A1JN0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C2 | C32 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C32 | C31 | doub | 1.38Å | 1.38Å | Aromatic |
| C5 | C31 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.48Å | 1.47Å | |
| C7 | C6 | doub | 1.36Å | 1.37Å | Aromatic |
| C7 | N8 | sing | 1.39Å | 1.36Å | Aromatic |
| C6 | N30 | sing | 1.35Å | 1.39Å | Aromatic |
| N8 | N29 | sing | 1.39Å | 1.36Å | Aromatic |
| N8 | C9 | sing | 1.36Å | 1.36Å | Aromatic |
| N30 | C9 | doub | 1.31Å | 1.31Å | Aromatic |
| N29 | C11 | doub | 1.29Å | 1.33Å | Aromatic |
| C9 | S10 | sing | 1.77Å | 1.75Å | Aromatic |
| C11 | S10 | sing | 1.77Å | 1.76Å | Aromatic |
| C11 | N12 | sing | 1.38Å | 1.34Å | |
| C28 | N12 | sing | 1.47Å | 1.46Å | |
| C28 | C27 | sing | 1.53Å | 1.52Å | |
| N12 | C13 | sing | 1.47Å | 1.47Å | |
| C27 | C15 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C15 | C14 | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.51Å | 1.51Å | |
| C23 | C22 | sing | 1.53Å | 1.50Å | |
| O26 | C16 | doub | 1.21Å | 1.23Å | |
| C16 | N17 | sing | 1.35Å | 1.33Å | |
| C22 | N21 | sing | 1.47Å | 1.50Å | |
| N21 | C24 | sing | 1.47Å | 1.51Å | |
| N21 | C20 | sing | 1.47Å | 1.51Å | |
| C25 | C24 | sing | 1.53Å | 1.51Å | |
| N17 | C18 | sing | 1.47Å | 1.46Å | |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| C19 | C20 | sing | 1.53Å | 1.52Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C1 | H1C | sing | 1.09Å | 1.10Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C14 | H14B | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C18 | H18B | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| C20 | H20A | sing | 1.09Å | 1.10Å | |
| C20 | H20B | sing | 1.09Å | 1.10Å | |
| C22 | H22B | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | H23B | sing | 1.09Å | 1.10Å | |
| C23 | H23C | sing | 1.09Å | 1.10Å | |
| C23 | H23A | sing | 1.09Å | 1.10Å | |
| C24 | H24B | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C25 | H25B | sing | 1.09Å | 1.10Å | |
| C25 | H25C | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C27 | H27B | sing | 1.09Å | 1.10Å | |
| C28 | H28B | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C32 | H32 | sing | 1.08Å | 1.08Å | |
| N17 | H17 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 121.0° | 119.9° |
| C1 | C2 | C32 | 121.1° | 119.8° |
| C2 | C1 | H1C | 109.5° | 109.5° |
| C2 | C1 | H1B | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.5° | 109.4° |
| C2 | C3 | C4 | 121.3° | 120.1° |
| C3 | C2 | C32 | 117.9° | 120.2° |
