 1.19Å | |
| C24 | C25 | sing | 1.47Å | 1.47Å | |
| C25 | N26 | sing | 1.46Å | 1.45Å | |
| N26 | C27 | sing | 1.40Å | 1.38Å | |
| C27 | C28 | doub | 1.39Å | 1.39Å | Aromatic |
| C28 | C29 | sing | 1.38Å | 1.38Å | Aromatic |
| C29 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | P31 | sing | 1.81Å | 1.80Å | |
| P31 | C32 | sing | 1.82Å | 1.79Å | |
| P31 | C33 | sing | 1.82Å | 1.79Å | |
| P31 | O34 | doub | 1.48Å | 1.48Å | |
| C30 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | C36 | doub | 1.38Å | 1.38Å | Aromatic |
| C22 | N6 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | C11 | sing | 1.53Å | 1.52Å | |
| C36 | C27 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C12 | H12B | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C15 | H15B | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C16 | H16B | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C17 | H17B | sing | 1.09Å | 1.10Å | |
| C17 | H17C | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C32 | H32B | sing | 1.09Å | 1.10Å | |
| C32 | H32C | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C33 | H33B | sing | 1.09Å | 1.10Å | |
| C33 | H33C | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C5 | H5B | sing | 1.09Å | 1.10Å | |
| N10 | H10 | sing | 0.97Å | 1.00Å | |
| N26 | H26 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F1 | C2 | F3 | 106.2° | 109.5° |
| F1 | C2 | F4 | 107.2° | 109.5° |
| F1 | C2 | C5 | 112.1° | 109.5° |
| F3 | C2 | F4 | 106.7° | 109.5° |
| F3 | C2 | C5 | 112.7° | 109.5° |
| F4 | C2 | C5 | 111.6° | 109.5° |
| C2 | C5 | N6 | 111.9° | 109.5° |
| C2 | C5 | H5A | 108.9° | 109.5° |
| C2 | C5 | H5B | 108.9° | 109.4° |
| C5 | N6 | C7 | 125.4° | 125.2° |
| C5 | N6 | C22 | 126.7° | 125.1° |
| N6 | C5 | H5A | 108.9° | 109.5° |
| N6 | C5 | H5B | 108.8° | 109.5° |
| N6 | C7 | C8 | 108.8° | 107.5° |
| C7 | N6 | C22 | 107.9° | 109.7° |
| N6 | C7 | C20 | 129.3° | 133.1° |
| C7 | C8 | C9 | 119.5° | 119.9° |
| C7 | C8 | C21 | 106.4° | 106.4° |
| C8 | C7 | C20 | 121.9° | 119.4° |
| C8 | C9 | N10 | 119.5° | 120.3° |
| C8 | C9 | C18 | 118.7° | 119.5° |
| C9 | C8 | C21 | 134.0° | 133.7° |
| C9 | N10 | C11 | 125.5° | 120.0° |
| N10 | C9 | C18 | 121.7° | 120.2° |
| C9 | N10 | H10 | 105.3° | 120.0° |
| N10 | C11 | C12 | 109.7° | 109.5° |
| N10 | C11 | C16 | 110.2° | 109.5° |
| N10 | C11 | H11 | 109.4° | 109.5° |
| C11 | N10 | H10 | 105.3° | 120.0° |
| C11 | C12 | C13 | 110.6° | 109.2° |
