4U8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C9 | sing | 1.53Å | 1.54Å | |
| C11 | C9 | sing | 1.53Å | 1.55Å | |
| C12 | C9 | sing | 1.53Å | 1.55Å | |
| C9 | C6 | sing | 1.51Å | 1.55Å | |
| C6 | C7 | doub | 1.38Å | 1.41Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.41Å | Aromatic |
| C7 | C8 | sing | 1.38Å | 1.40Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.41Å | Aromatic |
| C8 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
| C4 | C3 | sing | 1.39Å | 1.41Å | Aromatic |
| C3 | C2 | sing | 1.48Å | 1.48Å | |
| C2 | C1 | doub | 1.40Å | 1.40Å | Aromatic |
| C2 | C13 | sing | 1.39Å | 1.41Å | Aromatic |
| C1 | C18 | sing | 1.36Å | 1.40Å | Aromatic |
| C13 | C14 | doub | 1.40Å | 1.41Å | Aromatic |
| C18 | C17 | doub | 1.39Å | 1.41Å | Aromatic |
| C14 | C17 | sing | 1.41Å | 1.40Å | Aromatic |
| C14 | C15 | sing | 1.42Å | 1.41Å | Aromatic |
| C17 | N1 | sing | 1.38Å | 1.40Å | Aromatic |
| C15 | C16 | doub | 1.36Å | 1.39Å | Aromatic |
| N1 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| N1 | C19 | sing | 1.40Å | 1.43Å | |
| C16 | C28 | sing | 1.47Å | 1.45Å | |
| C20 | C19 | doub | 1.39Å | 1.40Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | C24 | sing | 1.39Å | 1.40Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.40Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.41Å | Aromatic |
| C28 | O3 | doub | 1.22Å | 1.22Å | |
| C28 | O2 | sing | 1.35Å | 1.35Å | |
| C22 | C23 | sing | 1.39Å | 1.40Å | Aromatic |
| C22 | O1 | sing | 1.36Å | 1.37Å | |
| C25 | O1 | sing | 1.43Å | 1.44Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C25 | C27 | sing | 1.53Å | 1.53Å | |
| C7 | H1 | sing | 1.08Å | 1.08Å | |
| O2 | H2 | sing | 0.97Å | 0.95Å | |
| C1 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C4 | H5 | sing | 1.08Å | 1.08Å | |
| C15 | H6 | sing | 1.08Å | 1.08Å | |
| C24 | H7 | sing | 1.08Å | 1.08Å | |
| C23 | H8 | sing | 1.08Å | 1.08Å | |
| C25 | H9 | sing | 1.09Å | 1.10Å | |
| C27 | H10 | sing | 1.09Å | 1.10Å | |
| C27 | H11 | sing | 1.09Å | 1.10Å | |
| C27 | H12 | sing | 1.09Å | 1.10Å | |
| C26 | H13 | sing | 1.09Å | 1.10Å | |
| C26 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.08Å | 1.08Å | |
| C20 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C13 | H19 | sing | 1.08Å | 1.08Å | |
| C8 | H20 | sing | 1.08Å | 1.08Å | |
| C12 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C11 | H24 | sing | 1.09Å | 1.10Å | |
| C11 | H25 | sing | 1.09Å | 1.10Å | |
| C11 | H26 | sing | 1.09Å | 1.10Å | |
| C10 | H27 | sing | 1.09Å | 1.10Å | |
