A1AA0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.51Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | C4 | sing | 1.53Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C5 | N6 | sing | 1.46Å | 1.47Å | |
| N6 | C7 | sing | 1.46Å | 1.46Å | |
| N6 | C8 | sing | 1.35Å | 1.37Å | |
| C8 | O9 | doub | 1.22Å | 1.22Å | |
| C8 | C10 | sing | 1.47Å | 1.50Å | |
| C10 | C11 | doub | 1.36Å | 1.37Å | Aromatic |
| C11 | C12 | sing | 1.41Å | 1.44Å | Aromatic |
| C12 | C13 | doub | 1.40Å | 1.40Å | Aromatic |
| C13 | F14 | sing | 1.35Å | 1.35Å | |
| C13 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | C16 | doub | 1.39Å | 1.37Å | Aromatic |
| C16 | F17 | sing | 1.35Å | 1.36Å | |
| C16 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | F19 | sing | 1.35Å | 1.35Å | |
| C18 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
| C20 | N21 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C22 | sing | 1.51Å | 1.54Å | |
| C22 | O23 | doub | 1.21Å | 1.22Å | |
| C22 | N24 | sing | 1.35Å | 1.35Å | |
| N24 | C25 | sing | 1.48Å | 1.47Å | |
| C25 | C26 | sing | 1.54Å | 1.59Å | |
| C26 | C27 | sing | 1.54Å | 1.54Å | |
| C27 | C28 | sing | 1.55Å | 1.54Å | |
| C28 | C29 | sing | 1.51Å | 1.49Å | |
| C29 | N30 | doub | 1.28Å | 1.30Å | |
| C26 | C31 | sing | 1.50Å | 1.52Å | |
| C31 | O32 | doub | 1.21Å | 1.22Å | |
| C31 | N33 | sing | 1.35Å | 1.36Å | |
| N33 | C34 | sing | 1.40Å | 1.39Å | |
| C34 | C35 | doub | 1.39Å | 1.39Å | Aromatic |
| C35 | C36 | sing | 1.38Å | 1.39Å | Aromatic |
| C36 | C37 | doub | 1.38Å | 1.39Å | Aromatic |
| C37 | C38 | sing | 1.38Å | 1.39Å | Aromatic |
| C38 | C39 | doub | 1.38Å | 1.39Å | Aromatic |
| N21 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C28 | N24 | sing | 1.47Å | 1.48Å | |
| C39 | C34 | sing | 1.39Å | 1.39Å | Aromatic |
| C20 | C12 | sing | 1.41Å | 1.40Å | Aromatic |
| C35 | C26 | sing | 1.50Å | 1.51Å | |
| C4 | H4B | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C7 | H7B | sing | 1.09Å | 1.10Å | |
| C7 | H7C | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C1 | H1C | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3B | sing | 1.09Å | 1.10Å | |
| C3 | H3C | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| N21 | H21 | sing | 0.97Å | 1.00Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C27 | H27B | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| N30 | H30 | sing | 0.97Å | 1.00Å | |
| N33 | H33 | sing | 0.97Å | 1.00Å | |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C38 | H38 | sing | 1.08Å | 1.08Å | |
| C39 | H39 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 110.3° | 109.5° |