| C12 | C11 | C16 | 110.5° | 109.2° |
| C12 | C11 | H11 | 108.5° | 109.6° |
| C11 | C12 | H12A | 109.2° | 109.5° |
| C11 | C12 | H12B | 109.2° | 109.5° |
| C12 | C13 | N14 | 110.0° | 109.5° |
| C13 | C12 | H12A | 109.2° | 109.5° |
| C13 | C12 | H12B | 109.2° | 109.5° |
| C12 | C13 | H13A | 109.4° | 109.4° |
| C12 | C13 | H13B | 109.3° | 109.5° |
| C13 | N14 | C15 | 110.1° | 111.2° |
| C13 | N14 | C17 | 111.5° | 111.0° |
| N14 | C13 | H13A | 109.3° | 109.4° |
| N14 | C13 | H13B | 109.3° | 109.5° |
| N14 | C15 | C16 | 110.0° | 109.5° |
| C15 | N14 | C17 | 111.3° | 111.0° |
| N14 | C15 | H15A | 109.3° | 109.4° |
| N14 | C15 | H15B | 109.3° | 109.4° |
| C15 | C16 | C11 | 110.1° | 109.2° |
| C16 | C15 | H15A | 109.3° | 109.5° |
| C16 | C15 | H15B | 109.4° | 109.5° |
| C15 | C16 | H16A | 109.3° | 109.5° |
| C15 | C16 | H16B | 109.3° | 109.5° |
| N14 | C17 | H17A | 109.5° | 109.5° |
| N14 | C17 | H17B | 109.5° | 109.5° |
| N14 | C17 | H17C | 109.5° | 109.5° |
| C9 | C18 | C19 | 120.7° | 120.3° |
| C9 | C18 | H18 | 119.6° | 119.9° |
| C18 | C19 | C20 | 121.2° | 120.8° |
| C19 | C18 | H18 | 119.7° | 119.8° |
| C18 | C19 | H19 | 119.4° | 119.6° |
| C19 | C20 | C7 | 117.9° | 120.1° |
| C20 | C19 | H19 | 119.4° | 119.7° |
| C19 | C20 | H20 | 121.0° | 119.9° |
| C8 | C21 | C22 | 107.5° | 106.9° |
| C8 | C21 | H21 | 126.3° | 126.5° |
| C21 | C22 | C23 | 123.1° | 125.3° |
| C21 | C22 | N6 | 109.4° | 109.5° |
| C22 | C21 | H21 | 126.2° | 126.5° |
| C22 | C23 | C24 | 176.3° | 180.0° |
| C23 | C22 | N6 | 127.5° | 125.3° |
| C23 | C24 | C25 | 176.3° | 180.0° |
| C24 | C25 | N26 | 113.0° | 109.5° |
| C24 | C25 | H25A | 108.6° | 109.4° |
| C24 | C25 | H25B | 108.6° | 109.5° |
| C25 | N26 | C27 | 122.3° | 120.0° |
| N26 | C25 | H25A | 108.6° | 109.5° |
| N26 | C25 | H25B | 108.6° | 109.5° |
| C25 | N26 | H26 | 106.2° | 120.0° |
| N26 | C27 | C28 | 120.8° | 120.0° |
| N26 | C27 | C36 | 119.9° | 120.1° |
| C27 | N26 | H26 | 106.2° | 120.0° |
| C27 | C28 | C29 | 120.2° | 119.9° |
| C28 | C27 | C36 | 119.3° | 119.9° |
| C27 | C28 | H28 | 119.9° | 120.1° |
| C28 | C29 | C30 | 120.5° | 120.1° |
| C29 | C28 | H28 | 119.9° | 120.1° |
| C28 | C29 | H29 | 119.7° | 119.9° |
| C29 | C30 | P31 | 121.4° | 119.9° |
| C29 | C30 | C35 | 119.0° | 120.2° |
| C30 | C29 | H29 | 119.7° | 120.0° |
| C30 | P31 | C32 | 106.5° | 109.5° |
| C30 | P31 | C33 | 106.0° | 109.5° |
| C30 | P31 | O34 | 112.0° | 109.5° |