| C10 | H28 | sing | 1.09Å | 1.10Å | |
| C10 | H29 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C9 | C11 | 108.8° | 109.5° |
| C10 | C9 | C12 | 106.6° | 109.5° |
| C10 | C9 | C6 | 109.5° | 109.5° |
| C9 | C10 | H27 | 109.5° | 109.5° |
| C9 | C10 | H28 | 109.5° | 109.5° |
| C9 | C10 | H29 | 109.5° | 109.5° |
| C11 | C9 | C12 | 105.9° | 109.5° |
| C11 | C9 | C6 | 111.3° | 109.4° |
| C9 | C11 | H24 | 109.5° | 109.5° |
| C9 | C11 | H25 | 109.4° | 109.5° |
| C9 | C11 | H26 | 109.5° | 109.5° |
| C12 | C9 | C6 | 114.5° | 109.5° |
| C9 | C12 | H21 | 109.5° | 109.5° |
| C9 | C12 | H22 | 109.5° | 109.5° |
| C9 | C12 | H23 | 109.5° | 109.5° |
| C9 | C6 | C7 | 120.9° | 119.8° |
| C9 | C6 | C5 | 122.7° | 119.9° |
| C7 | C6 | C5 | 116.4° | 120.3° |
| C6 | C7 | C8 | 121.9° | 120.1° |
| C6 | C7 | H1 | 119.0° | 120.0° |
| C6 | C5 | C4 | 121.7° | 120.1° |
| C6 | C5 | H4 | 119.1° | 120.0° |
| C7 | C8 | C3 | 121.2° | 119.9° |
| C8 | C7 | H1 | 119.1° | 120.0° |
| C7 | C8 | H20 | 119.4° | 120.0° |
| C5 | C4 | C3 | 121.4° | 119.9° |
| C4 | C5 | H4 | 119.2° | 119.9° |
| C5 | C4 | H5 | 119.3° | 120.1° |
| C8 | C3 | C4 | 117.4° | 119.8° |
| C8 | C3 | C2 | 121.2° | 120.1° |
| C3 | C8 | H20 | 119.4° | 120.1° |
| C4 | C3 | C2 | 121.4° | 120.1° |
| C3 | C4 | H5 | 119.3° | 120.0° |
| C3 | C2 | C1 | 121.2° | 119.9° |
| C3 | C2 | C13 | 120.7° | 119.9° |
| C1 | C2 | C13 | 118.1° | 120.2° |
| C2 | C1 | C18 | 121.8° | 120.7° |
| C2 | C1 | H3 | 119.1° | 119.7° |
| C2 | C13 | C14 | 121.0° | 119.5° |
| C2 | C13 | H19 | 119.5° | 120.3° |
| C1 | C18 | C17 | 119.2° | 120.2° |
| C18 | C1 | H3 | 119.1° | 119.6° |
| C1 | C18 | H18 | 120.4° | 119.9° |
| C13 | C14 | C17 | 119.6° | 119.7° |
| C13 | C14 | C15 | 133.2° | 133.3° |
| C14 | C13 | H19 | 119.5° | 120.3° |
| C18 | C17 | C14 | 120.3° | 119.7° |
| C18 | C17 | N1 | 131.9° | 133.0° |
| C17 | C18 | H18 | 120.4° | 119.9° |
| C17 | C14 | C15 | 107.2° | 107.0° |
| C14 | C17 | N1 | 107.9° | 107.3° |
| C14 | C15 | C16 | 109.1° | 107.8° |
| C14 | C15 | H6 | 125.5° | 126.1° |
| C17 | N1 | C16 | 108.5° | 108.8° |
| C17 | N1 | C19 | 123.3° | 125.6° |
| C15 | C16 | N1 | 107.3° | 109.1° |
| C15 | C16 | C28 | 125.2° | 125.5° |
| C16 | C15 | H6 | 125.4° | 126.1° |
| C16 | N1 | C19 | 127.6° | 125.6° |
| N1 | C16 | C28 | 127.5° | 125.5° |
| N1 | C19 | C20 | 120.0° | 120.0° |
| N1 | C19 | C24 | 120.9° | 120.0° |
| C16 | C28 | O3 | 125.6° | 120.0° |
| C16 | C28 | O2 | 112.3° | 120.0° |
| C19 | C20 | C21 | 120.2° | 120.0° |
| C20 | C19 | C24 | 119.1° | 120.0° |
| C19 | C20 | H17 | 119.9° | 120.0° |
| C20 | C21 | C22 | 121.1° | 120.0° |
