NQB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C1 | N5 | sing | 1.47Å | 1.52Å | |
| C2 | N3 | sing | 1.47Å | 1.49Å | |
| C8 | N3 | sing | 1.47Å | 1.46Å | |
| C9 | C10 | sing | 1.38Å | 1.42Å | Aromatic |
| C9 | C25 | doub | 1.39Å | 1.42Å | Aromatic |
| C10 | C11 | doub | 1.39Å | 1.41Å | Aromatic |
| C10 | N5 | sing | 1.40Å | 1.44Å | |
| C11 | C12 | sing | 1.37Å | 1.40Å | Aromatic |
| C12 | C26 | doub | 1.40Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.40Å | 1.41Å | Aromatic |
| C14 | C13 | doub | 1.39Å | 1.40Å | Aromatic |
| C15 | C16 | doub | 1.40Å | 1.42Å | Aromatic |
| C15 | C19 | sing | 1.48Å | 1.50Å | |
| C16 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | O24 | doub | 1.22Å | 1.20Å | |
| C19 | N32 | sing | 1.35Å | 1.38Å | |
| C20 | C21 | sing | 1.53Å | 1.51Å | |
| C20 | C22 | sing | 1.53Å | 1.48Å | |
| C20 | N32 | sing | 1.46Å | 1.44Å | |
| C21 | C22 | sing | 1.53Å | 1.51Å | |
| N29 | C30 | sing | 1.35Å | 1.39Å | |
| N29 | C13 | sing | 1.40Å | 1.42Å | |
| N29 | C28 | sing | 1.36Å | 1.38Å | |
| C30 | C25 | sing | 1.47Å | 1.49Å | |
| C30 | O29 | doub | 1.22Å | 1.20Å | |
| N3 | C4 | sing | 1.47Å | 1.47Å | |
| C4 | C5 | sing | 1.53Å | 1.57Å | |
| C5 | N5 | sing | 1.47Å | 1.50Å | |
| C17 | C18 | doub | 1.38Å | 1.41Å | Aromatic |
| C18 | C23 | sing | 1.51Å | 1.50Å | |
| C18 | C13 | sing | 1.39Å | 1.41Å | Aromatic |
| C25 | C26 | sing | 1.41Å | 1.42Å | Aromatic |
| C26 | N27 | sing | 1.36Å | 1.38Å | |
| N27 | C28 | doub | 1.30Å | 1.29Å | |
| C1 | H11C | sing | 1.09Å | 1.10Å | |
| C1 | H12C | sing | 1.09Å | 1.10Å | |
| C2 | H21C | sing | 1.09Å | 1.10Å | |
| C2 | H22C | sing | 1.09Å | 1.10Å | |
| C8 | H81C | sing | 1.09Å | 1.10Å | |
| C8 | H82C | sing | 1.09Å | 1.10Å | |
| C8 | H83C | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| N32 | H32 | sing | 0.97Å | 1.00Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H211 | sing | 1.09Å | 1.10Å | |
| C21 | H212 | sing | 1.09Å | 1.10Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C4 | H41C | sing | 1.09Å | 1.10Å | |
| C4 | H42C | sing | 1.09Å | 1.10Å | |
| C5 | H51C | sing | 1.09Å | 1.10Å | |
| C5 | H52C | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H233 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | N5 | 115.5° | 109.4° |
| C1 | C2 | N3 | 112.0° | 109.4° |
| C2 | C1 | H11C | 107.9° | 109.5° |
| C2 | C1 | H12C | 108.0° | 109.5° |
| C1 | C2 | H21C | 108.8° | 109.5° |
| C1 | C2 | H22C | 108.9° | 109.5° |
| C1 | N5 | C10 | 117.1° | 111.0° |
| C1 | N5 | C5 | 118.7° | 110.9° |
| N5 | C1 | H11C | 108.0° | 109.5° |