| C2 | C3 | H3 | 119.3° | 120.0° |
| C3 | C4 | C5 | 120.6° | 119.9° |
| C4 | C3 | H3 | 119.4° | 119.9° |
| C3 | C4 | H4 | 119.7° | 120.0° |
| C2 | C32 | C31 | 121.3° | 120.1° |
| C2 | C32 | H32 | 119.3° | 119.9° |
| C4 | C5 | C31 | 118.4° | 119.7° |
| C4 | C5 | C6 | 120.8° | 120.1° |
| C5 | C4 | H4 | 119.7° | 120.1° |
| C32 | C31 | C5 | 120.5° | 119.9° |
| C32 | C31 | H31 | 119.7° | 120.1° |
| C31 | C32 | H32 | 119.3° | 120.0° |
| C31 | C5 | C6 | 120.9° | 120.2° |
| C5 | C31 | H31 | 119.8° | 120.0° |
| C5 | C6 | C7 | 129.2° | 126.0° |
| C5 | C6 | N30 | 120.1° | 125.9° |
| C6 | C7 | N8 | 105.0° | 107.4° |
| C7 | C6 | N30 | 110.8° | 108.0° |
| C6 | C7 | H7 | 127.5° | 126.3° |
| C7 | N8 | N29 | 134.1° | 139.0° |
| C7 | N8 | C9 | 107.7° | 105.9° |
| N8 | C7 | H7 | 127.5° | 126.3° |
| C6 | N30 | C9 | 104.1° | 108.8° |
| N29 | N8 | C9 | 118.2° | 115.1° |
| N8 | N29 | C11 | 109.2° | 119.2° |
| N8 | C9 | N30 | 112.5° | 109.9° |
| N8 | C9 | S10 | 109.0° | 105.6° |
| N30 | C9 | S10 | 138.5° | 144.6° |
| N29 | C11 | S10 | 115.2° | 105.9° |
| N29 | C11 | N12 | 123.3° | 127.1° |
| C9 | S10 | C11 | 88.4° | 94.4° |
| S10 | C11 | N12 | 121.5° | 127.1° |
| C11 | N12 | C28 | 121.1° | 120.6° |
| C11 | N12 | C13 | 125.6° | 120.7° |
| N12 | C28 | C27 | 110.5° | 108.8° |
| C28 | N12 | C13 | 113.3° | 118.7° |
| N12 | C28 | H28B | 109.2° | 109.6° |
| N12 | C28 | H28A | 109.2° | 109.6° |
| C28 | C27 | C15 | 109.9° | 109.3° |
| C28 | C27 | H27A | 109.4° | 109.5° |
| C28 | C27 | H27B | 109.4° | 109.6° |
| C27 | C28 | H28B | 109.2° | 109.6° |
| C27 | C28 | H28A | 109.2° | 109.5° |
| N12 | C13 | C14 | 111.0° | 108.8° |
| N12 | C13 | H13B | 109.1° | 109.6° |
| N12 | C13 | H13A | 109.1° | 109.7° |
| C27 | C15 | C14 | 110.1° | 109.5° |
| C27 | C15 | C16 | 111.1° | 109.5° |
| C27 | C15 | H15 | 107.6° | 109.4° |
| C15 | C27 | H27A | 109.4° | 109.5° |
| C15 | C27 | H27B | 109.4° | 109.5° |
| C13 | C14 | C15 | 110.9° | 109.3° |
| C13 | C14 | H14B | 109.1° | 109.5° |
| C13 | C14 | H14A | 109.1° | 109.6° |
| C14 | C13 | H13B | 109.1° | 109.6° |
| C14 | C13 | H13A | 109.1° | 109.5° |
| C14 | C15 | C16 | 112.4° | 109.5° |
| C15 | C14 | H14B | 109.1° | 109.5° |
| C15 | C14 | H14A | 109.1° | 109.4° |
| C14 | C15 | H15 | 107.6° | 109.5° |
| C15 | C16 | O26 | 121.7° | 120.0° |
| C15 | C16 | N17 | 115.7° | 120.0° |
| C16 | C15 | H15 | 107.9° | 109.4° |
| C23 | C22 | N21 | 112.2° | 109.5° |
| C23 | C22 | H22B | 108.8° | 109.5° |
| C23 | C22 | H22A | 108.8° | 109.5° |
| C22 | C23 | H23B | 109.5° | 109.5° |
| C22 | C23 | H23C | 109.5° | 109.5° |
