WLQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C15 | sing | 1.51Å | 1.55Å | |
| C15 | C14 | doub | 1.38Å | 1.41Å | Aromatic |
| C15 | C17 | sing | 1.38Å | 1.41Å | Aromatic |
| C14 | C13 | sing | 1.39Å | 1.40Å | Aromatic |
| C17 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | N2 | sing | 1.40Å | 1.47Å | |
| C13 | C23 | doub | 1.39Å | 1.41Å | Aromatic |
| N2 | C12 | sing | 1.47Å | 1.47Å | |
| C18 | C23 | sing | 1.39Å | 1.38Å | Aromatic |
| C18 | C19 | sing | 1.48Å | 1.55Å | |
| C20 | C19 | doub | 1.40Å | 1.41Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.42Å | Aromatic |
| C12 | C11 | sing | 1.51Å | 1.57Å | |
| C19 | N4 | sing | 1.33Å | 1.34Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.42Å | Aromatic |
| N4 | N3 | doub | 1.28Å | 1.37Å | Aromatic |
| C22 | N3 | sing | 1.32Å | 1.35Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C24 | sing | 1.38Å | 1.43Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.41Å | Aromatic |
| C24 | C25 | doub | 1.38Å | 1.42Å | Aromatic |
| C9 | C8 | doub | 1.38Å | 1.41Å | Aromatic |
| C25 | C8 | sing | 1.38Å | 1.41Å | Aromatic |
| C8 | C7 | sing | 1.51Å | 1.57Å | |
| C7 | N1 | sing | 1.47Å | 1.22Å | |
| C4 | N1 | sing | 1.47Å | 1.51Å | |
| C4 | C3 | sing | 1.53Å | 1.51Å | |
| N1 | C5 | sing | 1.47Å | 1.56Å | |
| O3 | C3 | sing | 1.43Å | 1.48Å | |
| C3 | C2 | sing | 1.53Å | 1.47Å | |
| C5 | C6 | sing | 1.53Å | 1.48Å | |
| C5 | C1 | sing | 1.53Å | 1.62Å | |
| C6 | O4 | sing | 1.43Å | 1.44Å | |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C2 | O2 | sing | 1.43Å | 1.53Å | |
| C1 | O1 | sing | 1.43Å | 1.45Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.08Å | 1.08Å | |
| C17 | H10 | sing | 1.08Å | 1.08Å | |
| C20 | H11 | sing | 1.08Å | 1.08Å | |
| C21 | H12 | sing | 1.08Å | 1.08Å | |
| C22 | H13 | sing | 1.08Å | 1.08Å | |
| C24 | H14 | sing | 1.08Å | 1.08Å | |
| O1 | H15 | sing | 0.97Å | 0.95Å | |
| C1 | H16 | sing | 1.09Å | 1.10Å | |
| C2 | H17 | sing | 1.09Å | 1.10Å | |
| O2 | H18 | sing | 0.97Å | 0.95Å | |
| C3 | H19 | sing | 1.09Å | 1.10Å | |
| O3 | H20 | sing | 0.97Å | 0.95Å | |
| O4 | H21 | sing | 0.97Å | 0.95Å | |
| C9 | H22 | sing | 1.08Å | 1.08Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C12 | H24 | sing | 1.09Å | 1.10Å | |
| N2 | H25 | sing | 0.97Å | 1.00Å | |