| N5 | C1 | H12C | 108.0° | 109.4° |
| C2 | N3 | C8 | 114.7° | 111.0° |
| C2 | N3 | C4 | 109.1° | 110.9° |
| N3 | C2 | H21C | 108.8° | 109.5° |
| N3 | C2 | H22C | 108.8° | 109.5° |
| C8 | N3 | C4 | 111.0° | 111.0° |
| N3 | C8 | H81C | 109.5° | 109.5° |
| N3 | C8 | H82C | 109.5° | 109.5° |
| N3 | C8 | H83C | 109.5° | 109.5° |
| C10 | C9 | C25 | 120.6° | 119.3° |
| C9 | C10 | C11 | 116.5° | 120.4° |
| C9 | C10 | N5 | 122.5° | 119.8° |
| C10 | C9 | H9 | 119.7° | 120.3° |
| C9 | C25 | C30 | 122.7° | 121.9° |
| C9 | C25 | C26 | 120.8° | 120.0° |
| C25 | C9 | H9 | 119.7° | 120.4° |
| C11 | C10 | N5 | 121.0° | 119.8° |
| C10 | C11 | C12 | 123.4° | 120.9° |
| C10 | C11 | H11 | 118.3° | 119.6° |
| C10 | N5 | C5 | 121.2° | 111.0° |
| C11 | C12 | C26 | 119.6° | 119.9° |
| C12 | C11 | H11 | 118.3° | 119.5° |
| C11 | C12 | H12 | 120.2° | 120.1° |
| C12 | C26 | C25 | 119.0° | 119.4° |
| C12 | C26 | N27 | 116.9° | 121.6° |
| C26 | C12 | H12 | 120.2° | 120.0° |
| C15 | C14 | C13 | 120.2° | 119.7° |
| C14 | C15 | C16 | 119.4° | 119.8° |
| C14 | C15 | C19 | 115.9° | 120.1° |
| C15 | C14 | H14 | 119.9° | 120.1° |
| C14 | C13 | N29 | 121.7° | 120.0° |
| C14 | C13 | C18 | 120.7° | 120.0° |
| C13 | C14 | H14 | 119.9° | 120.2° |
| C16 | C15 | C19 | 124.6° | 120.1° |
| C15 | C16 | C17 | 119.5° | 119.9° |
| C15 | C16 | H16 | 120.3° | 120.0° |
| C15 | C19 | O24 | 115.8° | 120.0° |
| C15 | C19 | N32 | 121.2° | 120.0° |
| C16 | C17 | C18 | 121.6° | 120.3° |
| C17 | C16 | H16 | 120.3° | 120.1° |
| C16 | C17 | H17 | 119.2° | 119.9° |
| O24 | C19 | N32 | 123.0° | 120.0° |
| C19 | N32 | C20 | 127.3° | 120.0° |
| C19 | N32 | H32 | 116.3° | 120.0° |
| C21 | C20 | C22 | 60.5° | 60.0° |
| C21 | C20 | N32 | 119.2° | 117.5° |
| C20 | C21 | C22 | 58.9° | 60.0° |
| C21 | C20 | H20 | 114.5° | 117.4° |
| C20 | C21 | H211 | 120.2° | 117.5° |
| C20 | C21 | H212 | 120.2° | 117.6° |
| C22 | C20 | N32 | 120.6° | 117.5° |
| C20 | C22 | C21 | 60.6° | 60.0° |
| C22 | C20 | H20 | 114.9° | 117.5° |
| C20 | C22 | H221 | 119.9° | 117.5° |
| C20 | C22 | H222 | 119.9° | 117.5° |
| C20 | N32 | H32 | 116.4° | 120.0° |
| N32 | C20 | H20 | 115.8° | 115.6° |
| C22 | C21 | H211 | 120.2° | 117.5° |
| C22 | C21 | H212 | 120.2° | 117.5° |
| C21 | C22 | H221 | 119.9° | 117.5° |
| C21 | C22 | H222 | 119.9° | 117.5° |
| C30 | N29 | C13 | 119.8° | 119.7° |
| C30 | N29 | C28 | 121.2° | 120.6° |
| N29 | C30 | C25 | 115.7° | 117.4° |
| N29 | C30 | O29 | 124.9° | 121.3° |
| C13 | N29 | C28 | 118.9° | 119.7° |
| N29 | C13 | C18 | 117.5° | 120.0° |
