QXK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O7 | C6 | doub | 1.21Å | 1.22Å | |
| C6 | C1 | sing | 1.51Å | 1.51Å | |
| O9 | C8 | doub | 1.21Å | 1.22Å | |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C1 | C8 | sing | 1.51Å | 1.53Å | |
| C1 | C4 | sing | 1.53Å | 1.54Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C8 | N10 | sing | 1.35Å | 1.36Å | |
| C24 | C23 | doub | 1.39Å | 1.39Å | Aromatic |
| C24 | C25 | sing | 1.36Å | 1.39Å | Aromatic |
| C23 | C22 | sing | 1.36Å | 1.40Å | Aromatic |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C20 | N9 | sing | 1.47Å | 1.47Å | |
| C7 | N9 | sing | 1.47Å | 1.47Å | |
| C7 | C13 | sing | 1.51Å | 1.52Å | |
| N10 | C11 | sing | 1.40Å | 1.38Å | |
| C12 | C11 | doub | 1.39Å | 1.41Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | N9 | sing | 1.47Å | 1.47Å | |
| C10 | C17 | sing | 1.53Å | 1.52Å | |
| N18 | C19 | sing | 1.47Å | 1.48Å | |
| N18 | C17 | sing | 1.47Å | 1.48Å | |
| N18 | C21 | sing | 1.47Å | 1.47Å | |
| C25 | C26 | doub | 1.40Å | 1.40Å | Aromatic |
| C11 | C16 | sing | 1.39Å | 1.41Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C22 | C21 | sing | 1.51Å | 1.52Å | |
| C22 | C27 | doub | 1.40Å | 1.41Å | Aromatic |
| C26 | C27 | sing | 1.42Å | 1.41Å | Aromatic |
| C26 | C29 | sing | 1.41Å | 1.40Å | Aromatic |
| C27 | C9 | sing | 1.41Å | 1.40Å | Aromatic |
| C16 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | C28 | doub | 1.36Å | 1.39Å | Aromatic |
| C9 | C18 | doub | 1.36Å | 1.39Å | Aromatic |
| C28 | C18 | sing | 1.39Å | 1.39Å | Aromatic |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C14 | H13 | sing | 1.08Å | 1.08Å | |
| C15 | H14 | sing | 1.08Å | 1.08Å | |
| C16 | H15 | sing | 1.08Å | 1.08Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| N10 | H19 | sing | 0.97Å | 1.00Å | |
| C7 | H20 | sing | 1.09Å | 1.10Å | |
| C7 | H21 | sing | 1.09Å | 1.10Å | |
| C10 | H23 | sing | 1.09Å | 1.10Å | |
| C10 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C23 | H32 | sing | 1.08Å | 1.08Å | |
| C24 | H33 | sing | 1.08Å | 1.08Å | |
| C25 | H34 | sing | 1.08Å | 1.08Å | |
| C9 | H35 | sing | 1.08Å | 1.08Å | |
| C28 | H36 | sing | 1.08Å | 1.08Å | |
| C29 | H37 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O7 | C6 | C1 | 122.8° | 120.0° |
| O7 | C6 | H11 | 118.6° | 120.0° |
| C6 | C1 | C2 | 109.5° | 109.4° |
| C6 | C1 | C8 | 107.7° | 109.5° |
| C6 | C1 | C4 | 107.4° | 109.5° |
| C1 | C6 | H11 | 118.6° | 119.9° |
| O9 | C8 | C1 | 115.0° | 120.0° |
| O9 | C8 | N10 | 124.0° | 120.0° |