| C22 | C23 | H23A | 109.5° | 109.5° |
| O26 | C16 | N17 | 122.6° | 120.0° |
| C16 | N17 | C18 | 122.7° | 120.0° |
| C16 | N17 | H17 | 118.6° | 120.0° |
| C22 | N21 | C24 | 113.7° | 111.0° |
| C22 | N21 | C20 | 112.4° | 111.0° |
| N21 | C22 | H22B | 108.8° | 109.5° |
| N21 | C22 | H22A | 108.8° | 109.4° |
| C24 | N21 | C20 | 114.3° | 111.0° |
| N21 | C24 | C25 | 113.6° | 109.5° |
| N21 | C24 | H24B | 108.4° | 109.5° |
| N21 | C24 | H24A | 108.4° | 109.4° |
| N21 | C20 | C19 | 113.2° | 109.5° |
| N21 | C20 | H20A | 108.5° | 109.5° |
| N21 | C20 | H20B | 108.5° | 109.5° |
| C25 | C24 | H24B | 108.5° | 109.5° |
| C25 | C24 | H24A | 108.4° | 109.5° |
| C24 | C25 | H25B | 109.5° | 109.4° |
| C24 | C25 | H25C | 109.4° | 109.4° |
| C24 | C25 | H25A | 109.5° | 109.5° |
| N17 | C18 | C19 | 112.4° | 109.5° |
| N17 | C18 | H18B | 108.8° | 109.4° |
| N17 | C18 | H18A | 108.7° | 109.4° |
| C18 | N17 | H17 | 118.6° | 120.0° |
| C18 | C19 | C20 | 115.1° | 109.5° |
| C19 | C18 | H18B | 108.8° | 109.5° |
| C19 | C18 | H18A | 108.7° | 109.5° |
| C18 | C19 | H19A | 108.0° | 109.5° |
| C18 | C19 | H19B | 108.0° | 109.5° |
| C20 | C19 | H19A | 108.0° | 109.5° |
| C20 | C19 | H19B | 108.0° | 109.5° |
| C19 | C20 | H20A | 108.5° | 109.5° |
| C19 | C20 | H20B | 108.5° | 109.5° |
| H1C | C1 | H1B | 109.5° | 109.5° |
| H1C | C1 | H1A | 109.5° | 109.5° |
| H1B | C1 | H1A | 109.5° | 109.4° |
| H14B | C14 | H14A | 109.5° | 109.5° |
| H13B | C13 | H13A | 109.5° | 109.5° |
| H18B | C18 | H18A | 109.5° | 109.5° |
| H19A | C19 | H19B | 109.5° | 109.4° |
| H20A | C20 | H20B | 109.5° | 109.5° |
| H22B | C22 | H22A | 109.5° | 109.5° |
| H23B | C23 | H23C | 109.4° | 109.4° |
| H23B | C23 | H23A | 109.5° | 109.4° |
| H23C | C23 | H23A | 109.5° | 109.5° |
| H24B | C24 | H24A | 109.5° | 109.5° |
| H25B | C25 | H25C | 109.5° | 109.5° |
| H25B | C25 | H25A | 109.5° | 109.5° |
| H25C | C25 | H25A | 109.5° | 109.5° |
| H27A | C27 | H27B | 109.5° | 109.4° |
| H28B | C28 | H28A | 109.4° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | C32 | 179.3° | 179.1° |
| C1 | C2 | C3 | C4 | 179.3° | 179.9° |
| C1 | C2 | C32 | C31 | 179.3° | 179.7° |
| C1 | C2 | C3 | H3 | 0.7° | 1.0° |
| C2 | C1 | H1C | H1B | 120.0° | 120.0° |
| C2 | C1 | H1C | H1A | 120.0° | 120.0° |
| C2 | C1 | H1B | H1A | 120.0° | 119.9° |
| C1 | C2 | C32 | H32 | 0.7° | 0.9° |
| C2 | C3 | C4 | H3 | 180.0° | 179.1° |
| C2 | C3 | C4 | C5 | 0.0° | 0.5° |
| C3 | C2 | C32 | C31 | 0.0° | 0.6° |
| C3 | C2 | C1 | H1C | 89.6° | 90.0° |