| C1 | C2 | C4 | 110.1° | 109.5° |
| C2 | C1 | H1B | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.5° | 109.5° |
| C2 | C1 | H1C | 109.5° | 109.5° |
| C1 | C2 | H2 | 108.4° | 109.5° |
| C3 | C2 | C4 | 111.3° | 109.5° |
| C3 | C2 | H2 | 108.4° | 109.5° |
| C2 | C3 | H3B | 109.5° | 109.4° |
| C2 | C3 | H3C | 109.5° | 109.4° |
| C2 | C3 | H3A | 109.5° | 109.5° |
| C2 | C4 | C5 | 115.6° | 109.5° |
| C2 | C4 | H4B | 107.9° | 109.5° |
| C2 | C4 | H4A | 107.9° | 109.5° |
| C4 | C2 | H2 | 108.3° | 109.5° |
| C4 | C5 | N6 | 112.7° | 109.5° |
| C4 | C5 | C22 | 109.9° | 109.5° |
| C5 | C4 | H4B | 107.9° | 109.4° |
| C5 | C4 | H4A | 107.9° | 109.5° |
| C4 | C5 | H5 | 107.5° | 109.5° |
| C5 | N6 | C7 | 117.5° | 120.0° |
| C5 | N6 | C8 | 118.1° | 120.0° |
| N6 | C5 | C22 | 110.7° | 109.4° |
| N6 | C5 | H5 | 108.3° | 109.5° |
| C7 | N6 | C8 | 124.2° | 120.0° |
| N6 | C7 | H7A | 109.5° | 109.5° |
| N6 | C7 | H7B | 109.5° | 109.5° |
| N6 | C7 | H7C | 109.5° | 109.4° |
| N6 | C8 | O9 | 121.6° | 120.0° |
| N6 | C8 | C10 | 120.0° | 120.0° |
| O9 | C8 | C10 | 118.4° | 120.0° |
| C8 | C10 | C11 | 133.6° | 125.4° |
| C8 | C10 | N21 | 117.3° | 125.4° |
| C10 | C11 | C12 | 107.2° | 107.7° |
| C11 | C10 | N21 | 109.2° | 109.1° |
| C10 | C11 | H11 | 126.4° | 126.2° |
| C11 | C12 | C13 | 136.0° | 133.3° |
| C11 | C12 | C20 | 106.9° | 107.1° |
| C12 | C11 | H11 | 126.4° | 126.1° |
| C12 | C13 | F14 | 117.8° | 120.1° |
| C12 | C13 | C15 | 124.0° | 119.8° |
| C13 | C12 | C20 | 117.1° | 119.7° |
| F14 | C13 | C15 | 118.1° | 120.1° |
| C13 | C15 | C16 | 117.2° | 120.4° |
| C13 | C15 | H15 | 121.4° | 119.8° |
| C15 | C16 | F17 | 120.0° | 119.7° |
| C15 | C16 | C18 | 121.6° | 120.6° |
| C16 | C15 | H15 | 121.4° | 119.8° |
| F17 | C16 | C18 | 118.5° | 119.7° |
| C16 | C18 | F19 | 119.6° | 120.0° |
| C16 | C18 | C20 | 120.5° | 120.0° |
| F19 | C18 | C20 | 119.9° | 120.0° |
| C18 | C20 | N21 | 132.6° | 133.1° |
| C18 | C20 | C12 | 119.6° | 119.6° |
| C20 | N21 | C10 | 109.0° | 108.7° |
| N21 | C20 | C12 | 107.8° | 107.3° |
| C20 | N21 | H21 | 125.5° | 125.6° |
| C5 | C22 | O23 | 120.0° | 120.0° |
| C5 | C22 | N24 | 118.5° | 120.0° |
| C22 | C5 | H5 | 107.5° | 109.5° |
| O23 | C22 | N24 | 121.4° | 120.0° |
| C22 | N24 | C25 | 128.5° | 125.6° |
| C22 | N24 | C28 | 120.2° | 125.6° |
| N24 | C25 | C26 | 103.1° | 104.7° |
| C25 | N24 | C28 | 111.1° | 108.7° |
| N24 | C25 | H25A | 111.1° | 110.4° |
| N24 | C25 | H25B | 111.0° | 110.4° |
| C25 | C26 | C27 | 99.9° | 103.2° |
| C25 | C26 | C31 | 111.5° | 112.1° |
| C25 | C26 | C35 | 117.8° | 112.2° |
| C26 | C25 | H25A | 111.1° | 110.4° |