| C5 | C4 | C1 | 116.0° | 109.4° |
| C5 | C4 | H6 | 107.8° | 109.5° |
| C5 | C4 | H7 | 107.8° | 109.4° |
| C4 | C5 | H8 | 109.5° | 109.5° |
| C4 | C5 | H9 | 109.5° | 109.4° |
| C4 | C5 | H10 | 109.5° | 109.4° |
| C2 | C1 | C8 | 105.8° | 109.5° |
| C2 | C1 | C4 | 112.3° | 109.5° |
| C1 | C2 | C3 | 116.2° | 109.5° |
| C1 | C2 | H1 | 107.8° | 109.4° |
| C1 | C2 | H2 | 107.8° | 109.5° |
| C8 | C1 | C4 | 114.1° | 109.5° |
| C1 | C8 | N10 | 121.0° | 120.0° |
| C1 | C4 | H6 | 107.8° | 109.5° |
| C1 | C4 | H7 | 107.8° | 109.4° |
| C3 | C2 | H1 | 107.7° | 109.5° |
| C3 | C2 | H2 | 107.8° | 109.5° |
| C2 | C3 | H3 | 109.5° | 109.5° |
| C2 | C3 | H4 | 109.5° | 109.5° |
| C2 | C3 | H5 | 109.5° | 109.5° |
| C8 | N10 | C11 | 126.9° | 120.0° |
| C8 | N10 | H19 | 116.5° | 120.0° |
| C23 | C24 | C25 | 119.8° | 121.0° |
| C24 | C23 | C22 | 121.0° | 121.0° |
| C24 | C23 | H32 | 119.5° | 119.5° |
| C23 | C24 | H33 | 120.1° | 119.5° |
| C24 | C25 | C26 | 120.0° | 119.7° |
| C25 | C24 | H33 | 120.1° | 119.5° |
| C24 | C25 | H34 | 120.0° | 120.1° |
| C23 | C22 | C21 | 117.1° | 120.2° |
| C23 | C22 | C27 | 119.5° | 119.6° |
| C22 | C23 | H32 | 119.5° | 119.5° |
| C19 | C20 | N9 | 108.7° | 109.4° |
| C20 | C19 | N18 | 112.7° | 109.3° |
| C20 | C19 | H26 | 108.6° | 109.5° |
| C20 | C19 | H27 | 108.7° | 109.5° |
| C19 | C20 | H28 | 109.6° | 109.5° |
| C19 | C20 | H29 | 109.6° | 109.5° |
| C20 | N9 | C7 | 109.2° | 111.0° |
| C20 | N9 | C10 | 108.1° | 110.9° |
| N9 | C20 | H28 | 109.7° | 109.5° |
| N9 | C20 | H29 | 109.7° | 109.5° |
| N9 | C7 | C13 | 113.3° | 109.5° |
| C7 | N9 | C10 | 111.5° | 111.0° |
| N9 | C7 | H20 | 108.5° | 109.4° |
| N9 | C7 | H21 | 108.5° | 109.4° |
| C7 | C13 | C12 | 116.1° | 120.0° |
| C7 | C13 | C14 | 123.9° | 120.0° |
| C13 | C7 | H20 | 108.5° | 109.5° |
| C13 | C7 | H21 | 108.5° | 109.5° |
| N10 | C11 | C12 | 124.3° | 120.1° |
| N10 | C11 | C16 | 118.2° | 120.1° |
| C11 | N10 | H19 | 116.5° | 120.0° |
| C11 | C12 | C13 | 121.7° | 119.9° |
| C12 | C11 | C16 | 117.5° | 119.8° |
| C11 | C12 | H12 | 119.2° | 120.1° |
| C12 | C13 | C14 | 120.1° | 120.0° |
| C13 | C12 | H12 | 119.1° | 120.0° |
| N9 | C10 | C17 | 108.4° | 109.4° |
| N9 | C10 | H23 | 109.7° | 109.5° |
| N9 | C10 | H24 | 109.7° | 109.5° |
| C10 | C17 | N18 | 111.1° | 109.4° |
| C10 | C17 | H16 | 109.1° | 109.5° |
| C10 | C17 | H17 | 109.1° | 109.5° |
| C17 | C10 | H23 | 109.8° | 109.5° |
| C17 | C10 | H24 | 109.7° | 109.5° |
| C19 | N18 | C17 | 113.6° | 110.9° |
| C19 | N18 | C21 | 107.1° | 111.0° |