| C3 | C2 | C1 | H1B | 150.4° | 150.0° |
| C3 | C2 | C1 | H1A | 30.4° | 30.1° |
| C2 | C3 | C4 | H4 | 180.0° | 179.4° |
| C3 | C2 | C32 | H32 | 180.0° | 180.0° |
| C4 | C3 | C2 | C32 | 0.0° | 0.9° |
| C3 | C4 | C5 | H4 | 180.0° | 179.9° |
| C3 | C4 | C5 | C31 | 0.1° | 0.0° |
| C3 | C4 | C5 | C6 | 178.7° | 179.7° |
| C2 | C32 | C31 | H32 | 180.0° | 179.4° |
| C2 | C32 | C31 | C5 | 0.0° | 0.1° |
| C32 | C2 | C3 | H3 | 180.0° | 180.0° |
| C32 | C2 | C1 | H1C | 89.7° | 89.1° |
| C32 | C2 | C1 | H1B | 30.4° | 30.9° |
| C32 | C2 | C1 | H1A | 150.3° | 150.8° |
| C2 | C32 | C31 | H31 | 180.0° | 180.0° |
| C4 | C5 | C31 | C32 | 0.0° | 0.3° |
| C4 | C5 | C31 | C6 | 178.8° | 179.7° |
| C4 | C5 | C6 | C7 | 1.4° | 0.6° |
| C4 | C5 | C6 | N30 | 177.2° | 179.7° |
| C5 | C4 | C3 | H3 | 180.0° | 179.6° |
| C4 | C5 | C31 | H31 | 180.0° | 179.6° |
| C32 | C31 | C5 | H31 | 180.0° | 179.9° |
| C32 | C31 | C5 | C6 | 178.7° | 180.0° |
| C31 | C5 | C6 | C7 | 179.8° | 179.7° |
| C31 | C5 | C6 | N30 | 1.6° | 0.1° |
| C31 | C5 | C4 | H4 | 179.9° | 179.9° |
| C5 | C31 | C32 | H32 | 180.0° | 179.5° |
| C5 | C6 | C7 | N30 | 178.7° | 179.7° |
| C5 | C6 | C7 | N8 | 178.7° | 180.0° |
| C5 | C6 | N30 | C9 | 178.8° | 180.0° |
| C6 | C5 | C4 | H4 | 1.3° | 0.4° |
| C5 | C6 | C7 | H7 | 1.3° | 0.1° |
| C6 | C5 | C31 | H31 | 1.3° | 0.1° |
| C6 | C7 | N8 | H7 | 180.0° | 179.9° |
| C6 | C7 | N8 | N29 | 179.7° | 179.9° |
| C6 | C7 | N8 | C9 | 0.0° | 0.1° |
| C7 | C6 | N30 | C9 | 0.0° | 0.3° |
| N8 | C7 | C6 | N30 | 0.0° | 0.3° |
| C7 | N8 | N29 | C9 | 179.7° | 179.9° |
| C7 | N8 | C9 | N30 | 0.0° | 0.0° |
| C7 | N8 | N29 | C11 | 179.7° | 179.9° |
| C7 | N8 | C9 | S10 | 179.8° | 179.9° |
| C6 | N30 | C9 | N8 | 0.0° | 0.2° |
| C6 | N30 | C9 | S10 | 179.6° | 180.0° |
| N30 | C6 | C7 | H7 | 180.0° | 179.8° |
| N29 | N8 | C9 | N30 | 179.8° | 179.9° |
| N29 | N8 | C9 | S10 | 0.0° | 0.0° |
| N8 | N29 | C11 | S10 | 0.0° | 0.2° |
| N8 | N29 | C11 | N12 | 178.4° | 179.9° |
| N29 | N8 | C7 | H7 | 0.3° | 0.0° |
| N8 | C9 | N30 | S10 | 179.6° | 179.8° |
| C9 | N8 | N29 | C11 | 0.0° | 0.2° |
| N8 | C9 | S10 | C11 | 0.0° | 0.1° |
| C9 | N8 | C7 | H7 | 180.0° | 179.9° |
| N30 | C9 | S10 | C11 | 179.7° | 179.9° |
| N29 | C11 | S10 | C9 | 0.0° | 0.2° |
| N29 | C11 | S10 | N12 | 178.4° | 179.8° |
| N29 | C11 | N12 | C28 | 25.5° | 179.8° |
| N29 | C11 | N12 | C13 | 153.9° | 0.2° |
| C9 | S10 | C11 | N12 | 178.4° | 180.0° |
| S10 | C11 | N12 | C28 | 156.2° | 0.0° |
| S10 | C11 | N12 | C13 | 24.4° | 180.0° |
| C11 | N12 | C28 | C13 | 179.4° | 180.0° |