| C20 | C21 | H16 | 119.5° | 120.1° |
| C21 | C20 | H17 | 119.9° | 120.0° |
| C19 | C24 | C23 | 120.3° | 120.0° |
| C19 | C24 | H7 | 119.8° | 120.0° |
| C21 | C22 | C23 | 118.5° | 120.0° |
| C21 | C22 | O1 | 117.1° | 119.9° |
| C22 | C21 | H16 | 119.5° | 120.0° |
| C24 | C23 | C22 | 120.8° | 120.0° |
| C23 | C24 | H7 | 119.8° | 120.0° |
| C24 | C23 | H8 | 119.6° | 120.0° |
| O3 | C28 | O2 | 120.7° | 120.0° |
| C28 | O2 | H2 | 109.5° | 117.0° |
| C23 | C22 | O1 | 124.4° | 120.0° |
| C22 | C23 | H8 | 119.6° | 119.9° |
| C22 | O1 | C25 | 124.2° | 117.0° |
| O1 | C25 | C26 | 106.0° | 109.4° |
| O1 | C25 | C27 | 110.7° | 109.5° |
| O1 | C25 | H9 | 111.1° | 109.5° |
| C26 | C25 | C27 | 109.4° | 109.5° |
| C26 | C25 | H9 | 109.8° | 109.4° |
| C25 | C26 | H13 | 109.5° | 109.4° |
| C25 | C26 | H14 | 109.5° | 109.5° |
| C25 | C26 | H15 | 109.5° | 109.5° |
| C27 | C25 | H9 | 109.8° | 109.5° |
| C25 | C27 | H10 | 109.5° | 109.5° |
| C25 | C27 | H11 | 109.4° | 109.5° |
| C25 | C27 | H12 | 109.5° | 109.5° |
| H10 | C27 | H11 | 109.4° | 109.5° |
| H10 | C27 | H12 | 109.5° | 109.5° |
| H11 | C27 | H12 | 109.5° | 109.4° |
| H13 | C26 | H14 | 109.5° | 109.5° |
| H13 | C26 | H15 | 109.5° | 109.4° |
| H14 | C26 | H15 | 109.5° | 109.5° |
| H21 | C12 | H22 | 109.5° | 109.5° |
| H21 | C12 | H23 | 109.5° | 109.5° |
| H22 | C12 | H23 | 109.5° | 109.5° |
| H24 | C11 | H25 | 109.4° | 109.5° |
| H24 | C11 | H26 | 109.5° | 109.5° |
| H25 | C11 | H26 | 109.5° | 109.5° |
| H27 | C10 | H28 | 109.5° | 109.5° |
| H27 | C10 | H29 | 109.5° | 109.5° |
| H28 | C10 | H29 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C9 | C11 | C12 | 114.2° | 120.0° |
| C10 | C9 | C11 | C6 | 120.7° | 120.0° |
| C10 | C9 | C12 | C6 | 121.3° | 120.0° |
| C10 | C9 | C6 | C7 | 102.6° | 60.0° |
| C10 | C9 | C6 | C5 | 77.1° | 120.0° |
| C10 | C9 | C12 | H21 | 180.0° | 180.0° |
| C10 | C9 | C12 | H22 | 60.0° | 60.0° |
| C10 | C9 | C12 | H23 | 60.0° | 60.0° |
| C10 | C9 | C11 | H24 | 180.0° | 60.0° |
| C10 | C9 | C11 | H25 | 60.0° | 60.0° |
| C10 | C9 | C11 | H26 | 60.0° | 180.0° |
| C9 | C10 | H27 | H28 | 120.0° | 120.0° |
| C9 | C10 | H27 | H29 | 120.0° | 120.0° |
| C9 | C10 | H28 | H29 | 120.0° | 120.0° |
| C11 | C9 | C12 | C6 | 123.0° | 120.0° |
| C11 | C9 | C6 | C7 | 17.6° | 180.0° |
| C11 | C9 | C6 | C5 | 162.6° | 0.0° |
| C11 | C9 | C12 | H21 | 64.3° | 60.0° |
| C11 | C9 | C12 | H22 | 55.7° | 60.0° |
| C11 | C9 | C12 | H23 | 175.7° | 180.0° |
| C9 | C11 | H24 | H25 | 120.0° | 120.0° |
| C9 | C11 | H24 | H26 | 120.0° | 120.0° |