| N18 | C19 | H26 | 108.7° | 109.5° |
| N18 | C19 | H27 | 108.7° | 109.5° |
| C17 | N18 | C21 | 109.6° | 111.0° |
| N18 | C17 | H16 | 109.1° | 109.5° |
| N18 | C17 | H17 | 109.1° | 109.5° |
| N18 | C21 | C22 | 112.8° | 109.5° |
| N18 | C21 | H30 | 108.6° | 109.4° |
| N18 | C21 | H31 | 108.6° | 109.5° |
| C25 | C26 | C27 | 121.1° | 119.3° |
| C25 | C26 | C29 | 118.0° | 121.3° |
| C26 | C25 | H34 | 120.0° | 120.2° |
| C11 | C16 | C15 | 121.2° | 119.9° |
| C11 | C16 | H15 | 119.4° | 120.0° |
| C13 | C14 | C15 | 119.5° | 120.2° |
| C13 | C14 | H13 | 120.3° | 119.9° |
| C21 | C22 | C27 | 123.5° | 120.2° |
| C22 | C21 | H30 | 108.6° | 109.4° |
| C22 | C21 | H31 | 108.7° | 109.5° |
| C22 | C27 | C26 | 118.7° | 119.4° |
| C22 | C27 | C9 | 123.6° | 121.3° |
| C27 | C26 | C29 | 120.9° | 119.4° |
| C26 | C27 | C9 | 117.8° | 119.3° |
| C26 | C29 | C28 | 120.1° | 119.7° |
| C26 | C29 | H37 | 120.0° | 120.2° |
| C27 | C9 | C18 | 120.9° | 119.7° |
| C27 | C9 | H35 | 119.6° | 120.2° |
| C16 | C15 | C14 | 120.1° | 120.0° |
| C16 | C15 | H14 | 120.0° | 120.0° |
| C15 | C16 | H15 | 119.4° | 120.1° |
| C15 | C14 | H13 | 120.3° | 119.9° |
| C14 | C15 | H14 | 120.0° | 120.0° |
| C29 | C28 | C18 | 119.8° | 120.9° |
| C29 | C28 | H36 | 120.1° | 119.5° |
| C28 | C29 | H37 | 119.9° | 120.2° |
| C9 | C18 | C28 | 120.5° | 121.0° |
| C9 | C18 | H18 | 119.7° | 119.5° |
| C18 | C9 | H35 | 119.5° | 120.2° |
| C28 | C18 | H18 | 119.8° | 119.5° |
| C18 | C28 | H36 | 120.1° | 119.5° |
| H1 | C2 | H2 | 109.5° | 109.4° |
| H3 | C3 | H4 | 109.5° | 109.4° |
| H3 | C3 | H5 | 109.4° | 109.5° |
| H4 | C3 | H5 | 109.5° | 109.5° |
| H6 | C4 | H7 | 109.5° | 109.5° |
| H8 | C5 | H9 | 109.5° | 109.5° |
| H8 | C5 | H10 | 109.5° | 109.5° |
| H9 | C5 | H10 | 109.4° | 109.5° |
| H16 | C17 | H17 | 109.5° | 109.5° |
| H20 | C7 | H21 | 109.5° | 109.5° |
| H23 | C10 | H24 | 109.5° | 109.5° |
| H26 | C19 | H27 | 109.5° | 109.5° |
| H28 | C20 | H29 | 109.5° | 109.5° |
| H30 | C21 | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O7 | C6 | C1 | H11 | 180.0° | 180.0° |
| O7 | C6 | C1 | C2 | 8.1° | 0.0° |
| O7 | C6 | C1 | C8 | 106.5° | 120.0° |
| O7 | C6 | C1 | C4 | 130.3° | 119.9° |
| C6 | C1 | C8 | O9 | 39.2° | 120.0° |
| C6 | C1 | C4 | C5 | 46.3° | 180.0° |
| C6 | C1 | C2 | C8 | 115.7° | 120.0° |
| C6 | C1 | C2 | C4 | 119.2° | 120.0° |
| C6 | C1 | C8 | C4 | 119.0° | 120.0° |
| C6 | C1 | C2 | C3 | 163.5° | 60.0° |
| C6 | C1 | C8 | N10 | 144.2° | 60.1° |
| C6 | C1 | C2 | H1 | 42.6° | 180.0° |
| C6 | C1 | C2 | H2 | 75.5° | 60.1° |