| C11 | N12 | C28 | C27 | 138.5° | 126.4° |
| C11 | N12 | C13 | C14 | 158.7° | 126.4° |
| C11 | N12 | C13 | H13B | 81.1° | 113.8° |
| C11 | N12 | C13 | H13A | 38.5° | 6.5° |
| C11 | N12 | C28 | H28B | 101.4° | 6.5° |
| C11 | N12 | C28 | H28A | 18.3° | 113.8° |
| N12 | C28 | C27 | H28B | 120.2° | 119.8° |
| N12 | C28 | C27 | H28A | 120.2° | 119.8° |
| N12 | C28 | C27 | C15 | 67.0° | 54.6° |
| C28 | N12 | C13 | C14 | 21.9° | 53.6° |
| C28 | N12 | C13 | H13B | 98.4° | 66.2° |
| C28 | N12 | C13 | H13A | 142.1° | 173.4° |
| N12 | C28 | C27 | H27A | 172.9° | 65.4° |
| N12 | C28 | C27 | H27B | 53.1° | 174.6° |
| N12 | C28 | H28B | H28A | 119.6° | 120.4° |
| C27 | C28 | N12 | C13 | 40.9° | 53.6° |
| C28 | C27 | C15 | H27A | 120.1° | 120.0° |
| C28 | C27 | C15 | H27B | 120.1° | 120.1° |
| C28 | C27 | C15 | C14 | 24.7° | 61.3° |
| C28 | C27 | C15 | C16 | 149.8° | 178.6° |
| C28 | C27 | C15 | H15 | 92.3° | 58.7° |
| C28 | C27 | H27A | H27B | 119.8° | 120.1° |
| C27 | C28 | H28B | H28A | 119.5° | 120.3° |
| N12 | C13 | C14 | H13B | 120.2° | 119.9° |
| N12 | C13 | C14 | H13A | 120.2° | 120.0° |
| N12 | C13 | C14 | C15 | 63.2° | 54.7° |
| N12 | C13 | C14 | H14B | 176.6° | 65.3° |
| N12 | C13 | C14 | H14A | 57.0° | 174.6° |
| N12 | C13 | H13B | H13A | 119.3° | 120.5° |
| C13 | N12 | C28 | H28B | 79.2° | 173.4° |
| C13 | N12 | C28 | H28A | 161.1° | 66.2° |
| C27 | C15 | C14 | C13 | 36.1° | 61.3° |
| C27 | C15 | C14 | C16 | 124.4° | 120.1° |
| C27 | C15 | C14 | H15 | 117.0° | 120.0° |
| C27 | C15 | C16 | H15 | 117.7° | 119.9° |
| C27 | C15 | C16 | O26 | 66.6° | 120.1° |
| C27 | C15 | C16 | N17 | 113.0° | 59.9° |
| C27 | C15 | C14 | H14B | 156.4° | 58.6° |
| C27 | C15 | C14 | H14A | 84.1° | 178.7° |
| C15 | C27 | H27A | H27B | 119.8° | 120.0° |
| C15 | C27 | C28 | H28B | 53.2° | 174.4° |
| C15 | C27 | C28 | H28A | 172.8° | 65.2° |
| C13 | C14 | C15 | H14B | 120.2° | 120.0° |
| C13 | C14 | C15 | H14A | 120.2° | 120.0° |
| C13 | C14 | C15 | C16 | 88.3° | 178.6° |
| C13 | C14 | H14B | H14A | 119.4° | 120.2° |
| C14 | C13 | H13B | H13A | 119.3° | 120.2° |
| C13 | C14 | C15 | H15 | 153.1° | 58.6° |
| C14 | C15 | C16 | H15 | 118.4° | 120.0° |
| C14 | C15 | C16 | O26 | 57.2° | 0.0° |
| C14 | C15 | C16 | N17 | 123.2° | 179.9° |
| C15 | C14 | H14B | H14A | 119.3° | 120.0° |
| C15 | C14 | C13 | H13B | 57.0° | 65.2° |
| C15 | C14 | C13 | H13A | 176.5° | 174.6° |
| C14 | C15 | C27 | H27A | 144.8° | 58.6° |
| C14 | C15 | C27 | H27B | 95.4° | 178.6° |
| C15 | C16 | O26 | N17 | 179.6° | 179.9° |
| C15 | C16 | N17 | C18 | 178.7° | 180.0° |