| C26 | C25 | H25B | 111.0° | 110.4° |
| C26 | C27 | C28 | 105.2° | 102.8° |
| C27 | C26 | C31 | 112.5° | 111.9° |
| C27 | C26 | C35 | 113.5° | 112.0° |
| C26 | C27 | H27A | 110.5° | 110.7° |
| C26 | C27 | H27B | 110.5° | 110.8° |
| C27 | C28 | C29 | 113.2° | 109.9° |
| C27 | C28 | N24 | 104.7° | 107.3° |
| C27 | C28 | H28 | 108.0° | 110.0° |
| C28 | C27 | H27A | 110.5° | 110.8° |
| C28 | C27 | H27B | 110.5° | 110.8° |
| C28 | C29 | N30 | 120.4° | 120.0° |
| C29 | C28 | N24 | 113.6° | 109.8° |
| C29 | C28 | H28 | 108.5° | 109.9° |
| C28 | C29 | H29 | 119.8° | 120.0° |
| N30 | C29 | H29 | 119.8° | 120.0° |
| C29 | N30 | H30 | 112.0° | 120.0° |
| C26 | C31 | O32 | 125.8° | 126.8° |
| C26 | C31 | N33 | 108.2° | 106.4° |
| C31 | C26 | C35 | 102.2° | 105.5° |
| O32 | C31 | N33 | 126.0° | 126.8° |
| C31 | N33 | C34 | 111.9° | 112.2° |
| C31 | N33 | H33 | 124.1° | 123.9° |
| N33 | C34 | C35 | 109.5° | 110.2° |
| N33 | C34 | C39 | 129.1° | 130.8° |
| C34 | N33 | H33 | 124.1° | 123.9° |
| C34 | C35 | C36 | 119.6° | 120.6° |
| C35 | C34 | C39 | 121.4° | 119.0° |
| C34 | C35 | C26 | 108.3° | 105.6° |
| C35 | C36 | C37 | 119.4° | 120.1° |
| C36 | C35 | C26 | 132.1° | 133.8° |
| C35 | C36 | H36 | 120.3° | 120.0° |
| C36 | C37 | C38 | 120.6° | 119.9° |
| C37 | C36 | H36 | 120.3° | 119.9° |
| C36 | C37 | H37 | 119.7° | 120.1° |
| C37 | C38 | C39 | 120.5° | 120.3° |
| C38 | C37 | H37 | 119.7° | 120.1° |
| C37 | C38 | H38 | 119.7° | 119.9° |
| C38 | C39 | C34 | 118.5° | 120.2° |
| C39 | C38 | H38 | 119.8° | 119.8° |
| C38 | C39 | H39 | 120.8° | 119.9° |
| C10 | N21 | H21 | 125.5° | 125.7° |
| N24 | C28 | H28 | 108.7° | 109.8° |
| C34 | C39 | H39 | 120.8° | 119.9° |
| H4B | C4 | H4A | 109.5° | 109.5° |
| H7A | C7 | H7B | 109.4° | 109.5° |
| H7A | C7 | H7C | 109.4° | 109.5° |
| H7B | C7 | H7C | 109.5° | 109.4° |
| H1B | C1 | H1A | 109.5° | 109.4° |
| H1B | C1 | H1C | 109.5° | 109.5° |
| H1A | C1 | H1C | 109.4° | 109.5° |
| H3B | C3 | H3C | 109.5° | 109.5° |
| H3B | C3 | H3A | 109.5° | 109.5° |
| H3C | C3 | H3A | 109.4° | 109.5° |
| H25A | C25 | H25B | 109.5° | 110.4° |
| H27A | C27 | H27B | 109.5° | 110.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | C4 | 122.5° | 120.0° |
| C1 | C2 | C3 | H2 | 118.5° | 120.0° |
| C1 | C2 | C4 | H2 | 118.4° | 120.0° |
| C1 | C2 | C4 | C5 | 154.0° | 68.5° |
| C1 | C2 | C4 | H4B | 85.2° | 51.4° |
| C1 | C2 | C4 | H4A | 33.1° | 171.4° |
| C2 | C1 | H1B | H1A | 120.0° | 120.0° |
| C2 | C1 | H1B | H1C | 120.0° | 120.0° |
| C2 | C1 | H1A | H1C | 120.0° | 120.0° |
| C1 | C2 | C3 | H3B | 180.0° | 60.0° |
| C1 | C2 | C3 | H3C | 60.0° | 180.0° |