| P31 | C30 | C35 | 119.5° | 119.9° |
| C32 | P31 | C33 | 105.3° | 109.5° |
| C32 | P31 | O34 | 112.6° | 109.5° |
| P31 | C32 | H32A | 109.5° | 109.5° |
| P31 | C32 | H32B | 109.5° | 109.5° |
| P31 | C32 | H32C | 109.5° | 109.5° |
| C33 | P31 | O34 | 113.9° | 109.5° |
| P31 | C33 | H33A | 109.5° | 109.5° |
| P31 | C33 | H33B | 109.5° | 109.5° |
| P31 | C33 | H33C | 109.5° | 109.5° |
| C30 | C35 | C36 | 120.6° | 120.0° |
| C30 | C35 | H35 | 119.7° | 120.0° |
| C35 | C36 | C27 | 120.3° | 119.9° |
| C36 | C35 | H35 | 119.7° | 120.0° |
| C35 | C36 | H36 | 119.8° | 120.0° |
| C7 | C20 | H20 | 121.0° | 119.9° |
| C16 | C11 | H11 | 108.5° | 109.5° |
| C11 | C16 | H16A | 109.3° | 109.5° |
| C11 | C16 | H16B | 109.3° | 109.5° |
| C27 | C36 | H36 | 119.9° | 120.1° |
| H12A | C12 | H12B | 109.5° | 109.6° |
| H13A | C13 | H13B | 109.5° | 109.4° |
| H15A | C15 | H15B | 109.5° | 109.5° |
| H16A | C16 | H16B | 109.5° | 109.6° |
| H17A | C17 | H17B | 109.5° | 109.4° |
| H17A | C17 | H17C | 109.5° | 109.5° |
| H17B | C17 | H17C | 109.5° | 109.5° |
| H25A | C25 | H25B | 109.5° | 109.5° |
| H32A | C32 | H32B | 109.5° | 109.5° |
| H32A | C32 | H32C | 109.5° | 109.5° |
| H32B | C32 | H32C | 109.4° | 109.5° |
| H33A | C33 | H33B | 109.5° | 109.5° |
| H33A | C33 | H33C | 109.5° | 109.4° |
| H33B | C33 | H33C | 109.5° | 109.4° |
| H5A | C5 | H5B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F1 | C2 | F3 | F4 | 114.1° | 120.0° |
| F1 | C2 | F3 | C5 | 123.1° | 120.0° |
| F1 | C2 | F4 | C5 | 123.1° | 120.0° |
| F1 | C2 | C5 | N6 | 51.9° | 60.0° |
| F1 | C2 | C5 | H5A | 68.5° | 60.0° |
| F1 | C2 | C5 | H5B | 172.3° | 180.0° |
| F3 | C2 | F4 | C5 | 123.5° | 120.0° |
| F3 | C2 | C5 | N6 | 67.8° | 60.0° |
| F3 | C2 | C5 | H5A | 171.8° | 180.0° |
| F3 | C2 | C5 | H5B | 52.5° | 60.0° |
| F4 | C2 | C5 | N6 | 172.2° | 180.0° |
| F4 | C2 | C5 | H5A | 51.8° | 60.0° |
| F4 | C2 | C5 | H5B | 67.5° | 60.0° |
| C2 | C5 | N6 | H5A | 120.4° | 120.0° |
| C2 | C5 | N6 | H5B | 120.4° | 120.0° |
| C2 | C5 | N6 | C7 | 88.1° | 90.0° |
| C2 | C5 | N6 | C22 | 93.0° | 90.0° |
| C2 | C5 | H5A | H5B | 118.9° | 120.0° |
| C5 | N6 | C7 | C22 | 179.1° | 180.0° |
| C5 | N6 | C7 | C8 | 179.0° | 180.0° |
| C5 | N6 | C22 | C21 | 179.0° | 180.0° |
| C5 | N6 | C22 | C23 | 1.9° | 0.1° |
| C5 | N6 | C7 | C20 | 4.2° | 0.0° |
| N6 | C5 | H5A | H5B | 118.9° | 120.0° |
| N6 | C7 | C8 | C20 | 177.1° | 180.0° |