| C16 | C15 | C14 | H14B | 32.0° | 61.4° |
| C16 | C15 | C14 | H14A | 151.5° | 58.6° |
| C16 | C15 | C27 | H27A | 90.1° | 61.4° |
| C16 | C15 | C27 | H27B | 29.8° | 58.6° |
| C15 | C16 | N17 | H17 | 1.3° | 0.1° |
| C23 | C22 | N21 | H22B | 120.4° | 120.0° |
| C23 | C22 | N21 | H22A | 120.4° | 120.0° |
| C23 | C22 | N21 | C24 | 178.3° | 164.1° |
| C23 | C22 | N21 | C20 | 49.9° | 72.0° |
| C23 | C22 | H22B | H22A | 118.8° | 120.0° |
| C22 | C23 | H23B | H23C | 120.0° | 120.0° |
| C22 | C23 | H23B | H23A | 120.0° | 120.0° |
| C22 | C23 | H23C | H23A | 120.0° | 120.0° |
| O26 | C16 | N17 | C18 | 0.9° | 0.1° |
| O26 | C16 | C15 | H15 | 175.7° | 120.0° |
| O26 | C16 | N17 | H17 | 179.1° | 180.0° |
| C16 | N17 | C18 | H17 | 180.0° | 179.9° |
| C16 | N17 | C18 | C19 | 138.4° | 179.9° |
| C16 | N17 | C18 | H18B | 17.9° | 60.0° |
| C16 | N17 | C18 | H18A | 101.2° | 60.0° |
| N17 | C16 | C15 | H15 | 4.7° | 60.0° |
| C22 | N21 | C24 | C20 | 130.9° | 124.0° |
| C22 | N21 | C24 | C25 | 168.8° | 75.5° |
| C22 | N21 | C20 | C19 | 100.1° | 170.0° |
| C22 | N21 | C20 | H20A | 139.4° | 50.0° |
| C22 | N21 | C20 | H20B | 20.5° | 70.0° |
| N21 | C22 | H22B | H22A | 118.8° | 120.0° |
| N21 | C22 | C23 | H23B | 180.0° | 174.8° |
| N21 | C22 | C23 | H23C | 60.0° | 54.8° |
| N21 | C22 | C23 | H23A | 60.0° | 65.3° |
| C22 | N21 | C24 | H24B | 48.2° | 164.5° |
| C22 | N21 | C24 | H24A | 70.6° | 44.5° |
| N21 | C24 | C25 | H24B | 120.6° | 120.0° |
| N21 | C24 | C25 | H24A | 120.6° | 119.9° |
| C24 | N21 | C20 | C19 | 128.4° | 66.0° |
| C24 | N21 | C20 | H20A | 7.9° | 174.0° |
| C24 | N21 | C20 | H20B | 111.0° | 54.0° |
| C24 | N21 | C22 | H22B | 57.9° | 44.1° |
| C24 | N21 | C22 | H22A | 61.3° | 76.0° |
| N21 | C24 | H24B | H24A | 118.1° | 120.0° |
| N21 | C24 | C25 | H25B | 180.0° | 174.9° |
| N21 | C24 | C25 | H25C | 60.0° | 54.9° |
| N21 | C24 | C25 | H25A | 60.0° | 65.1° |
| C20 | N21 | C24 | C25 | 60.3° | 160.5° |
| N21 | C20 | C19 | C18 | 115.8° | 180.0° |
| N21 | C20 | C19 | H20A | 120.6° | 120.0° |
| N21 | C20 | C19 | H20B | 120.5° | 120.0° |
| N21 | C20 | C19 | H19A | 123.4° | 60.0° |
| N21 | C20 | C19 | H19B | 5.1° | 60.0° |
| N21 | C20 | H20A | H20B | 118.3° | 120.0° |
| C20 | N21 | C22 | H22B | 170.3° | 168.1° |
| C20 | N21 | C22 | H22A | 70.5° | 48.0° |
| C20 | N21 | C24 | H24B | 179.1° | 40.5° |
| C20 | N21 | C24 | H24A | 60.3° | 79.5° |
| C25 | C24 | H24B | H24A | 118.1° | 120.0° |
| C24 | C25 | H25B | H25C | 120.0° | 120.0° |
| C24 | C25 | H25B | H25A | 120.0° | 120.0° |