| C14 | H26 | sing | 1.08Å | 1.08Å | |
| C16 | H27 | sing | 1.09Å | 1.10Å | |
| C16 | H28 | sing | 1.09Å | 1.10Å | |
| C16 | H29 | sing | 1.09Å | 1.10Å | |
| C23 | H30 | sing | 1.08Å | 1.08Å | |
| C25 | H31 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | C15 | C14 | 123.1° | 119.9° |
| C16 | C15 | C17 | 117.0° | 119.9° |
| C15 | C16 | H27 | 109.5° | 109.5° |
| C15 | C16 | H28 | 109.5° | 109.5° |
| C15 | C16 | H29 | 109.5° | 109.5° |
| C14 | C15 | C17 | 119.8° | 120.2° |
| C15 | C14 | C13 | 116.0° | 120.2° |
| C15 | C14 | H26 | 122.0° | 119.9° |
| C15 | C17 | C18 | 122.5° | 120.0° |
| C15 | C17 | H10 | 118.7° | 120.0° |
| C14 | C13 | N2 | 119.2° | 120.1° |
| C14 | C13 | C23 | 124.2° | 119.9° |
| C13 | C14 | H26 | 122.0° | 119.9° |
| C17 | C18 | C23 | 119.0° | 119.8° |
| C17 | C18 | C19 | 122.4° | 120.1° |
| C18 | C17 | H10 | 118.8° | 120.0° |
| N2 | C13 | C23 | 116.6° | 120.0° |
| C13 | N2 | C12 | 116.5° | 120.0° |
| C13 | N2 | H25 | 107.7° | 120.0° |
| C13 | C23 | C18 | 118.4° | 119.8° |
| C13 | C23 | H30 | 120.8° | 120.1° |
| N2 | C12 | C11 | 108.5° | 109.5° |
| N2 | C12 | H23 | 109.7° | 109.5° |
| N2 | C12 | H24 | 109.7° | 109.5° |
| C12 | N2 | H25 | 107.7° | 120.0° |
| C23 | C18 | C19 | 118.6° | 120.1° |
| C18 | C23 | H30 | 120.8° | 120.1° |
| C18 | C19 | C20 | 117.8° | 120.2° |
| C18 | C19 | N4 | 119.8° | 120.2° |
| C19 | C20 | C21 | 117.9° | 117.9° |
| C20 | C19 | N4 | 122.4° | 119.7° |
| C19 | C20 | H11 | 121.0° | 121.1° |
| C20 | C21 | C22 | 117.4° | 118.1° |
| C21 | C20 | H11 | 121.1° | 121.1° |
| C20 | C21 | H12 | 121.3° | 120.9° |
| C12 | C11 | C10 | 118.5° | 120.0° |
| C12 | C11 | C24 | 121.7° | 120.0° |
| C11 | C12 | H23 | 109.7° | 109.4° |
| C11 | C12 | H24 | 109.7° | 109.5° |
| C19 | N4 | N3 | 119.9° | 122.0° |
| C21 | C22 | N3 | 121.3° | 120.1° |
| C22 | C21 | H12 | 121.3° | 121.0° |
| C21 | C22 | H13 | 119.4° | 120.0° |
| N4 | N3 | C22 | 121.1° | 122.3° |
| N3 | C22 | H13 | 119.3° | 119.9° |
| C10 | C11 | C24 | 119.6° | 120.0° |
| C11 | C10 | C9 | 119.2° | 120.0° |
| C11 | C10 | H9 | 120.4° | 120.0° |
| C11 | C24 | C25 | 121.7° | 120.0° |
| C11 | C24 | H14 | 119.2° | 119.9° |
| C10 | C9 | C8 | 120.6° | 120.0° |
| C9 | C10 | H9 | 120.4° | 120.0° |
| C10 | C9 | H22 | 119.7° | 120.0° |