| N6 | C7 | C8 | C9 | 177.0° | 179.7° |
| N6 | C7 | C20 | C19 | 176.3° | 180.0° |
| N6 | C7 | C8 | C21 | 0.1° | 0.0° |
| C7 | N6 | C22 | C21 | 0.1° | 0.0° |
| C7 | N6 | C22 | C23 | 179.1° | 180.0° |
| N6 | C7 | C20 | H20 | 3.7° | 0.0° |
| C7 | N6 | C5 | H5A | 151.5° | 150.0° |
| C7 | N6 | C5 | H5B | 32.3° | 30.0° |
| C7 | C8 | C9 | C21 | 175.8° | 179.6° |
| C7 | C8 | C9 | N10 | 179.2° | 180.0° |
| C7 | C8 | C9 | C18 | 0.1° | 0.6° |
| C8 | C7 | C20 | C19 | 0.1° | 0.0° |
| C7 | C8 | C21 | C22 | 0.1° | 0.0° |
| C8 | C7 | N6 | C22 | 0.1° | 0.0° |
| C8 | C7 | C20 | H20 | 179.9° | 180.0° |
| C7 | C8 | C21 | H21 | 179.9° | 180.0° |
| C8 | C9 | N10 | C18 | 179.3° | 179.4° |
| C8 | C9 | N10 | C11 | 176.6° | 180.0° |
| C8 | C9 | C18 | C19 | 0.1° | 0.6° |
| C9 | C8 | C21 | C22 | 176.3° | 179.7° |
| C9 | C8 | C7 | C20 | 0.1° | 0.3° |
| C8 | C9 | C18 | H18 | 179.9° | 179.7° |
| C9 | C8 | C21 | H21 | 3.7° | 0.4° |
| C8 | C9 | N10 | H10 | 54.5° | 0.0° |
| C9 | N10 | C11 | H10 | 122.1° | 180.0° |
| C9 | N10 | C11 | C12 | 162.2° | 155.0° |
| N10 | C9 | C18 | C19 | 179.2° | 180.0° |
| N10 | C9 | C8 | C21 | 3.4° | 0.4° |
| C9 | N10 | C11 | C16 | 75.9° | 85.3° |
| C9 | N10 | C11 | H11 | 43.3° | 34.8° |
| N10 | C9 | C18 | H18 | 0.8° | 0.3° |
| N10 | C11 | C12 | C16 | 121.7° | 119.9° |
| N10 | C11 | C12 | H11 | 119.4° | 120.1° |
| N10 | C11 | C12 | C13 | 177.0° | 177.6° |
| N10 | C11 | C16 | C15 | 177.1° | 177.6° |
| C11 | N10 | C9 | C18 | 2.6° | 0.6° |
| N10 | C11 | C16 | H11 | 119.7° | 120.1° |
| N10 | C11 | C12 | H12A | 56.9° | 57.7° |
| N10 | C11 | C12 | H12B | 62.8° | 62.4° |
| N10 | C11 | C16 | H16A | 57.0° | 62.5° |
| N10 | C11 | C16 | H16B | 62.8° | 57.7° |
| C11 | C12 | C13 | H12A | 120.1° | 119.9° |
| C11 | C12 | C13 | H12B | 120.1° | 119.9° |
| C11 | C12 | C13 | N14 | 57.5° | 59.2° |
| C12 | C11 | C16 | C15 | 55.8° | 57.7° |
| C12 | C11 | C16 | H11 | 118.9° | 120.0° |
| C11 | C12 | H12A | H12B | 119.5° | 120.1° |
| C11 | C12 | C13 | H13A | 177.6° | 179.2° |
| C11 | C12 | C13 | H13B | 62.6° | 60.9° |
| C12 | C11 | C16 | H16A | 64.4° | 177.6° |
| C12 | C11 | C16 | H16B | 175.8° | 62.2° |
| C12 | C11 | N10 | H10 | 75.6° | 25.0° |
| C12 | C13 | N14 | H13A | 120.1° | 120.0° |
| C12 | C13 | N14 | H13B | 120.1° | 120.0° |
| C12 | C13 | N14 | C15 | 60.3° | 61.8° |
| C12 | C13 | N14 | C17 | 175.6° | 174.2° |
| C13 | C12 | C11 | C16 | 55.3° | 57.7° |
| C13 | C12 | C11 | H11 | 63.5° | 62.3° |