| C9 | C11 | H25 | H26 | 120.0° | 120.0° |
| C11 | C9 | C10 | H27 | 180.0° | 180.0° |
| C11 | C9 | C10 | H28 | 60.0° | 60.0° |
| C11 | C9 | C10 | H29 | 60.0° | 60.0° |
| C12 | C9 | C6 | C7 | 137.7° | 60.1° |
| C12 | C9 | C6 | C5 | 42.6° | 120.0° |
| C9 | C12 | H21 | H22 | 120.0° | 120.0° |
| C9 | C12 | H21 | H23 | 120.0° | 120.0° |
| C9 | C12 | H22 | H23 | 120.0° | 120.0° |
| C12 | C9 | C11 | H24 | 65.8° | 180.0° |
| C12 | C9 | C11 | H25 | 174.3° | 60.0° |
| C12 | C9 | C11 | H26 | 54.2° | 60.0° |
| C12 | C9 | C10 | H27 | 66.3° | 60.0° |
| C12 | C9 | C10 | H28 | 53.8° | 60.0° |
| C12 | C9 | C10 | H29 | 173.7° | 180.0° |
| C9 | C6 | C7 | C5 | 179.7° | 179.9° |
| C9 | C6 | C7 | C8 | 179.9° | 180.0° |
| C9 | C6 | C5 | C4 | 180.0° | 179.9° |
| C9 | C6 | C7 | H1 | 0.1° | 0.4° |
| C9 | C6 | C5 | H4 | 0.0° | 0.0° |
| C6 | C9 | C12 | H21 | 58.7° | 59.9° |
| C6 | C9 | C12 | H22 | 178.7° | 179.9° |
| C6 | C9 | C12 | H23 | 61.3° | 60.1° |
| C6 | C9 | C11 | H24 | 59.3° | 60.0° |
| C6 | C9 | C11 | H25 | 60.7° | 180.0° |
| C6 | C9 | C11 | H26 | 179.3° | 60.0° |
| C6 | C9 | C10 | H27 | 58.2° | 60.0° |
| C6 | C9 | C10 | H28 | 178.2° | 179.9° |
| C6 | C9 | C10 | H29 | 61.8° | 60.0° |
| C6 | C7 | C8 | H1 | 180.0° | 179.7° |
| C7 | C6 | C5 | C4 | 0.2° | 0.0° |
| C6 | C7 | C8 | C3 | 0.4° | 0.1° |
| C7 | C6 | C5 | H4 | 179.8° | 179.9° |
| C6 | C7 | C8 | H20 | 179.6° | 179.7° |
| C5 | C6 | C7 | C8 | 0.4° | 0.1° |
| C6 | C5 | C4 | H4 | 180.0° | 179.9° |
| C6 | C5 | C4 | C3 | 0.1° | 0.0° |
| C5 | C6 | C7 | H1 | 179.7° | 179.7° |
| C6 | C5 | C4 | H5 | 179.8° | 180.0° |
| C7 | C8 | C3 | H20 | 180.0° | 179.8° |
| C7 | C8 | C3 | C4 | 0.3° | 0.1° |
| C7 | C8 | C3 | C2 | 179.9° | 180.0° |
| C5 | C4 | C3 | C8 | 0.1° | 0.0° |
| C5 | C4 | C3 | H5 | 180.0° | 179.9° |
| C5 | C4 | C3 | C2 | 179.9° | 180.0° |
| C8 | C3 | C4 | C2 | 179.8° | 179.9° |
| C8 | C3 | C2 | C1 | 38.1° | 179.9° |
| C8 | C3 | C2 | C13 | 141.7° | 0.1° |
| C3 | C8 | C7 | H1 | 179.6° | 179.7° |
| C8 | C3 | C4 | H5 | 179.8° | 180.0° |
| C4 | C3 | C2 | C1 | 142.1° | 0.0° |
| C4 | C3 | C2 | C13 | 38.0° | 180.0° |
| C3 | C4 | C5 | H4 | 179.9° | 179.9° |
| C4 | C3 | C8 | H20 | 179.7° | 179.7° |
| C3 | C2 | C1 | C13 | 179.8° | 180.0° |
| C3 | C2 | C1 | C18 | 179.9° | 180.0° |
| C3 | C2 | C13 | C14 | 179.9° | 180.0° |
| C3 | C2 | C1 | H3 | 0.1° | 0.3° |
| C2 | C3 | C4 | H5 | 0.0° | 0.1° |
| C3 | C2 | C13 | H19 | 0.1° | 0.1° |
| C2 | C3 | C8 | H20 | 0.1° | 0.2° |
| C2 | C1 | C18 | H3 | 180.0° | 179.7° |
| C1 | C2 | C13 | C14 | 0.1° | 0.0° |
| C2 | C1 | C18 | C17 | 0.0° | 0.2° |