| C1 | C2 | C3 | H3A | 60.0° | 60.0° |
| C3 | C2 | C4 | H2 | 119.1° | 120.0° |
| C3 | C2 | C4 | C5 | 83.5° | 171.5° |
| C3 | C2 | C4 | H4B | 37.4° | 68.6° |
| C3 | C2 | C4 | H4A | 155.6° | 51.4° |
| C3 | C2 | C1 | H1B | 180.0° | 58.3° |
| C3 | C2 | C1 | H1A | 60.0° | 178.2° |
| C3 | C2 | C1 | H1C | 60.0° | 61.7° |
| C2 | C3 | H3B | H3C | 120.0° | 119.9° |
| C2 | C3 | H3B | H3A | 120.0° | 120.0° |
| C2 | C3 | H3C | H3A | 120.0° | 120.0° |
| C2 | C4 | C5 | H4B | 120.9° | 120.0° |
| C2 | C4 | C5 | H4A | 120.9° | 120.1° |
| C2 | C4 | C5 | N6 | 56.4° | 68.6° |
| C2 | C4 | C5 | C22 | 179.6° | 171.4° |
| C2 | C4 | H4B | H4A | 117.2° | 120.1° |
| C2 | C4 | C5 | H5 | 63.0° | 51.4° |
| C4 | C2 | C1 | H1B | 56.8° | 178.3° |
| C4 | C2 | C1 | H1A | 63.2° | 61.8° |
| C4 | C2 | C1 | H1C | 176.8° | 58.3° |
| C4 | C2 | C3 | H3B | 57.6° | 60.0° |
| C4 | C2 | C3 | H3C | 177.6° | 60.0° |
| C4 | C2 | C3 | H3A | 62.5° | 180.0° |
| C4 | C5 | N6 | C22 | 123.5° | 120.0° |
| C4 | C5 | N6 | H5 | 118.8° | 120.0° |
| C4 | C5 | N6 | C7 | 65.6° | 54.1° |
| C4 | C5 | N6 | C8 | 110.9° | 125.8° |
| C4 | C5 | C22 | H5 | 116.7° | 120.0° |
| C4 | C5 | C22 | O23 | 18.8° | 101.2° |
| C4 | C5 | C22 | N24 | 158.3° | 78.8° |
| C5 | C4 | H4B | H4A | 117.2° | 119.9° |
| C5 | C4 | C2 | H2 | 35.6° | 51.5° |
| C5 | N6 | C7 | C8 | 176.3° | 179.9° |
| C5 | N6 | C8 | O9 | 3.5° | 6.4° |
| C5 | N6 | C8 | C10 | 177.3° | 173.6° |
| N6 | C5 | C22 | H5 | 118.2° | 120.0° |
| N6 | C5 | C22 | O23 | 106.3° | 18.8° |
| N6 | C5 | C22 | N24 | 76.5° | 161.2° |
| N6 | C5 | C4 | H4B | 177.3° | 51.4° |
| N6 | C5 | C4 | H4A | 64.5° | 171.4° |
| C5 | N6 | C7 | H7A | 180.0° | 96.1° |
| C5 | N6 | C7 | H7B | 60.0° | 143.9° |
| C5 | N6 | C7 | H7C | 60.0° | 24.0° |
| C7 | N6 | C8 | O9 | 179.7° | 173.6° |
| C7 | N6 | C8 | C10 | 1.0° | 6.3° |
| C7 | N6 | C5 | C22 | 57.9° | 65.9° |
| C7 | N6 | C5 | H5 | 175.5° | 174.2° |
| N6 | C7 | H7A | H7B | 120.0° | 120.0° |
| N6 | C7 | H7A | H7C | 120.0° | 120.0° |
| N6 | C7 | H7B | H7C | 120.0° | 119.9° |
| N6 | C8 | O9 | C10 | 179.3° | 180.0° |
| N6 | C8 | C10 | C11 | 6.3° | 172.5° |
| C8 | N6 | C5 | C22 | 125.6° | 114.2° |
| N6 | C8 | C10 | N21 | 175.3° | 7.2° |
| C8 | N6 | C5 | H5 | 8.0° | 5.8° |
| C8 | N6 | C7 | H7A | 3.7° | 83.9° |
| C8 | N6 | C7 | H7B | 123.7° | 36.2° |
| C8 | N6 | C7 | H7C | 116.3° | 156.1° |
| O9 | C8 | C10 | C11 | 174.5° | 7.5° |
| O9 | C8 | C10 | N21 | 4.0° | 172.8° |
| C8 | C10 | C11 | N21 | 178.6° | 179.7° |
| C8 | C10 | C11 | C12 | 179.7° | 180.0° |
| C8 | C10 | N21 | C20 | 179.6° | 179.8° |
| C8 | C10 | C11 | H11 | 0.3° | 0.0° |
| C8 | C10 | N21 | H21 | 0.4° | 0.3° |