| C13 | C12 | H12A | H12B | 119.5° | 120.1° |
| C12 | C13 | H13A | H13B | 119.8° | 119.9° |
| C13 | N14 | C15 | C17 | 124.1° | 124.1° |
| C13 | N14 | C15 | C16 | 61.0° | 61.8° |
| N14 | C13 | C12 | H12A | 62.7° | 60.7° |
| N14 | C13 | C12 | H12B | 177.6° | 179.1° |
| N14 | C13 | H13A | H13B | 119.7° | 120.0° |
| C13 | N14 | C15 | H15A | 179.0° | 58.3° |
| C13 | N14 | C15 | H15B | 59.1° | 178.2° |
| C13 | N14 | C17 | H17A | 180.0° | 60.0° |
| C13 | N14 | C17 | H17B | 60.0° | 180.0° |
| C13 | N14 | C17 | H17C | 60.0° | 60.0° |
| N14 | C15 | C16 | H15A | 120.1° | 120.0° |
| N14 | C15 | C16 | H15B | 120.1° | 120.0° |
| N14 | C15 | C16 | C11 | 58.5° | 59.2° |
| C15 | N14 | C13 | H13A | 179.6° | 178.2° |
| C15 | N14 | C13 | H13B | 59.7° | 58.3° |
| N14 | C15 | H15A | H15B | 119.8° | 119.9° |
| N14 | C15 | C16 | H16A | 61.6° | 179.1° |
| N14 | C15 | C16 | H16B | 178.6° | 60.7° |
| C15 | N14 | C17 | H17A | 56.6° | 64.2° |
| C15 | N14 | C17 | H17B | 176.6° | 55.8° |
| C15 | N14 | C17 | H17C | 63.4° | 175.8° |
| C16 | C15 | N14 | C17 | 174.9° | 174.1° |
| C15 | C16 | C11 | H16A | 120.1° | 119.9° |
| C15 | C16 | C11 | H16B | 120.1° | 119.9° |
| C15 | C16 | C11 | H11 | 63.1° | 62.3° |
| C16 | C15 | H15A | H15B | 119.8° | 120.0° |
| C15 | C16 | H16A | H16B | 119.7° | 120.1° |
| C17 | N14 | C13 | H13A | 55.5° | 54.2° |
| C17 | N14 | C13 | H13B | 64.3° | 65.8° |
| C17 | N14 | C15 | H15A | 54.8° | 65.8° |
| C17 | N14 | C15 | H15B | 65.0° | 54.1° |
| N14 | C17 | H17A | H17B | 120.0° | 120.0° |
| N14 | C17 | H17A | H17C | 120.0° | 120.0° |
| N14 | C17 | H17B | H17C | 120.0° | 120.0° |
| C9 | C18 | C19 | H18 | 180.0° | 179.7° |
| C9 | C18 | C19 | C20 | 0.1° | 0.3° |
| C18 | C9 | C8 | C21 | 175.9° | 179.8° |
| C9 | C18 | C19 | H19 | 179.9° | 179.7° |
| C18 | C9 | N10 | H10 | 124.8° | 179.4° |
| C18 | C19 | C20 | H19 | 180.0° | 180.0° |
| C18 | C19 | C20 | C7 | 0.1° | 0.0° |
| C18 | C19 | C20 | H20 | 179.8° | 179.9° |
| C19 | C20 | C7 | H20 | 180.0° | 180.0° |
| C20 | C19 | C18 | H18 | 179.9° | 180.0° |
| C8 | C21 | C22 | H21 | 180.0° | 180.0° |
| C8 | C21 | C22 | C23 | 179.2° | 179.9° |
| C8 | C21 | C22 | N6 | 0.0° | 0.0° |
| C21 | C8 | C7 | C20 | 176.9° | 180.0° |
| C21 | C22 | C23 | N6 | 179.0° | 179.9° |
| C21 | C22 | C23 | C24 | 62.4° | 171.5° |
| C22 | C23 | C24 | C25 | 39.7° | 104.1° |
| C23 | C22 | C21 | H21 | 0.8° | 0.0° |
| C23 | C24 | C25 | N26 | 171.4° | 112.7° |