| C24 | C25 | H25C | H25A | 120.0° | 120.0° |
| N17 | C18 | C19 | H18B | 120.5° | 120.0° |
| N17 | C18 | C19 | H18A | 120.4° | 120.0° |
| N17 | C18 | C19 | C20 | 175.3° | 180.0° |
| N17 | C18 | H18B | H18A | 118.7° | 120.0° |
| N17 | C18 | C19 | H19A | 63.9° | 60.0° |
| N17 | C18 | C19 | H19B | 54.5° | 60.0° |
| C18 | C19 | C20 | H19A | 120.8° | 120.0° |
| C18 | C19 | C20 | H19B | 120.8° | 120.0° |
| C19 | C18 | H18B | H18A | 118.7° | 120.0° |
| C18 | C19 | H19A | H19B | 117.4° | 120.0° |
| C18 | C19 | C20 | H20A | 123.7° | 60.0° |
| C18 | C19 | C20 | H20B | 4.8° | 60.0° |
| C19 | C18 | N17 | H17 | 41.6° | 0.0° |
| C20 | C19 | C18 | H18B | 54.8° | 60.1° |
| C20 | C19 | C18 | H18A | 64.3° | 60.0° |
| C20 | C19 | H19A | H19B | 117.4° | 120.0° |
| C19 | C20 | H20A | H20B | 118.3° | 120.0° |
| H3 | C3 | C4 | H4 | 0.0° | 0.3° |
| H1C | C1 | H1B | H1A | 120.0° | 120.0° |
| H14B | C14 | C13 | H13B | 63.2° | 174.9° |
| H14B | C14 | C13 | H13A | 56.3° | 54.7° |
| H14B | C14 | C15 | H15 | 86.6° | 178.6° |
| H14A | C14 | C13 | H13B | 177.2° | 54.7° |
| H14A | C14 | C13 | H13A | 63.3° | 65.5° |
| H14A | C14 | C15 | H15 | 32.9° | 61.4° |
| H18B | C18 | C19 | H19A | 175.6° | 60.0° |
| H18B | C18 | C19 | H19B | 66.0° | 180.0° |
| H18B | C18 | N17 | H17 | 162.1° | 120.0° |
| H18A | C18 | C19 | H19A | 56.5° | 180.0° |
| H18A | C18 | C19 | H19B | 174.9° | 60.0° |
| H18A | C18 | N17 | H17 | 78.8° | 120.1° |
| H15 | C15 | C27 | H27A | 27.8° | 178.7° |
| H15 | C15 | C27 | H27B | 147.7° | 61.4° |
| H19A | C19 | C20 | H20A | 2.9° | 180.0° |
| H19A | C19 | C20 | H20B | 116.1° | 60.0° |
| H19B | C19 | C20 | H20A | 115.5° | 60.0° |
| H19B | C19 | C20 | H20B | 125.6° | 180.0° |
| H22B | C22 | C23 | H23B | 59.6° | 54.8° |
| H22B | C22 | C23 | H23C | 60.4° | 65.2° |
| H22B | C22 | C23 | H23A | 179.6° | 174.8° |
| H22A | C22 | C23 | H23B | 59.6° | 65.3° |
| H22A | C22 | C23 | H23C | 179.6° | 174.8° |
| H22A | C22 | C23 | H23A | 60.4° | 54.7° |
| H23B | C23 | H23C | H23A | 120.0° | 119.9° |
| H24B | C24 | C25 | H25B | 59.4° | 54.9° |
| H24B | C24 | C25 | H25C | 179.4° | 65.1° |
| H24B | C24 | C25 | H25A | 60.6° | 174.9° |
| H24A | C24 | C25 | H25B | 59.4° | 65.2° |
| H24A | C24 | C25 | H25C | 60.6° | 174.8° |
| H24A | C24 | C25 | H25A | 179.4° | 54.8° |
| H25B | C25 | H25C | H25A | 120.0° | 120.1° |
| H27A | C27 | C28 | H28B | 66.9° | 54.5° |
| H27A | C27 | C28 | H28A | 52.8° | 174.8° |
| H27B | C27 | C28 | H28B | 173.2° | 65.5° |
| H27B | C27 | C28 | H28A | 67.1° | 54.8° |
| H31 | C31 | C32 | H32 | 0.0° | 0.6° |