| C10 | C11 | C12 | H11 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 178.8° | 179.6° |
| C11 | C10 | N21 | C20 | 1.5° | 0.5° |
| C10 | C11 | C12 | C20 | 1.3° | 0.0° |
| C11 | C10 | N21 | H21 | 178.4° | 180.0° |
| C11 | C12 | C13 | C20 | 179.9° | 179.5° |
| C11 | C12 | C13 | F14 | 0.4° | 0.5° |
| C11 | C12 | C13 | C15 | 179.3° | 179.6° |
| C11 | C12 | C20 | C18 | 179.7° | 179.9° |
| C11 | C12 | C20 | N21 | 0.4° | 0.3° |
| C12 | C11 | C10 | N21 | 1.7° | 0.3° |
| C12 | C13 | F14 | C15 | 179.7° | 179.9° |
| C12 | C13 | C15 | C16 | 0.4° | 0.1° |
| C13 | C12 | C20 | C18 | 0.2° | 0.4° |
| C13 | C12 | C20 | N21 | 179.7° | 180.0° |
| C12 | C13 | C15 | H15 | 179.5° | 179.9° |
| C13 | C12 | C11 | H11 | 1.2° | 0.4° |
| F14 | C13 | C15 | C16 | 179.8° | 180.0° |
| F14 | C13 | C12 | C20 | 179.7° | 180.0° |
| F14 | C13 | C15 | H15 | 0.2° | 0.0° |
| C13 | C15 | C16 | H15 | 180.0° | 180.0° |
| C13 | C15 | C16 | F17 | 179.9° | 180.0° |
| C13 | C15 | C16 | C18 | 0.1° | 0.4° |
| C15 | C13 | C12 | C20 | 0.6° | 0.1° |
| C15 | C16 | F17 | C18 | 179.8° | 179.6° |
| C15 | C16 | C18 | F19 | 179.8° | 180.0° |
| C15 | C16 | C18 | C20 | 0.4° | 0.8° |
| F17 | C16 | C18 | F19 | 0.0° | 0.4° |
| F17 | C16 | C18 | C20 | 179.8° | 179.6° |
| F17 | C16 | C15 | H15 | 0.2° | 0.0° |
| C16 | C18 | F19 | C20 | 179.8° | 179.2° |
| C16 | C18 | C20 | N21 | 179.9° | 179.7° |
| C16 | C18 | C20 | C12 | 0.3° | 0.8° |
| C18 | C16 | C15 | H15 | 180.0° | 179.6° |
| F19 | C18 | C20 | N21 | 0.1° | 0.5° |
| F19 | C18 | C20 | C12 | 180.0° | 180.0° |
| C18 | C20 | N21 | C12 | 179.8° | 179.6° |
| C18 | C20 | N21 | C10 | 179.2° | 180.0° |
| C18 | C20 | N21 | H21 | 0.8° | 0.4° |
| C20 | N21 | C10 | H21 | 180.0° | 179.5° |
| C5 | C22 | O23 | N24 | 177.1° | 180.0° |
| C5 | C22 | N24 | C25 | 6.4° | 176.3° |
| C5 | C22 | N24 | C28 | 178.0° | 3.7° |
| C22 | C5 | C4 | H4B | 58.7° | 68.6° |
| C22 | C5 | C4 | H4A | 59.5° | 51.4° |
| O23 | C22 | N24 | C25 | 176.4° | 3.7° |
| O23 | C22 | N24 | C28 | 0.9° | 176.3° |
| O23 | C22 | C5 | H5 | 135.5° | 138.8° |
| C22 | N24 | C25 | C28 | 175.9° | 180.0° |
| C22 | N24 | C25 | C26 | 151.3° | 157.3° |
| C22 | N24 | C28 | C27 | 175.5° | 179.0° |
| C22 | N24 | C28 | C29 | 60.6° | 61.5° |
| N24 | C22 | C5 | H5 | 41.7° | 41.2° |
| C22 | N24 | C28 | H28 | 60.3° | 59.4° |
| C22 | N24 | C25 | H25A | 32.4° | 83.9° |
| C22 | N24 | C25 | H25B | 89.7° | 38.5° |
| N24 | C25 | C26 | H25A | 119.0° | 118.9° |
| N24 | C25 | C26 | H25B | 119.0° | 118.8° |
| N24 | C25 | C26 | C27 | 37.5° | 35.4° |
| C25 | N24 | C28 | C27 | 0.8° | 1.0° |
| C25 | N24 | C28 | C29 | 123.2° | 118.5° |