| N29 | C28 | N27 | 125.8° | 123.3° |
| N29 | C28 | H28 | 117.1° | 118.3° |
| C25 | C30 | O29 | 119.4° | 121.2° |
| C30 | C25 | C26 | 116.5° | 118.0° |
| N3 | C4 | C5 | 115.8° | 109.4° |
| N3 | C4 | H41C | 107.9° | 109.5° |
| N3 | C4 | H42C | 107.8° | 109.4° |
| C4 | C5 | N5 | 117.8° | 109.3° |
| C5 | C4 | H41C | 107.9° | 109.5° |
| C5 | C4 | H42C | 107.9° | 109.5° |
| C4 | C5 | H51C | 107.3° | 109.5° |
| C4 | C5 | H52C | 107.3° | 109.5° |
| N5 | C5 | H51C | 107.4° | 109.5° |
| N5 | C5 | H52C | 107.4° | 109.4° |
| C17 | C18 | C23 | 121.0° | 119.9° |
| C17 | C18 | C13 | 118.6° | 120.2° |
| C18 | C17 | H17 | 119.2° | 119.9° |
| C23 | C18 | C13 | 120.4° | 119.9° |
| C18 | C23 | H231 | 109.5° | 109.4° |
| C18 | C23 | H232 | 109.5° | 109.5° |
| C18 | C23 | H233 | 109.5° | 109.4° |
| C25 | C26 | N27 | 124.1° | 119.0° |
| C26 | N27 | C28 | 116.8° | 121.6° |
| N27 | C28 | H28 | 117.1° | 118.3° |
| H11C | C1 | H12C | 109.5° | 109.5° |
| H21C | C2 | H22C | 109.5° | 109.5° |
| H81C | C8 | H82C | 109.4° | 109.5° |
| H81C | C8 | H83C | 109.5° | 109.4° |
| H82C | C8 | H83C | 109.4° | 109.5° |
| H211 | C21 | H212 | 109.4° | 115.5° |
| H221 | C22 | H222 | 109.5° | 115.6° |
| H41C | C4 | H42C | 109.5° | 109.5° |
| H51C | C5 | H52C | 109.5° | 109.5° |
| H231 | C23 | H232 | 109.5° | 109.5° |
| H231 | C23 | H233 | 109.5° | 109.5° |
| H232 | C23 | H233 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | N5 | H11C | 120.8° | 120.0° |
| C2 | C1 | N5 | H12C | 120.9° | 119.9° |
| C1 | C2 | N3 | H21C | 120.4° | 119.9° |
| C1 | C2 | N3 | H22C | 120.4° | 120.0° |
| C1 | C2 | N3 | C8 | 170.0° | 64.5° |
| C2 | C1 | N5 | C10 | 150.9° | 176.8° |
| C1 | C2 | N3 | C4 | 64.8° | 59.3° |
| C2 | C1 | N5 | C5 | 9.8° | 59.3° |
| C2 | C1 | H11C | H12C | 117.3° | 120.1° |
| C1 | C2 | H21C | H22C | 118.9° | 120.0° |
| N5 | C1 | C2 | N3 | 44.1° | 58.4° |
| C1 | N5 | C10 | C9 | 162.1° | 180.0° |
| C1 | N5 | C10 | C11 | 18.7° | 0.0° |
| C1 | N5 | C10 | C5 | 160.2° | 123.8° |
| C1 | N5 | C5 | C4 | 3.2° | 59.3° |
| N5 | C1 | H11C | H12C | 117.3° | 120.0° |
| N5 | C1 | C2 | H21C | 164.5° | 61.6° |
| N5 | C1 | C2 | H22C | 76.3° | 178.4° |
| C1 | N5 | C5 | H51C | 124.4° | 179.3° |
| C1 | N5 | C5 | H52C | 117.9° | 60.6° |
| C2 | N3 | C8 | C4 | 124.2° | 123.8° |
| C2 | N3 | C4 | C5 | 51.3° | 59.3° |
| N3 | C2 | C1 | H11C | 165.0° | 61.6° |
| N3 | C2 | C1 | H12C | 76.8° | 178.3° |
| N3 | C2 | H21C | H22C | 118.8° | 120.1° |
| C2 | N3 | C8 | H81C | 180.0° | 60.0° |
| C2 | N3 | C8 | H82C | 60.0° | 180.0° |
| C2 | N3 | C8 | H83C | 60.0° | 60.0° |