| C6 | C1 | C4 | H6 | 167.2° | 59.9° |
| C6 | C1 | C4 | H7 | 74.6° | 60.1° |
| O9 | C8 | C1 | C2 | 77.8° | 0.0° |
| O9 | C8 | C1 | N10 | 176.7° | 180.0° |
| O9 | C8 | C1 | C4 | 158.2° | 120.0° |
| O9 | C8 | N10 | C11 | 1.9° | 5.3° |
| O9 | C8 | N10 | H19 | 178.1° | 174.7° |
| C5 | C4 | C1 | C2 | 74.1° | 60.1° |
| C5 | C4 | C1 | C8 | 165.5° | 60.0° |
| C5 | C4 | C1 | H6 | 120.9° | 120.1° |
| C5 | C4 | C1 | H7 | 120.9° | 119.9° |
| C5 | C4 | H6 | H7 | 117.0° | 120.0° |
| C4 | C5 | H8 | H9 | 120.0° | 120.0° |
| C4 | C5 | H8 | H10 | 120.0° | 119.9° |
| C4 | C5 | H9 | H10 | 120.0° | 119.9° |
| C2 | C1 | C8 | C4 | 124.0° | 120.0° |
| C1 | C2 | C3 | H1 | 120.9° | 120.0° |
| C1 | C2 | C3 | H2 | 121.0° | 120.1° |
| C2 | C1 | C8 | N10 | 98.8° | 180.0° |
| C1 | C2 | H1 | H2 | 117.0° | 120.0° |
| C1 | C2 | C3 | H3 | 180.0° | 180.0° |
| C1 | C2 | C3 | H4 | 60.0° | 60.1° |
| C1 | C2 | C3 | H5 | 60.0° | 60.0° |
| C2 | C1 | C4 | H6 | 46.8° | 60.0° |
| C2 | C1 | C4 | H7 | 164.9° | 180.0° |
| C2 | C1 | C6 | H11 | 171.9° | 180.0° |
| C8 | C1 | C2 | C3 | 47.8° | 180.0° |
| C1 | C8 | N10 | C11 | 178.2° | 174.8° |
| C8 | C1 | C2 | H1 | 73.2° | 60.0° |
| C8 | C1 | C2 | H2 | 168.7° | 59.9° |
| C8 | C1 | C4 | H6 | 73.6° | 180.0° |
| C8 | C1 | C4 | H7 | 44.6° | 59.9° |
| C8 | C1 | C6 | H11 | 73.5° | 60.0° |
| C1 | C8 | N10 | H19 | 1.8° | 5.2° |
| C4 | C1 | C2 | C3 | 77.3° | 60.0° |
| C4 | C1 | C8 | N10 | 25.1° | 60.0° |
| C4 | C1 | C2 | H1 | 161.8° | 60.1° |
| C4 | C1 | C2 | H2 | 43.7° | 180.0° |
| C1 | C4 | H6 | H7 | 117.0° | 120.0° |
| C1 | C4 | C5 | H8 | 180.0° | 60.0° |
| C1 | C4 | C5 | H9 | 60.0° | 60.1° |
| C1 | C4 | C5 | H10 | 60.0° | 180.0° |
| C4 | C1 | C6 | H11 | 49.7° | 60.0° |
| C3 | C2 | H1 | H2 | 117.0° | 120.0° |
| C2 | C3 | H3 | H4 | 120.0° | 120.0° |
| C2 | C3 | H3 | H5 | 120.0° | 120.0° |
| C2 | C3 | H4 | H5 | 120.0° | 120.0° |
| C8 | N10 | C11 | H19 | 180.0° | 180.0° |
| C8 | N10 | C11 | C12 | 0.9° | 146.7° |
| C8 | N10 | C11 | C16 | 179.0° | 33.3° |
| C23 | C24 | C25 | H33 | 180.0° | 179.9° |
| C24 | C23 | C22 | H32 | 180.0° | 179.9° |
| C23 | C24 | C25 | C26 | 0.1° | 0.2° |
| C24 | C23 | C22 | C21 | 179.5° | 179.9° |
| C24 | C23 | C22 | C27 | 0.2° | 0.0° |
| C23 | C24 | C25 | H34 | 179.9° | 180.0° |
| C25 | C24 | C23 | C22 | 0.2° | 0.1° |
| C24 | C25 | C26 | H34 | 180.0° | 179.8° |
| C24 | C25 | C26 | C27 | 0.0° | 0.1° |
| C24 | C25 | C26 | C29 | 179.9° | 179.7° |
| C25 | C24 | C23 | H32 | 179.8° | 179.9° |
| C23 | C22 | C21 | N18 | 45.5° | 100.0° |
| C23 | C22 | C21 | C27 | 179.2° | 180.0° |