| C24 | C25 | C8 | 117.1° | 120.0° |
| C25 | C24 | H14 | 119.2° | 120.0° |
| C24 | C25 | H31 | 121.4° | 120.0° |
| C9 | C8 | C25 | 121.7° | 120.0° |
| C9 | C8 | C7 | 116.9° | 120.0° |
| C8 | C9 | H22 | 119.7° | 120.0° |
| C25 | C8 | C7 | 121.4° | 120.0° |
| C8 | C25 | H31 | 121.4° | 120.0° |
| C8 | C7 | N1 | 113.8° | 109.5° |
| C8 | C7 | H7 | 108.4° | 109.5° |
| C8 | C7 | H8 | 108.4° | 109.5° |
| C7 | N1 | C4 | 110.6° | 111.0° |
| C7 | N1 | C5 | 112.3° | 111.0° |
| N1 | C7 | H7 | 108.4° | 109.4° |
| N1 | C7 | H8 | 108.4° | 109.5° |
| N1 | C4 | C3 | 116.4° | 109.6° |
| C4 | N1 | C5 | 109.6° | 111.2° |
| N1 | C4 | H2 | 107.7° | 109.4° |
| N1 | C4 | H3 | 107.7° | 109.5° |
| C4 | C3 | O3 | 106.0° | 109.5° |
| C4 | C3 | C2 | 112.8° | 109.3° |
| C3 | C4 | H2 | 107.7° | 109.5° |
| C3 | C4 | H3 | 107.7° | 109.5° |
| C4 | C3 | H19 | 108.8° | 109.5° |
| N1 | C5 | C6 | 116.0° | 109.5° |
| N1 | C5 | C1 | 108.7° | 109.6° |
| N1 | C5 | H4 | 105.5° | 109.4° |
| O3 | C3 | C2 | 110.7° | 109.5° |
| O3 | C3 | H19 | 109.1° | 109.5° |
| C3 | O3 | H20 | 109.5° | 114.0° |
| C3 | C2 | C1 | 113.3° | 109.2° |
| C3 | C2 | O2 | 113.0° | 109.5° |
| C3 | C2 | H17 | 105.8° | 109.6° |
| C2 | C3 | H19 | 109.3° | 109.5° |
| C6 | C5 | C1 | 114.2° | 109.5° |
| C5 | C6 | O4 | 111.4° | 109.4° |
| C6 | C5 | H4 | 106.4° | 109.4° |
| C5 | C6 | H5 | 109.0° | 109.5° |
| C5 | C6 | H6 | 109.0° | 109.4° |
| C5 | C1 | C2 | 113.8° | 109.3° |
| C5 | C1 | O1 | 112.4° | 109.5° |
| C1 | C5 | H4 | 104.9° | 109.5° |
| C5 | C1 | H16 | 107.0° | 109.5° |
| O4 | C6 | H5 | 109.0° | 109.5° |
| O4 | C6 | H6 | 109.0° | 109.4° |
| C6 | O4 | H21 | 109.5° | 114.0° |
| C1 | C2 | O2 | 113.2° | 109.5° |
| C2 | C1 | O1 | 106.1° | 109.5° |
| C2 | C1 | H16 | 108.4° | 109.6° |
| C1 | C2 | H17 | 105.4° | 109.5° |
| O2 | C2 | H17 | 105.2° | 109.5° |
| C2 | O2 | H18 | 109.5° | 114.0° |
| C1 | O1 | H15 | 109.5° | 114.0° |
| O1 | C1 | H16 | 109.1° | 109.5° |
| H2 | C4 | H3 | 109.5° | 109.4° |
| H5 | C6 | H6 | 109.5° | 109.5° |
| H7 | C7 | H8 | 109.5° | 109.5° |
| H23 | C12 | H24 | 109.5° | 109.4° |
| H27 | C16 | H28 | 109.5° | 109.5° |
| H27 | C16 | H29 | 109.4° | 109.4° |
| H28 | C16 | H29 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | C15 | C14 | C17 | 178.2° | 180.0° |
| C16 | C15 | C14 | C13 | 179.0° | 180.0° |