| C2 | N3 | C4 | H41C | 172.3° | 60.7° |
| C2 | N3 | C4 | H42C | 69.6° | 179.3° |
| C8 | N3 | C4 | C5 | 178.7° | 64.5° |
| C8 | N3 | C2 | H21C | 49.6° | 175.5° |
| C8 | N3 | C2 | H22C | 69.6° | 55.5° |
| N3 | C8 | H81C | H82C | 120.0° | 120.0° |
| N3 | C8 | H81C | H83C | 120.0° | 120.0° |
| N3 | C8 | H82C | H83C | 120.0° | 120.0° |
| C8 | N3 | C4 | H41C | 60.4° | 175.5° |
| C8 | N3 | C4 | H42C | 57.8° | 55.4° |
| C10 | C9 | C25 | H9 | 180.0° | 179.8° |
| C9 | C10 | C11 | N5 | 179.3° | 180.0° |
| C9 | C10 | C11 | C12 | 1.2° | 0.0° |
| C10 | C9 | C25 | C30 | 178.1° | 179.9° |
| C9 | C10 | N5 | C5 | 1.9° | 56.2° |
| C10 | C9 | C25 | C26 | 1.3° | 0.0° |
| C9 | C10 | C11 | H11 | 178.8° | 180.0° |
| C25 | C9 | C10 | C11 | 1.7° | 0.1° |
| C25 | C9 | C10 | N5 | 179.0° | 179.9° |
| C9 | C25 | C26 | C12 | 0.3° | 0.0° |
| C9 | C25 | C30 | N29 | 177.6° | 180.0° |
| C9 | C25 | C30 | C26 | 179.4° | 180.0° |
| C9 | C25 | C30 | O29 | 1.0° | 0.1° |
| C9 | C25 | C26 | N27 | 180.0° | 180.0° |
| C10 | C11 | C12 | H11 | 180.0° | 179.9° |
| C10 | C11 | C12 | C26 | 0.2° | 0.0° |
| C11 | C10 | N5 | C5 | 178.9° | 123.8° |
| C11 | C10 | C9 | H9 | 178.3° | 179.7° |
| C10 | C11 | C12 | H12 | 179.8° | 180.0° |
| N5 | C10 | C11 | C12 | 179.5° | 180.0° |
| C10 | N5 | C5 | C4 | 163.1° | 176.8° |
| C10 | N5 | C1 | H11C | 30.1° | 63.2° |
| C10 | N5 | C1 | H12C | 88.2° | 56.9° |
| N5 | C10 | C9 | H9 | 1.0° | 0.3° |
| N5 | C10 | C11 | H11 | 0.5° | 0.0° |
| C10 | N5 | C5 | H51C | 75.7° | 56.8° |
| C10 | N5 | C5 | H52C | 42.0° | 63.3° |
| C11 | C12 | C26 | H12 | 180.0° | 180.0° |
| C11 | C12 | C26 | C25 | 0.3° | 0.0° |
| C11 | C12 | C26 | N27 | 179.5° | 180.0° |
| C12 | C26 | C25 | C30 | 179.2° | 180.0° |
| C12 | C26 | C25 | N27 | 179.7° | 180.0° |
| C12 | C26 | N27 | C28 | 177.5° | 180.0° |
| C26 | C12 | C11 | H11 | 179.8° | 179.9° |
| C15 | C14 | C13 | H14 | 180.0° | 179.7° |
| C14 | C15 | C16 | C19 | 175.9° | 180.0° |
| C14 | C15 | C16 | C17 | 2.8° | 0.0° |
| C14 | C15 | C19 | O24 | 18.0° | 0.1° |
| C14 | C15 | C19 | N32 | 164.5° | 180.0° |
| C15 | C14 | C13 | N29 | 176.1° | 180.0° |
| C15 | C14 | C13 | C18 | 0.2° | 0.0° |
| C14 | C15 | C16 | H16 | 177.2° | 180.0° |
| C13 | C14 | C15 | C16 | 2.2° | 0.0° |
| C13 | C14 | C15 | C19 | 178.5° | 180.0° |
| C14 | C13 | N29 | C30 | 84.5° | 90.0° |
| C14 | C13 | N29 | C18 | 176.4° | 180.0° |
| C14 | C13 | N29 | C28 | 98.7° | 89.9° |
| C14 | C13 | C18 | C17 | 1.3° | 0.0° |
| C14 | C13 | C18 | C23 | 179.7° | 180.0° |
| C15 | C16 | C17 | H16 | 180.0° | 179.9° |