| C23 | C22 | C27 | C26 | 0.1° | 0.0° |
| C23 | C22 | C27 | C9 | 179.8° | 180.0° |
| C23 | C22 | C21 | H30 | 75.0° | 140.0° |
| C23 | C22 | C21 | H31 | 166.0° | 20.1° |
| C22 | C23 | C24 | H33 | 179.8° | 180.0° |
| C19 | C20 | N9 | H28 | 119.9° | 120.0° |
| C19 | C20 | N9 | H29 | 119.9° | 119.9° |
| C19 | C20 | N9 | C7 | 173.9° | 176.8° |
| C19 | C20 | N9 | C10 | 64.6° | 59.3° |
| C20 | C19 | N18 | H26 | 120.5° | 120.0° |
| C20 | C19 | N18 | H27 | 120.5° | 119.9° |
| C20 | C19 | N18 | C17 | 46.8° | 59.3° |
| C20 | C19 | N18 | C21 | 168.0° | 176.8° |
| C20 | C19 | H26 | H27 | 118.5° | 120.1° |
| C19 | C20 | H28 | H29 | 120.3° | 120.0° |
| C20 | N9 | C7 | C10 | 119.5° | 123.8° |
| C20 | N9 | C7 | C13 | 171.0° | 66.2° |
| C20 | N9 | C10 | C17 | 67.1° | 59.3° |
| N9 | C20 | C19 | N18 | 54.2° | 58.4° |
| C20 | N9 | C7 | H20 | 50.4° | 173.8° |
| C20 | N9 | C7 | H21 | 68.4° | 53.8° |
| C20 | N9 | C10 | H23 | 173.1° | 60.7° |
| C20 | N9 | C10 | H24 | 52.8° | 179.3° |
| N9 | C20 | C19 | H26 | 174.7° | 61.5° |
| N9 | C20 | C19 | H27 | 66.3° | 178.4° |
| N9 | C20 | H28 | H29 | 120.4° | 120.1° |
| N9 | C7 | C13 | H20 | 120.6° | 120.0° |
| N9 | C7 | C13 | H21 | 120.6° | 120.0° |
| N9 | C7 | C13 | C12 | 152.1° | 90.0° |
| C7 | N9 | C10 | C17 | 172.8° | 176.8° |
| N9 | C7 | C13 | C14 | 27.9° | 90.0° |
| N9 | C7 | H20 | H21 | 118.2° | 119.9° |
| C7 | N9 | C10 | H23 | 53.0° | 63.2° |
| C7 | N9 | C10 | H24 | 67.3° | 56.8° |
| C7 | N9 | C20 | H28 | 54.0° | 63.3° |
| C7 | N9 | C20 | H29 | 66.2° | 56.8° |
| C7 | C13 | C12 | C11 | 180.0° | 180.0° |
| C7 | C13 | C12 | C14 | 179.9° | 180.0° |
| C13 | C7 | N9 | C10 | 69.5° | 170.0° |
| C7 | C13 | C14 | C15 | 179.9° | 180.0° |
| C7 | C13 | C12 | H12 | 0.0° | 0.2° |
| C7 | C13 | C14 | H13 | 0.1° | 0.0° |
| C13 | C7 | H20 | H21 | 118.3° | 120.0° |
| N10 | C11 | C12 | C16 | 179.9° | 180.0° |
| N10 | C11 | C12 | C13 | 179.9° | 180.0° |
| N10 | C11 | C16 | C15 | 179.9° | 180.0° |
| N10 | C11 | C12 | H12 | 0.1° | 0.2° |
| N10 | C11 | C16 | H15 | 0.1° | 0.0° |
| C11 | C12 | C13 | H12 | 180.0° | 179.8° |
| C11 | C12 | C13 | C14 | 0.1° | 0.0° |
| C12 | C11 | C16 | C15 | 0.0° | 0.1° |
| C12 | C11 | C16 | H15 | 180.0° | 180.0° |
| C12 | C11 | N10 | H19 | 179.1° | 33.3° |
| C13 | C12 | C11 | C16 | 0.0° | 0.1° |
| C12 | C13 | C14 | C15 | 0.1° | 0.0° |
| C12 | C13 | C14 | H13 | 179.9° | 180.0° |
| C12 | C13 | C7 | H20 | 87.3° | 150.0° |
| C12 | C13 | C7 | H21 | 31.6° | 30.0° |
| N9 | C10 | C17 | H23 | 119.8° | 120.0° |