| N24 | C25 | C26 | C31 | 156.6° | 156.0° |
| N24 | C25 | C26 | C35 | 85.8° | 85.4° |
| C25 | N24 | C28 | H28 | 116.0° | 120.6° |
| N24 | C25 | H25A | H25B | 123.0° | 122.4° |
| C25 | C26 | C27 | C31 | 118.3° | 120.8° |
| C25 | C26 | C27 | C35 | 126.3° | 120.9° |
| C25 | C26 | C27 | C28 | 37.7° | 33.9° |
| C25 | C26 | C31 | C35 | 126.7° | 122.5° |
| C25 | C26 | C31 | O32 | 52.8° | 57.3° |
| C25 | C26 | C31 | N33 | 127.1° | 122.7° |
| C25 | C26 | C35 | C34 | 123.0° | 122.6° |
| C25 | C26 | C35 | C36 | 58.0° | 57.4° |
| C26 | C25 | N24 | C28 | 24.6° | 22.7° |
| C26 | C25 | H25A | H25B | 123.0° | 122.3° |
| C25 | C26 | C27 | H27A | 157.0° | 152.3° |
| C25 | C26 | C27 | H27B | 81.6° | 84.4° |
| C26 | C27 | C28 | H27A | 119.3° | 118.3° |
| C26 | C27 | C28 | H27B | 119.3° | 118.4° |
| C26 | C27 | C28 | C29 | 148.5° | 140.3° |
| C27 | C26 | C31 | C35 | 122.0° | 122.1° |
| C27 | C26 | C31 | O32 | 58.4° | 58.1° |
| C27 | C26 | C31 | N33 | 121.6° | 121.9° |
| C27 | C26 | C35 | C34 | 120.8° | 121.8° |
| C27 | C26 | C35 | C36 | 58.1° | 58.2° |
| C26 | C27 | C28 | N24 | 24.3° | 20.9° |
| C26 | C27 | C28 | H28 | 91.4° | 98.6° |
| C27 | C26 | C25 | H25A | 156.5° | 83.5° |
| C27 | C26 | C25 | H25B | 81.4° | 154.1° |
| C26 | C27 | H27A | H27B | 122.0° | 123.3° |
| C27 | C28 | C29 | N24 | 119.2° | 117.9° |
| C27 | C28 | C29 | H28 | 119.8° | 121.2° |
| C27 | C28 | C29 | N30 | 103.6° | 119.3° |
| C28 | C27 | C26 | C31 | 156.0° | 154.7° |
| C27 | C28 | N24 | H28 | 115.2° | 119.6° |
| C28 | C27 | C26 | C35 | 88.6° | 87.0° |
| C28 | C27 | H27A | H27B | 122.0° | 123.3° |
| C27 | C28 | C29 | H29 | 76.4° | 60.7° |
| C28 | C29 | N30 | H29 | 180.0° | 180.0° |
| C29 | C28 | N24 | H28 | 120.9° | 121.0° |
| C29 | C28 | C27 | H27A | 92.2° | 101.3° |
| C29 | C28 | C27 | H27B | 29.2° | 22.0° |
| C28 | C29 | N30 | H30 | 180.0° | 180.0° |
| N30 | C29 | C28 | N24 | 137.2° | 1.4° |
| N30 | C29 | C28 | H28 | 16.2° | 119.5° |
| C26 | C31 | O32 | N33 | 179.9° | 180.0° |
| C26 | C31 | N33 | C34 | 0.1° | 0.1° |
| C31 | C26 | C35 | C34 | 0.5° | 0.2° |
| C31 | C26 | C35 | C36 | 179.5° | 179.8° |
| C31 | C26 | C25 | H25A | 84.4° | 37.1° |
| C31 | C26 | C25 | H25B | 37.6° | 85.2° |
| C31 | C26 | C27 | H27A | 84.6° | 86.9° |
| C31 | C26 | C27 | H27B | 36.7° | 36.3° |
| C26 | C31 | N33 | H33 | 179.9° | 179.9° |
| O32 | C31 | N33 | C34 | 179.8° | 179.9° |
| O32 | C31 | C26 | C35 | 179.5° | 179.8° |
| O32 | C31 | N33 | H33 | 0.2° | 0.1° |
| C31 | N33 | C34 | H33 | 180.0° | 180.0° |
| C31 | N33 | C34 | C35 | 0.2° | 0.0° |
| C31 | N33 | C34 | C39 | 179.9° | 180.0° |
| N33 | C31 | C26 | C35 | 0.4° | 0.2° |