| C16 | C15 | C17 | C18 | 179.1° | 179.8° |
| C16 | C15 | C17 | H10 | 1.0° | 0.1° |
| C16 | C15 | C14 | H26 | 1.0° | 0.0° |
| C15 | C16 | H27 | H28 | 120.0° | 120.0° |
| C15 | C16 | H27 | H29 | 120.0° | 120.0° |
| C15 | C16 | H28 | H29 | 120.0° | 120.1° |
| C15 | C14 | C13 | H26 | 180.0° | 180.0° |
| C14 | C15 | C17 | C18 | 0.7° | 0.2° |
| C15 | C14 | C13 | N2 | 178.3° | 180.0° |
| C15 | C14 | C13 | C23 | 1.3° | 0.3° |
| C14 | C15 | C17 | H10 | 179.3° | 180.0° |
| C14 | C15 | C16 | H27 | 89.0° | 90.0° |
| C14 | C15 | C16 | H28 | 150.9° | 150.0° |
| C14 | C15 | C16 | H29 | 31.0° | 30.0° |
| C17 | C15 | C14 | C13 | 0.7° | 0.1° |
| C15 | C17 | C18 | H10 | 180.0° | 179.9° |
| C15 | C17 | C18 | C23 | 1.2° | 0.2° |
| C15 | C17 | C18 | C19 | 179.8° | 180.0° |
| C17 | C15 | C14 | H26 | 179.3° | 180.0° |
| C17 | C15 | C16 | H27 | 89.3° | 90.0° |
| C17 | C15 | C16 | H28 | 30.8° | 30.0° |
| C17 | C15 | C16 | H29 | 150.7° | 150.1° |
| C14 | C13 | N2 | C23 | 179.6° | 179.7° |
| C14 | C13 | N2 | C12 | 177.8° | 0.3° |
| C14 | C13 | C23 | C18 | 1.8° | 0.3° |
| C14 | C13 | N2 | H25 | 56.8° | 179.7° |
| C14 | C13 | C23 | H30 | 178.2° | 179.7° |
| C17 | C18 | C23 | C13 | 1.7° | 0.0° |
| C17 | C18 | C23 | C19 | 179.0° | 179.8° |
| C17 | C18 | C19 | C20 | 10.0° | 4.9° |
| C17 | C18 | C19 | N4 | 170.6° | 175.0° |
| C17 | C18 | C23 | H30 | 178.4° | 179.9° |
| C13 | N2 | C12 | H25 | 121.0° | 180.0° |
| N2 | C13 | C23 | C18 | 177.8° | 180.0° |
| C13 | N2 | C12 | C11 | 85.1° | 180.0° |
| C13 | N2 | C12 | H23 | 34.7° | 60.0° |
| C13 | N2 | C12 | H24 | 155.0° | 60.0° |
| N2 | C13 | C14 | H26 | 1.7° | 0.0° |
| N2 | C13 | C23 | H30 | 2.2° | 0.0° |
| C23 | C13 | N2 | C12 | 2.5° | 180.0° |
| C13 | C23 | C18 | H30 | 180.0° | 180.0° |
| C13 | C23 | C18 | C19 | 179.3° | 179.7° |
| C23 | C13 | N2 | H25 | 123.6° | 0.0° |
| C23 | C13 | C14 | H26 | 178.7° | 179.7° |
| N2 | C12 | C11 | H23 | 119.8° | 120.0° |
| N2 | C12 | C11 | H24 | 119.8° | 120.0° |
| N2 | C12 | C11 | C10 | 27.8° | 90.0° |
| N2 | C12 | C11 | C24 | 156.9° | 89.7° |
| N2 | C12 | H23 | H24 | 120.5° | 120.0° |
| C23 | C18 | C19 | C20 | 169.0° | 175.3° |
| C23 | C18 | C19 | N4 | 10.4° | 4.8° |
| C23 | C18 | C17 | H10 | 178.8° | 179.9° |
| C18 | C19 | C20 | N4 | 179.4° | 180.0° |
| C18 | C19 | C20 | C21 | 180.0° | 180.0° |