| C16 | C15 | C19 | O24 | 158.0° | 180.0° |
| C16 | C15 | C19 | N32 | 19.5° | 0.0° |
| C15 | C16 | C17 | C18 | 1.4° | 0.0° |
| C16 | C15 | C14 | H14 | 177.8° | 179.7° |
| C15 | C16 | C17 | H17 | 178.6° | 180.0° |
| C19 | C15 | C16 | C17 | 178.7° | 180.0° |
| C15 | C19 | O24 | N32 | 177.5° | 180.0° |
| C15 | C19 | N32 | C20 | 178.5° | 180.0° |
| C19 | C15 | C14 | H14 | 1.6° | 0.3° |
| C19 | C15 | C16 | H16 | 1.3° | 0.0° |
| C15 | C19 | N32 | H32 | 1.5° | 0.0° |
| C16 | C17 | C18 | H17 | 180.0° | 180.0° |
| C16 | C17 | C18 | C23 | 179.1° | 180.0° |
| C16 | C17 | C18 | C13 | 0.6° | 0.0° |
| O24 | C19 | N32 | C20 | 1.2° | 0.1° |
| O24 | C19 | N32 | H32 | 178.8° | 180.0° |
| C19 | N32 | C20 | C21 | 125.1° | 155.0° |
| C19 | N32 | C20 | C22 | 54.1° | 136.4° |
| C19 | N32 | C20 | H32 | 180.0° | 180.0° |
| C19 | N32 | C20 | H20 | 92.0° | 9.4° |
| C21 | C20 | C22 | N32 | 108.4° | 107.5° |
| C21 | C20 | C22 | H20 | 105.2° | 107.4° |
| C21 | C20 | N32 | H20 | 142.9° | 145.6° |
| C20 | C21 | C22 | H211 | 109.2° | 107.5° |
| C20 | C21 | C22 | H212 | 109.2° | 107.6° |
| C21 | C20 | N32 | H32 | 54.9° | 25.0° |
| C20 | C21 | H211 | H212 | 145.4° | 145.7° |
| C21 | C20 | C22 | H221 | 109.6° | 107.5° |
| C21 | C20 | C22 | H222 | 109.6° | 107.5° |
| C22 | C20 | N32 | H20 | 146.1° | 145.8° |
| C22 | C20 | N32 | H32 | 125.9° | 43.6° |
| C20 | C22 | H221 | H222 | 144.4° | 145.6° |
| N32 | C20 | C21 | H211 | 1.6° | 0.0° |
| N32 | C20 | C21 | H212 | 140.1° | 145.0° |
| N32 | C20 | C22 | H221 | 142.0° | 145.0° |
| N32 | C20 | C22 | H222 | 1.2° | 0.1° |
| C22 | C21 | H211 | H212 | 145.3° | 145.6° |
| C21 | C22 | H221 | H222 | 144.4° | 145.8° |
| C30 | N29 | C13 | C28 | 176.8° | 179.9° |
| N29 | C30 | C25 | O29 | 176.5° | 179.9° |
| C30 | N29 | C13 | C18 | 91.8° | 90.0° |
| N29 | C30 | C25 | C26 | 1.8° | 0.0° |
| C30 | N29 | C28 | N27 | 1.1° | 0.1° |
| C30 | N29 | C28 | H28 | 178.9° | 180.0° |
| C13 | N29 | C30 | C25 | 179.3° | 180.0° |
| C13 | N29 | C30 | O29 | 4.3° | 0.1° |
| N29 | C13 | C18 | C17 | 177.7° | 180.0° |
| N29 | C13 | C18 | C23 | 3.9° | 0.0° |
| C13 | N29 | C28 | N27 | 177.8° | 180.0° |
| N29 | C13 | C14 | H14 | 3.9° | 0.3° |
| C13 | N29 | C28 | H28 | 2.2° | 0.1° |
| C28 | N29 | C30 | C25 | 2.6° | 0.1° |
| C28 | N29 | C30 | O29 | 179.0° | 179.9° |
| C28 | N29 | C13 | C18 | 84.9° | 90.1° |
| N29 | C28 | N27 | C26 | 1.4° | 0.0° |
| N29 | C28 | N27 | H28 | 180.0° | 179.9° |
| C30 | C25 | C26 | N27 | 0.5° | 0.0° |
| C30 | C25 | C9 | H9 | 1.9° | 0.2° |
| O29 | C30 | C25 | C26 | 178.4° | 179.9° |
| N3 | C4 | C5 | H41C | 120.9° | 120.0° |