| N9 | C10 | C17 | H24 | 119.8° | 120.0° |
| N9 | C10 | C17 | N18 | 58.3° | 58.4° |
| N9 | C10 | C17 | H16 | 62.0° | 61.6° |
| N9 | C10 | C17 | H17 | 178.5° | 178.4° |
| C10 | N9 | C7 | H20 | 169.9° | 50.0° |
| C10 | N9 | C7 | H21 | 51.1° | 70.0° |
| N9 | C10 | H23 | H24 | 120.5° | 120.0° |
| C10 | N9 | C20 | H28 | 175.6° | 60.7° |
| C10 | N9 | C20 | H29 | 55.3° | 179.3° |
| C10 | C17 | N18 | C19 | 48.5° | 59.3° |
| C10 | C17 | N18 | H16 | 120.2° | 119.9° |
| C10 | C17 | N18 | H17 | 120.3° | 120.0° |
| C10 | C17 | N18 | C21 | 168.3° | 176.8° |
| C10 | C17 | H16 | H17 | 119.3° | 120.1° |
| C17 | C10 | H23 | H24 | 120.5° | 120.1° |
| C19 | N18 | C17 | C21 | 119.8° | 123.9° |
| C19 | N18 | C21 | C22 | 167.9° | 170.0° |
| C19 | N18 | C17 | H16 | 71.7° | 60.6° |
| C19 | N18 | C17 | H17 | 168.8° | 179.3° |
| N18 | C19 | H26 | H27 | 118.5° | 120.1° |
| N18 | C19 | C20 | H28 | 174.1° | 61.5° |
| N18 | C19 | C20 | H29 | 65.7° | 178.4° |
| C19 | N18 | C21 | H30 | 47.4° | 50.0° |
| C19 | N18 | C21 | H31 | 71.6° | 70.0° |
| C17 | N18 | C21 | C22 | 68.4° | 66.2° |
| N18 | C17 | H16 | H17 | 119.3° | 120.0° |
| N18 | C17 | C10 | H23 | 178.1° | 61.6° |
| N18 | C17 | C10 | H24 | 61.5° | 178.3° |
| C17 | N18 | C19 | H26 | 167.3° | 60.6° |
| C17 | N18 | C19 | H27 | 73.7° | 179.3° |
| C17 | N18 | C21 | H30 | 171.1° | 173.8° |
| C17 | N18 | C21 | H31 | 52.1° | 53.9° |
| N18 | C21 | C22 | H30 | 120.5° | 119.9° |
| N18 | C21 | C22 | H31 | 120.5° | 120.1° |
| N18 | C21 | C22 | C27 | 135.3° | 80.0° |
| C21 | N18 | C17 | H16 | 48.0° | 63.2° |
| C21 | N18 | C17 | H17 | 71.5° | 56.8° |
| C21 | N18 | C19 | H26 | 71.6° | 63.2° |
| C21 | N18 | C19 | H27 | 47.5° | 56.9° |
| N18 | C21 | H30 | H31 | 118.5° | 120.0° |
| C25 | C26 | C27 | C22 | 0.0° | 0.0° |
| C25 | C26 | C27 | C29 | 179.9° | 179.8° |
| C25 | C26 | C27 | C9 | 179.7° | 179.9° |
| C25 | C26 | C29 | C28 | 179.9° | 179.9° |
| C26 | C25 | C24 | H33 | 180.0° | 180.0° |
| C25 | C26 | C29 | H37 | 0.1° | 0.2° |
| C11 | C16 | C15 | H15 | 180.0° | 180.0° |
| C11 | C16 | C15 | C14 | 0.0° | 0.1° |
| C16 | C11 | C12 | H12 | 180.0° | 179.7° |
| C11 | C16 | C15 | H14 | 180.0° | 180.0° |
| C16 | C11 | N10 | H19 | 1.0° | 146.7° |
| C13 | C14 | C15 | C16 | 0.1° | 0.1° |
| C13 | C14 | C15 | H13 | 180.0° | 179.9° |
| C14 | C13 | C12 | H12 | 179.9° | 179.7° |
| C13 | C14 | C15 | H14 | 179.9° | 180.0° |
| C14 | C13 | C7 | H20 | 92.6° | 30.0° |
| C14 | C13 | C7 | H21 | 148.5° | 150.0° |
| C21 | C22 | C27 | C26 | 179.3° | 180.0° |
| C21 | C22 | C27 | C9 | 1.0° | 0.1° |