| C24 | C23 | C22 | N6 | 116.6° | 8.5° |
| C23 | C24 | C25 | H25A | 68.1° | 127.4° |
| C23 | C24 | C25 | H25B | 50.9° | 7.4° |
| C24 | C25 | N26 | H25A | 120.5° | 120.0° |
| C24 | C25 | N26 | H25B | 120.5° | 120.0° |
| C24 | C25 | N26 | C27 | 77.0° | 180.0° |
| C24 | C25 | H25A | H25B | 118.4° | 120.0° |
| C24 | C25 | N26 | H26 | 161.2° | 0.0° |
| C25 | N26 | C27 | H26 | 121.8° | 179.9° |
| C25 | N26 | C27 | C28 | 5.7° | 180.0° |
| C25 | N26 | C27 | C36 | 172.0° | 0.3° |
| N26 | C25 | H25A | H25B | 118.4° | 120.0° |
| N26 | C27 | C28 | C36 | 177.7° | 179.7° |
| N26 | C27 | C28 | C29 | 177.7° | 179.7° |
| N26 | C27 | C36 | C35 | 177.7° | 179.7° |
| C27 | N26 | C25 | H25A | 43.6° | 60.0° |
| C27 | N26 | C25 | H25B | 162.5° | 60.0° |
| N26 | C27 | C28 | H28 | 2.4° | 0.3° |
| N26 | C27 | C36 | H36 | 2.3° | 0.3° |
| C27 | C28 | C29 | H28 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.1° | 0.0° |
| C28 | C27 | C36 | C35 | 0.0° | 0.0° |
| C27 | C28 | C29 | H29 | 179.9° | 179.9° |
| C28 | C27 | C36 | H36 | 179.9° | 180.0° |
| C28 | C27 | N26 | H26 | 116.1° | 0.0° |
| C28 | C29 | C30 | H29 | 180.0° | 179.9° |
| C28 | C29 | C30 | P31 | 179.9° | 180.0° |
| C28 | C29 | C30 | C35 | 0.1° | 0.1° |
| C29 | C28 | C27 | C36 | 0.1° | 0.0° |
| C29 | C30 | P31 | C35 | 179.9° | 180.0° |
| C29 | C30 | P31 | C32 | 95.9° | 150.0° |
| C29 | C30 | P31 | C33 | 152.3° | 90.0° |
| C29 | C30 | P31 | O34 | 27.6° | 30.0° |
| C29 | C30 | C35 | C36 | 0.0° | 0.0° |
| C30 | C29 | C28 | H28 | 179.9° | 180.0° |
| C29 | C30 | C35 | H35 | 180.0° | 180.0° |
| C30 | P31 | C32 | C33 | 112.3° | 120.0° |
| C30 | P31 | C32 | O34 | 123.1° | 120.0° |
| C30 | P31 | C33 | O34 | 123.6° | 120.0° |
| P31 | C30 | C35 | C36 | 179.9° | 180.0° |
| P31 | C30 | C29 | H29 | 0.2° | 0.1° |
| C30 | P31 | C32 | H32A | 180.0° | 60.0° |
| C30 | P31 | C32 | H32B | 60.0° | 180.0° |
| C30 | P31 | C32 | H32C | 60.0° | 60.0° |
| C30 | P31 | C33 | H33A | 180.0° | 60.0° |
| C30 | P31 | C33 | H33B | 60.0° | 180.0° |
| C30 | P31 | C33 | H33C | 60.0° | 60.0° |
| P31 | C30 | C35 | H35 | 0.1° | 0.1° |
| C32 | P31 | C33 | O34 | 123.8° | 120.0° |
| C32 | P31 | C30 | C35 | 84.0° | 30.0° |
| P31 | C32 | H32A | H32B | 120.0° | 120.0° |
| P31 | C32 | H32A | H32C | 120.0° | 120.0° |
| P31 | C32 | H32B | H32C | 120.0° | 120.0° |
| C32 | P31 | C33 | H33A | 67.4° | 180.0° |
| C32 | P31 | C33 | H33B | 52.6° | 60.0° |
| C32 | P31 | C33 | H33C | 172.6° | 60.0° |