| N33 | C34 | C35 | C39 | 179.9° | 180.0° |
| N33 | C34 | C35 | C36 | 179.6° | 179.9° |
| N33 | C34 | C39 | C38 | 179.9° | 179.9° |
| N33 | C34 | C35 | C26 | 0.5° | 0.1° |
| N33 | C34 | C39 | H39 | 0.2° | 0.0° |
| C34 | C35 | C36 | C26 | 178.8° | 180.0° |
| C34 | C35 | C36 | C37 | 0.4° | 0.2° |
| C35 | C34 | C39 | C38 | 0.2° | 0.1° |
| C35 | C34 | N33 | H33 | 179.8° | 180.0° |
| C34 | C35 | C36 | H36 | 179.6° | 179.9° |
| C35 | C34 | C39 | H39 | 179.7° | 180.0° |
| C35 | C36 | C37 | H36 | 180.0° | 179.9° |
| C35 | C36 | C37 | C38 | 0.1° | 0.1° |
| C36 | C35 | C34 | C39 | 0.5° | 0.1° |
| C35 | C36 | C37 | H37 | 179.9° | 179.9° |
| C36 | C37 | C38 | H37 | 180.0° | 179.9° |
| C36 | C37 | C38 | C39 | 0.2° | 0.0° |
| C37 | C36 | C35 | C26 | 179.3° | 179.8° |
| C36 | C37 | C38 | H38 | 179.8° | 180.0° |
| C37 | C38 | C39 | H38 | 180.0° | 179.9° |
| C37 | C38 | C39 | C34 | 0.1° | 0.1° |
| C38 | C37 | C36 | H36 | 179.9° | 180.0° |
| C37 | C38 | C39 | H39 | 179.9° | 180.0° |
| C38 | C39 | C34 | H39 | 180.0° | 179.9° |
| C39 | C38 | C37 | H37 | 179.9° | 179.9° |
| C10 | N21 | C20 | C12 | 0.7° | 0.5° |
| N21 | C10 | C11 | H11 | 178.3° | 179.7° |
| C28 | N24 | C25 | H25A | 143.5° | 96.1° |
| C28 | N24 | C25 | H25B | 94.4° | 141.5° |
| N24 | C28 | C27 | H27A | 143.6° | 139.3° |
| N24 | C28 | C27 | H27B | 95.0° | 97.4° |
| N24 | C28 | C29 | H29 | 42.8° | 178.6° |
| C39 | C34 | C35 | C26 | 179.6° | 179.9° |
| C39 | C34 | N33 | H33 | 0.1° | 0.0° |
| C34 | C39 | C38 | H38 | 179.9° | 179.9° |
| C20 | C12 | C11 | H11 | 178.7° | 180.0° |
| C12 | C20 | N21 | H21 | 179.3° | 180.0° |
| C35 | C26 | C25 | H25A | 33.2° | 155.7° |
| C35 | C26 | C25 | H25B | 155.3° | 33.4° |
| C35 | C26 | C27 | H27A | 30.7° | 31.4° |
| C35 | C26 | C27 | H27B | 152.1° | 154.6° |
| C26 | C35 | C36 | H36 | 0.7° | 0.1° |
| H4B | C4 | C5 | H5 | 57.9° | 171.4° |
| H4B | C4 | C2 | H2 | 156.5° | 171.4° |
| H4A | C4 | C5 | H5 | 176.2° | 68.6° |
| H4A | C4 | C2 | H2 | 85.3° | 68.5° |
| H7A | C7 | H7B | H7C | 119.9° | 120.0° |
| H28 | C28 | C27 | H27A | 27.9° | 19.8° |
| H28 | C28 | C27 | H27B | 149.3° | 143.1° |
| H28 | C28 | C29 | H29 | 163.8° | 60.5° |
| H1B | C1 | H1A | H1C | 120.0° | 120.0° |
| H1B | C1 | C2 | H2 | 61.5° | 61.7° |
| H1A | C1 | C2 | H2 | 178.5° | 58.2° |
| H1C | C1 | C2 | H2 | 58.5° | 178.3° |
| H2 | C2 | C3 | H3B | 61.5° | 180.0° |
| H2 | C2 | C3 | H3C | 58.6° | 60.0° |
| H2 | C2 | C3 | H3A | 178.5° | 60.0° |
| H3B | C3 | H3C | H3A | 120.0° | 120.0° |
| H29 | C29 | N30 | H30 | 0.0° | 0.0° |
| H36 | C36 | C37 | H37 | 0.1° | 0.1° |
| H37 | C37 | C38 | H38 | 0.2° | 0.0° |
| H38 | C38 | C39 | H39 | 0.1° | 0.0° |