| C18 | C19 | N4 | N3 | 179.0° | 179.9° |
| C19 | C18 | C17 | H10 | 0.2° | 0.2° |
| C18 | C19 | C20 | H11 | 0.0° | 0.1° |
| C19 | C18 | C23 | H30 | 0.7° | 0.3° |
| C19 | C20 | C21 | H11 | 180.0° | 179.9° |
| C19 | C20 | C21 | C22 | 1.2° | 0.0° |
| C20 | C19 | N4 | N3 | 1.6° | 0.0° |
| C19 | C20 | C21 | H12 | 178.8° | 180.0° |
| C21 | C20 | C19 | N4 | 0.6° | 0.0° |
| C20 | C21 | C22 | H12 | 180.0° | 180.0° |
| C20 | C21 | C22 | N3 | 2.0° | 0.0° |
| C20 | C21 | C22 | H13 | 178.0° | 179.9° |
| C12 | C11 | C10 | C24 | 175.4° | 179.7° |
| C12 | C11 | C10 | C9 | 177.4° | 180.0° |
| C12 | C11 | C24 | C25 | 178.8° | 180.0° |
| C12 | C11 | C10 | H9 | 2.6° | 0.1° |
| C12 | C11 | C24 | H14 | 1.2° | 0.0° |
| C11 | C12 | H23 | H24 | 120.5° | 120.0° |
| C11 | C12 | N2 | H25 | 153.8° | 0.0° |
| C19 | N4 | N3 | C22 | 0.8° | 0.1° |
| N4 | C19 | C20 | H11 | 179.4° | 179.9° |
| C21 | C22 | N3 | N4 | 1.0° | 0.1° |
| C21 | C22 | N3 | H13 | 180.0° | 179.9° |
| C22 | C21 | C20 | H11 | 178.8° | 179.9° |
| N4 | N3 | C22 | H13 | 179.0° | 180.0° |
| N3 | C22 | C21 | H12 | 178.1° | 180.0° |
| C11 | C10 | C9 | H9 | 180.0° | 179.9° |
| C10 | C11 | C24 | C25 | 3.6° | 0.3° |
| C11 | C10 | C9 | C8 | 0.0° | 0.0° |
| C10 | C11 | C24 | H14 | 176.4° | 179.7° |
| C11 | C10 | C9 | H22 | 179.9° | 180.0° |
| C10 | C11 | C12 | H23 | 147.6° | 150.0° |
| C10 | C11 | C12 | H24 | 92.1° | 30.1° |
| C24 | C11 | C10 | C9 | 2.0° | 0.3° |
| C11 | C24 | C25 | H14 | 180.0° | 180.0° |
| C11 | C24 | C25 | C8 | 2.8° | 0.0° |
| C24 | C11 | C10 | H9 | 178.0° | 179.8° |
| C24 | C11 | C12 | H23 | 37.1° | 30.3° |
| C24 | C11 | C12 | H24 | 83.2° | 150.2° |
| C11 | C24 | C25 | H31 | 177.1° | 180.0° |
| C10 | C9 | C8 | H22 | 180.0° | 180.0° |
| C10 | C9 | C8 | C25 | 0.7° | 0.3° |
| C10 | C9 | C8 | C7 | 179.2° | 179.9° |
| C24 | C25 | C8 | C9 | 0.7° | 0.3° |
| C24 | C25 | C8 | H31 | 180.0° | 180.0° |
| C24 | C25 | C8 | C7 | 177.7° | 180.0° |
| C9 | C8 | C25 | C7 | 178.4° | 179.6° |
| C9 | C8 | C7 | N1 | 85.2° | 90.0° |
| C9 | C8 | C7 | H7 | 35.5° | 29.9° |
| C9 | C8 | C7 | H8 | 154.2° | 150.0° |
| C8 | C9 | C10 | H9 | 179.9° | 179.9° |
| C9 | C8 | C25 | H31 | 179.3° | 179.7° |
| C25 | C8 | C7 | N1 | 93.3° | 90.4° |
| C25 | C8 | C7 | H7 | 146.1° | 149.7° |
| C25 | C8 | C7 | H8 | 27.3° | 29.7° |