| N3 | C4 | C5 | H42C | 120.9° | 119.9° |
| N3 | C4 | C5 | N5 | 18.0° | 58.4° |
| C4 | N3 | C2 | H21C | 174.8° | 60.6° |
| C4 | N3 | C2 | H22C | 55.6° | 179.3° |
| C4 | N3 | C8 | H81C | 55.8° | 63.8° |
| C4 | N3 | C8 | H82C | 175.8° | 56.2° |
| C4 | N3 | C8 | H83C | 64.3° | 176.2° |
| N3 | C4 | H41C | H42C | 117.1° | 120.0° |
| N3 | C4 | C5 | H51C | 103.2° | 178.4° |
| N3 | C4 | C5 | H52C | 139.2° | 61.5° |
| C4 | C5 | N5 | H51C | 121.2° | 120.0° |
| C4 | C5 | N5 | H52C | 121.2° | 120.0° |
| C5 | C4 | H41C | H42C | 117.1° | 120.1° |
| C4 | C5 | H51C | H52C | 116.2° | 120.1° |
| C5 | N5 | C1 | H11C | 130.6° | 60.7° |
| C5 | N5 | C1 | H12C | 111.1° | 179.3° |
| N5 | C5 | C4 | H41C | 138.9° | 61.6° |
| N5 | C5 | C4 | H42C | 102.9° | 178.3° |
| N5 | C5 | H51C | H52C | 116.2° | 120.0° |
| C17 | C18 | C23 | C13 | 178.4° | 180.0° |
| C18 | C17 | C16 | H16 | 178.6° | 180.0° |
| C17 | C18 | C23 | H231 | 89.2° | 90.0° |
| C17 | C18 | C23 | H232 | 150.8° | 150.0° |
| C17 | C18 | C23 | H233 | 30.8° | 30.0° |
| C23 | C18 | C17 | H17 | 0.9° | 0.0° |
| C18 | C23 | H231 | H232 | 120.0° | 120.0° |
| C18 | C23 | H231 | H233 | 120.0° | 119.9° |
| C18 | C23 | H232 | H233 | 120.0° | 120.0° |
| C18 | C13 | C14 | H14 | 179.8° | 179.7° |
| C13 | C18 | C17 | H17 | 179.4° | 180.0° |
| C13 | C18 | C23 | H231 | 89.2° | 90.0° |
| C13 | C18 | C23 | H232 | 30.8° | 30.0° |
| C13 | C18 | C23 | H233 | 150.8° | 150.0° |
| C25 | C26 | N27 | C28 | 2.2° | 0.0° |
| C26 | C25 | C9 | H9 | 178.7° | 179.8° |
| C25 | C26 | C12 | H12 | 179.7° | 180.0° |
| N27 | C26 | C12 | H12 | 0.6° | 0.0° |
| C26 | N27 | C28 | H28 | 178.6° | 179.9° |
| H11C | C1 | C2 | H21C | 74.6° | 178.5° |
| H11C | C1 | C2 | H22C | 44.6° | 58.4° |
| H12C | C1 | C2 | H21C | 43.6° | 58.3° |
| H12C | C1 | C2 | H22C | 162.9° | 61.7° |
| H81C | C8 | H82C | H83C | 119.9° | 120.0° |
| H11 | C11 | C12 | H12 | 0.2° | 0.0° |
| H16 | C16 | C17 | H17 | 1.4° | 0.0° |
| H32 | N32 | C20 | H20 | 88.0° | 170.7° |
| H20 | C20 | C21 | H211 | 144.9° | 145.0° |
| H20 | C20 | C21 | H212 | 3.3° | 0.0° |
| H20 | C20 | C22 | H221 | 4.4° | 0.1° |
| H20 | C20 | C22 | H222 | 145.2° | 145.1° |
| H211 | C21 | C22 | H221 | 141.1° | 145.1° |
| H211 | C21 | C22 | H222 | 0.4° | 0.0° |
| H212 | C21 | C22 | H221 | 0.5° | 0.1° |
| H212 | C21 | C22 | H222 | 141.2° | 145.0° |
| H41C | C4 | C5 | H51C | 17.7° | 58.4° |
| H41C | C4 | C5 | H52C | 99.9° | 178.5° |
| H42C | C4 | C5 | H51C | 135.9° | 61.7° |
| H42C | C4 | C5 | H52C | 18.2° | 58.4° |
| H231 | C23 | H232 | H233 | 120.0° | 120.0° |