| C22 | C21 | H30 | H31 | 118.5° | 120.0° |
| C21 | C22 | C23 | H32 | 0.6° | 0.0° |
| C22 | C27 | C26 | C9 | 179.7° | 180.0° |
| C22 | C27 | C26 | C29 | 179.9° | 179.8° |
| C22 | C27 | C9 | C18 | 179.6° | 179.9° |
| C27 | C22 | C21 | H30 | 104.2° | 40.0° |
| C27 | C22 | C21 | H31 | 14.8° | 160.0° |
| C27 | C22 | C23 | H32 | 179.8° | 180.0° |
| C22 | C27 | C9 | H35 | 0.4° | 0.0° |
| C27 | C26 | C29 | C28 | 0.2° | 0.2° |
| C26 | C27 | C9 | C18 | 0.7° | 0.0° |
| C27 | C26 | C25 | H34 | 180.0° | 180.0° |
| C26 | C27 | C9 | H35 | 179.3° | 180.0° |
| C27 | C26 | C29 | H37 | 179.8° | 180.0° |
| C29 | C26 | C27 | C9 | 0.4° | 0.2° |
| C26 | C29 | C28 | H37 | 180.0° | 179.8° |
| C26 | C29 | C28 | C18 | 0.3° | 0.1° |
| C29 | C26 | C25 | H34 | 0.1° | 0.1° |
| C26 | C29 | C28 | H36 | 179.7° | 180.0° |
| C27 | C9 | C18 | H35 | 180.0° | 180.0° |
| C27 | C9 | C18 | C28 | 0.9° | 0.3° |
| C27 | C9 | C18 | H18 | 179.1° | 180.0° |
| C16 | C15 | C14 | H14 | 180.0° | 180.0° |
| C16 | C15 | C14 | H13 | 179.9° | 180.0° |
| C14 | C15 | C16 | H15 | 180.0° | 180.0° |
| C29 | C28 | C18 | C9 | 0.6° | 0.3° |
| C29 | C28 | C18 | H36 | 180.0° | 179.9° |
| C29 | C28 | C18 | H18 | 179.4° | 180.0° |
| C9 | C18 | C28 | H18 | 180.0° | 179.7° |
| C9 | C18 | C28 | H36 | 179.4° | 179.7° |
| C28 | C18 | C9 | H35 | 179.1° | 179.7° |
| C18 | C28 | C29 | H37 | 179.7° | 179.7° |
| H1 | C2 | C3 | H3 | 59.0° | 60.0° |
| H1 | C2 | C3 | H4 | 179.1° | 180.0° |
| H1 | C2 | C3 | H5 | 60.9° | 60.0° |
| H2 | C2 | C3 | H3 | 59.0° | 59.9° |
| H2 | C2 | C3 | H4 | 61.0° | 60.0° |
| H2 | C2 | C3 | H5 | 179.0° | 179.9° |
| H3 | C3 | H4 | H5 | 120.0° | 120.0° |
| H6 | C4 | C5 | H8 | 59.1° | 180.0° |
| H6 | C4 | C5 | H9 | 60.9° | 59.9° |
| H6 | C4 | C5 | H10 | 179.1° | 60.0° |
| H7 | C4 | C5 | H8 | 59.0° | 59.9° |
| H7 | C4 | C5 | H9 | 179.1° | 180.0° |
| H7 | C4 | C5 | H10 | 61.0° | 60.1° |
| H8 | C5 | H9 | H10 | 120.0° | 120.1° |
| H13 | C14 | C15 | H14 | 0.1° | 0.0° |
| H14 | C15 | C16 | H15 | 0.0° | 0.0° |
| H16 | C17 | C10 | H23 | 57.9° | 178.5° |
| H16 | C17 | C10 | H24 | 178.2° | 58.4° |
| H17 | C17 | C10 | H23 | 61.6° | 58.4° |
| H17 | C17 | C10 | H24 | 58.7° | 61.6° |
| H18 | C18 | C9 | H35 | 0.9° | 0.0° |
| H18 | C18 | C28 | H36 | 0.6° | 0.1° |
| H26 | C19 | C20 | H28 | 65.4° | 178.5° |
| H26 | C19 | C20 | H29 | 54.8° | 58.4° |
| H27 | C19 | C20 | H28 | 53.6° | 58.4° |
| H27 | C19 | C20 | H29 | 173.9° | 61.7° |
| H32 | C23 | C24 | H33 | 0.1° | 0.1° |
| H33 | C24 | C25 | H34 | 0.1° | 0.1° |
| H36 | C28 | C29 | H37 | 0.3° | 0.2° |