| C2 | C1 | C18 | H18 | 180.0° | 179.7° |
| C1 | C2 | C13 | H19 | 180.0° | 179.9° |
| C13 | C2 | C1 | C18 | 0.0° | 0.0° |
| C2 | C13 | C14 | H19 | 180.0° | 179.9° |
| C2 | C13 | C14 | C17 | 0.0° | 0.2° |
| C2 | C13 | C14 | C15 | 179.9° | 179.9° |
| C13 | C2 | C1 | H3 | 180.0° | 179.7° |
| C1 | C18 | C17 | H18 | 180.0° | 180.0° |
| C1 | C18 | C17 | C14 | 0.0° | 0.5° |
| C1 | C18 | C17 | N1 | 179.9° | 180.0° |
| C13 | C14 | C17 | C18 | 0.0° | 0.5° |
| C13 | C14 | C17 | C15 | 179.9° | 179.9° |
| C13 | C14 | C17 | N1 | 179.9° | 179.9° |
| C13 | C14 | C15 | C16 | 180.0° | 179.4° |
| C13 | C14 | C15 | H6 | 0.1° | 0.1° |
| C18 | C17 | C14 | N1 | 179.9° | 179.7° |
| C18 | C17 | C14 | C15 | 179.9° | 179.6° |
| C18 | C17 | N1 | C16 | 180.0° | 180.0° |
| C18 | C17 | N1 | C19 | 8.2° | 0.7° |
| C17 | C18 | C1 | H3 | 180.0° | 179.9° |
| C17 | C14 | C15 | C16 | 0.1° | 0.4° |
| C14 | C17 | N1 | C16 | 0.1° | 0.4° |
| C14 | C17 | N1 | C19 | 171.7° | 179.7° |
| C17 | C14 | C15 | H6 | 179.9° | 179.8° |
| C14 | C17 | C18 | H18 | 180.0° | 179.5° |
| C17 | C14 | C13 | H19 | 180.0° | 179.7° |
| C15 | C14 | C17 | N1 | 0.0° | 0.0° |
| C14 | C15 | C16 | H6 | 180.0° | 179.3° |
| C14 | C15 | C16 | N1 | 0.2° | 0.7° |
| C14 | C15 | C16 | C28 | 179.9° | 179.2° |
| C15 | C14 | C13 | H19 | 0.1° | 0.2° |
| C17 | N1 | C16 | C15 | 0.2° | 0.7° |
| C17 | N1 | C16 | C19 | 171.3° | 179.2° |
| C17 | N1 | C16 | C28 | 179.9° | 179.2° |
| C17 | N1 | C19 | C20 | 64.0° | 63.8° |
| C17 | N1 | C19 | C24 | 115.5° | 115.9° |
| N1 | C17 | C18 | H18 | 0.1° | 0.1° |
| C15 | C16 | N1 | C28 | 179.9° | 179.9° |
| C15 | C16 | N1 | C19 | 171.2° | 180.0° |
| C15 | C16 | C28 | O3 | 21.0° | 0.1° |
| C15 | C16 | C28 | O2 | 145.8° | 179.9° |
| C16 | N1 | C19 | C20 | 125.8° | 115.3° |
| C16 | N1 | C19 | C24 | 54.7° | 65.0° |
| N1 | C16 | C28 | O3 | 158.9° | 180.0° |
| N1 | C16 | C28 | O2 | 34.3° | 0.0° |
| N1 | C16 | C15 | H6 | 179.8° | 180.0° |
| C19 | N1 | C16 | C28 | 8.7° | 0.0° |
| N1 | C19 | C20 | C24 | 179.6° | 179.7° |
| N1 | C19 | C20 | C21 | 179.5° | 179.8° |
| N1 | C19 | C24 | C23 | 179.9° | 180.0° |
| N1 | C19 | C24 | H7 | 0.1° | 0.0° |
| N1 | C19 | C20 | H17 | 0.4° | 0.0° |
| C16 | C28 | O3 | O2 | 165.8° | 180.0° |
| C16 | C28 | O2 | H2 | 167.5° | 180.0° |
| C28 | C16 | C15 | H6 | 0.1° | 0.1° |
| C19 | C20 | C21 | H17 | 180.0° | 179.8° |
| C19 | C20 | C21 | C22 | 0.3° | 0.5° |
| C20 | C19 | C24 | C23 | 0.4° | 0.3° |
| C20 | C19 | C24 | H7 | 179.7° | 179.8° |
| C19 | C20 | C21 | H16 | 179.7° | 179.7° |
| C21 | C20 | C19 | C24 | 0.0° | 0.5° |