| C33 | P31 | C30 | C35 | 27.7° | 90.0° |
| C33 | P31 | C32 | H32A | 67.7° | 60.0° |
| C33 | P31 | C32 | H32B | 172.3° | 60.0° |
| C33 | P31 | C32 | H32C | 52.3° | 180.0° |
| P31 | C33 | H33A | H33B | 120.0° | 120.0° |
| P31 | C33 | H33A | H33C | 120.0° | 120.1° |
| P31 | C33 | H33B | H33C | 120.0° | 120.0° |
| O34 | P31 | C30 | C35 | 152.5° | 150.0° |
| O34 | P31 | C32 | H32A | 56.9° | 180.0° |
| O34 | P31 | C32 | H32B | 63.1° | 60.0° |
| O34 | P31 | C32 | H32C | 176.9° | 60.0° |
| O34 | P31 | C33 | H33A | 56.4° | 60.0° |
| O34 | P31 | C33 | H33B | 176.4° | 60.0° |
| O34 | P31 | C33 | H33C | 63.7° | 180.0° |
| C30 | C35 | C36 | H35 | 180.0° | 179.9° |
| C30 | C35 | C36 | C27 | 0.0° | 0.0° |
| C35 | C30 | C29 | H29 | 179.9° | 180.0° |
| C30 | C35 | C36 | H36 | 180.0° | 180.0° |
| C35 | C36 | C27 | H36 | 180.0° | 180.0° |
| C22 | N6 | C7 | C20 | 176.7° | 180.0° |
| N6 | C22 | C21 | H21 | 180.0° | 180.0° |
| C22 | N6 | C5 | H5A | 27.4° | 30.0° |
| C22 | N6 | C5 | H5B | 146.7° | 150.0° |
| C7 | C20 | C19 | H19 | 179.9° | 180.0° |
| C16 | C11 | C12 | H12A | 64.8° | 62.2° |
| C16 | C11 | C12 | H12B | 175.5° | 177.6° |
| C11 | C16 | C15 | H15A | 178.6° | 60.8° |
| C11 | C16 | C15 | H15B | 61.6° | 179.2° |
| C11 | C16 | H16A | H16B | 119.7° | 120.1° |
| C16 | C11 | N10 | H10 | 46.2° | 94.7° |
| C36 | C27 | C28 | H28 | 179.9° | 180.0° |
| C27 | C36 | C35 | H35 | 180.0° | 179.9° |
| C36 | C27 | N26 | H26 | 66.2° | 179.6° |
| H11 | C11 | C12 | H12A | 176.3° | 177.8° |
| H11 | C11 | C12 | H12B | 56.6° | 57.7° |
| H11 | C11 | C16 | H16A | 176.7° | 57.6° |
| H11 | C11 | C16 | H16B | 57.0° | 177.8° |
| H11 | C11 | N10 | H10 | 165.4° | 145.2° |
| H12A | C12 | C13 | H13A | 57.4° | 59.3° |
| H12A | C12 | C13 | H13B | 177.2° | 179.2° |
| H12B | C12 | C13 | H13A | 62.3° | 60.9° |
| H12B | C12 | C13 | H13B | 57.5° | 59.1° |
| H15A | C15 | C16 | H16A | 58.4° | 59.1° |
| H15A | C15 | C16 | H16B | 61.4° | 179.3° |
| H15B | C15 | C16 | H16A | 178.3° | 60.9° |
| H15B | C15 | C16 | H16B | 58.5° | 59.3° |
| H17A | C17 | H17B | H17C | 120.0° | 120.0° |
| H18 | C18 | C19 | H19 | 0.1° | 0.0° |
| H19 | C19 | C20 | H20 | 0.2° | 0.0° |
| H25A | C25 | N26 | H26 | 78.2° | 119.9° |
| H25B | C25 | N26 | H26 | 40.7° | 120.0° |
| H28 | C28 | C29 | H29 | 0.2° | 0.0° |
| H32A | C32 | H32B | H32C | 120.0° | 120.0° |
| H33A | C33 | H33B | H33C | 120.0° | 119.9° |
| H35 | C35 | C36 | H36 | 0.0° | 0.1° |