| C8 | C25 | C24 | H14 | 177.2° | 180.0° |
| C25 | C8 | C9 | H22 | 179.3° | 179.7° |
| C8 | C7 | N1 | H7 | 120.6° | 120.0° |
| C8 | C7 | N1 | H8 | 120.6° | 120.1° |
| C8 | C7 | N1 | C4 | 63.2° | 62.3° |
| C8 | C7 | N1 | C5 | 174.1° | 173.4° |
| C8 | C7 | H7 | H8 | 118.0° | 120.1° |
| C7 | C8 | C9 | H22 | 0.8° | 0.1° |
| C7 | C8 | C25 | H31 | 2.3° | 0.0° |
| C7 | N1 | C4 | C5 | 124.3° | 124.2° |
| C7 | N1 | C4 | C3 | 179.1° | 174.1° |
| C7 | N1 | C5 | C6 | 54.7° | 54.0° |
| C7 | N1 | C5 | C1 | 175.0° | 174.1° |
| C7 | N1 | C4 | H2 | 58.1° | 65.8° |
| C7 | N1 | C4 | H3 | 59.9° | 54.1° |
| C7 | N1 | C5 | H4 | 62.9° | 65.8° |
| N1 | C7 | H7 | H8 | 118.1° | 120.0° |
| N1 | C4 | C3 | H2 | 121.0° | 120.0° |
| N1 | C4 | C3 | H3 | 121.0° | 120.1° |
| N1 | C4 | C3 | O3 | 174.3° | 179.1° |
| N1 | C4 | C3 | C2 | 52.9° | 59.2° |
| C4 | N1 | C5 | C6 | 177.9° | 178.2° |
| C4 | N1 | C5 | C1 | 51.7° | 61.7° |
| N1 | C4 | H2 | H3 | 116.8° | 120.0° |
| C4 | N1 | C5 | H4 | 60.4° | 58.4° |
| C4 | N1 | C7 | H7 | 176.2° | 57.6° |
| C4 | N1 | C7 | H8 | 57.4° | 177.6° |
| N1 | C4 | C3 | H19 | 68.5° | 60.8° |
| C3 | C4 | N1 | C5 | 54.8° | 61.7° |
| C4 | C3 | O3 | C2 | 122.7° | 119.8° |
| C4 | C3 | O3 | H19 | 117.0° | 120.1° |
| C4 | C3 | C2 | H19 | 121.1° | 120.0° |
| C4 | C3 | C2 | C1 | 49.0° | 57.7° |
| C4 | C3 | C2 | O2 | 179.4° | 177.5° |
| C3 | C4 | H2 | H3 | 116.8° | 119.9° |
| C4 | C3 | C2 | H17 | 66.0° | 62.3° |
| C4 | C3 | O3 | H20 | 180.0° | 60.0° |
| N1 | C5 | C6 | C1 | 127.7° | 120.1° |
| N1 | C5 | C6 | H4 | 117.0° | 119.9° |
| N1 | C5 | C1 | H4 | 112.5° | 120.0° |
| N1 | C5 | C6 | O4 | 104.2° | 63.5° |
| N1 | C5 | C1 | C2 | 51.9° | 59.1° |
| N1 | C5 | C1 | O1 | 172.5° | 179.1° |
| C5 | N1 | C4 | H2 | 66.2° | 58.4° |
| C5 | N1 | C4 | H3 | 175.8° | 178.3° |
| N1 | C5 | C6 | H5 | 135.5° | 56.5° |
| N1 | C5 | C6 | H6 | 16.1° | 176.5° |
| C5 | N1 | C7 | H7 | 53.5° | 66.7° |
| C5 | N1 | C7 | H8 | 65.3° | 53.3° |
| N1 | C5 | C1 | H16 | 67.7° | 60.9° |
| O3 | C3 | C2 | H19 | 120.3° | 120.1° |
| O3 | C3 | C2 | C1 | 167.7° | 177.6° |
| O3 | C3 | C2 | O2 | 61.9° | 62.5° |
| O3 | C3 | C4 | H2 | 53.3° | 59.1° |
| O3 | C3 | C4 | H3 | 64.7° | 60.8° |
| O3 | C3 | C2 | H17 | 52.6° | 57.7° |
| C3 | C2 | C1 | C5 | 50.7° | 57.6° |
| C3 | C2 | C1 | O2 | 130.3° | 119.9° |