| C20 | C21 | C22 | H16 | 180.0° | 179.8° |
| C20 | C21 | C22 | C23 | 0.2° | 0.3° |
| C20 | C21 | C22 | O1 | 179.7° | 179.8° |
| C19 | C24 | C23 | H7 | 180.0° | 180.0° |
| C19 | C24 | C23 | C22 | 0.4° | 0.1° |
| C19 | C24 | C23 | H8 | 179.6° | 180.0° |
| C24 | C19 | C20 | H17 | 180.0° | 179.8° |
| C21 | C22 | C23 | C24 | 0.1° | 0.1° |
| C21 | C22 | C23 | O1 | 179.9° | 180.0° |
| C21 | C22 | O1 | C25 | 0.2° | 174.5° |
| C21 | C22 | C23 | H8 | 179.9° | 180.0° |
| C22 | C21 | C20 | H17 | 179.7° | 179.8° |
| C24 | C23 | C22 | H8 | 180.0° | 179.9° |
| C24 | C23 | C22 | O1 | 180.0° | 180.0° |
| O3 | C28 | O2 | H2 | 0.0° | 0.0° |
| C23 | C22 | O1 | C25 | 179.7° | 5.5° |
| C22 | C23 | C24 | H7 | 179.6° | 180.0° |
| C23 | C22 | C21 | H16 | 179.8° | 179.9° |
| C22 | O1 | C25 | C26 | 156.7° | 84.9° |
| C22 | O1 | C25 | C27 | 84.8° | 155.1° |
| O1 | C22 | C23 | H8 | 0.0° | 0.0° |
| C22 | O1 | C25 | H9 | 37.4° | 35.1° |
| O1 | C22 | C21 | H16 | 0.3° | 0.1° |
| O1 | C25 | C26 | C27 | 119.4° | 120.0° |
| O1 | C25 | C26 | H9 | 120.0° | 120.0° |
| O1 | C25 | C27 | H9 | 123.0° | 120.1° |
| O1 | C25 | C27 | H10 | 180.0° | 59.9° |
| O1 | C25 | C27 | H11 | 60.0° | 180.0° |
| O1 | C25 | C27 | H12 | 60.0° | 60.0° |
| O1 | C25 | C26 | H13 | 180.0° | 60.1° |
| O1 | C25 | C26 | H14 | 60.0° | 60.0° |
| O1 | C25 | C26 | H15 | 60.0° | 180.0° |
| C26 | C25 | C27 | H9 | 120.6° | 119.9° |
| C26 | C25 | C27 | H10 | 63.6° | 60.1° |
| C26 | C25 | C27 | H11 | 176.4° | 60.0° |
| C26 | C25 | C27 | H12 | 56.5° | 180.0° |
| C25 | C26 | H13 | H14 | 120.0° | 120.0° |
| C25 | C26 | H13 | H15 | 120.0° | 119.9° |
| C25 | C26 | H14 | H15 | 120.0° | 120.0° |
| C25 | C27 | H10 | H11 | 120.0° | 120.0° |
| C25 | C27 | H10 | H12 | 120.0° | 120.0° |
| C25 | C27 | H11 | H12 | 120.0° | 120.0° |
| C27 | C25 | C26 | H13 | 60.6° | 60.0° |
| C27 | C25 | C26 | H14 | 59.4° | 180.0° |
| C27 | C25 | C26 | H15 | 179.4° | 59.9° |
| H1 | C7 | C8 | H20 | 0.4° | 0.0° |
| H3 | C1 | C18 | H18 | 0.0° | 0.0° |
| H4 | C5 | C4 | H5 | 0.1° | 0.0° |
| H7 | C24 | C23 | H8 | 0.4° | 0.0° |
| H9 | C25 | C27 | H10 | 57.0° | 180.0° |
| H9 | C25 | C27 | H11 | 63.0° | 60.0° |
| H9 | C25 | C27 | H12 | 177.0° | 60.0° |
| H9 | C25 | C26 | H13 | 60.0° | 179.9° |
| H9 | C25 | C26 | H14 | 180.0° | 60.0° |
| H9 | C25 | C26 | H15 | 60.1° | 60.0° |
| H10 | C27 | H11 | H12 | 120.0° | 120.0° |
| H13 | C26 | H14 | H15 | 120.0° | 120.0° |
| H16 | C21 | C20 | H17 | 0.3° | 0.1° |
| H21 | C12 | H22 | H23 | 120.0° | 120.0° |
| H24 | C11 | H25 | H26 | 120.0° | 120.0° |
| H27 | C10 | H28 | H29 | 120.0° | 120.0° |