| C3 | C2 | C1 | H17 | 115.3° | 120.0° |
| C3 | C2 | O2 | H17 | 114.9° | 120.3° |
| C3 | C2 | C1 | O1 | 174.8° | 177.6° |
| C2 | C3 | C4 | H2 | 68.1° | 60.9° |
| C2 | C3 | C4 | H3 | 173.9° | 179.2° |
| C3 | C2 | C1 | H16 | 68.1° | 62.3° |
| C3 | C2 | O2 | H18 | 180.0° | 60.3° |
| C2 | C3 | O3 | H20 | 57.4° | 179.8° |
| C6 | C5 | C1 | H4 | 116.2° | 119.9° |
| C5 | C6 | O4 | H5 | 120.3° | 120.1° |
| C5 | C6 | O4 | H6 | 120.3° | 119.9° |
| C6 | C5 | C1 | C2 | 176.8° | 179.2° |
| C6 | C5 | C1 | O1 | 56.2° | 60.8° |
| C5 | C6 | H5 | H6 | 119.1° | 120.0° |
| C6 | C5 | C1 | H16 | 63.6° | 59.2° |
| C5 | C6 | O4 | H21 | 180.0° | 180.0° |
| C1 | C5 | C6 | O4 | 128.1° | 56.6° |
| C5 | C1 | C2 | O1 | 124.1° | 120.0° |
| C5 | C1 | C2 | H16 | 118.9° | 120.0° |
| C5 | C1 | C2 | O2 | 179.0° | 177.5° |
| C5 | C1 | O1 | H16 | 118.5° | 120.0° |
| C1 | C5 | C6 | H5 | 7.8° | 176.6° |
| C1 | C5 | C6 | H6 | 111.6° | 63.3° |
| C5 | C1 | O1 | H15 | 180.0° | 180.0° |
| C5 | C1 | C2 | H17 | 64.5° | 62.4° |
| O4 | C6 | C5 | H4 | 12.8° | 176.6° |
| O4 | C6 | H5 | H6 | 119.1° | 120.0° |
| C1 | C2 | O2 | H17 | 114.6° | 120.1° |
| C2 | C1 | O1 | H16 | 116.6° | 120.1° |
| C2 | C1 | C5 | H4 | 60.6° | 60.9° |
| C2 | C1 | O1 | H15 | 55.1° | 60.2° |
| C1 | C2 | O2 | H18 | 49.6° | 180.0° |
| C1 | C2 | C3 | H19 | 72.1° | 62.3° |
| O2 | C2 | C1 | O1 | 54.9° | 62.5° |
| O2 | C2 | C1 | H16 | 62.2° | 57.6° |
| O2 | C2 | C3 | H19 | 58.3° | 57.6° |
| O1 | C1 | C5 | H4 | 60.0° | 59.1° |
| O1 | C1 | C2 | H17 | 59.5° | 57.6° |
| H2 | C4 | C3 | H19 | 170.5° | 179.2° |
| H3 | C4 | C3 | H19 | 52.5° | 59.3° |
| H4 | C5 | C6 | H5 | 107.5° | 63.4° |
| H4 | C5 | C6 | H6 | 133.1° | 56.7° |
| H4 | C5 | C1 | H16 | 179.8° | 179.1° |
| H5 | C6 | O4 | H21 | 59.7° | 60.0° |
| H6 | C6 | O4 | H21 | 59.7° | 60.0° |
| H9 | C10 | C9 | H22 | 0.1° | 0.1° |
| H11 | C20 | C21 | H12 | 1.1° | 0.0° |
| H12 | C21 | C22 | H13 | 2.0° | 0.1° |
| H14 | C24 | C25 | H31 | 2.9° | 0.0° |
| H15 | O1 | C1 | H16 | 61.4° | 60.0° |
| H16 | C1 | C2 | H17 | 176.6° | 177.7° |
| H17 | C2 | O2 | H18 | 65.0° | 59.9° |
| H17 | C2 | C3 | H19 | 172.9° | 177.8° |
| H19 | C3 | O3 | H20 | 63.0° | 60.2° |
| H23 | C12 | N2 | H25 | 86.4° | 120.0° |
| H24 | C12 | N2 | H25 | 34.0° | 120.0° |
| H27 | C16 | H28 | H29 | 119.9° | 120.0° |
