W12
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C28 | C26 | sing | 1.53Å | 1.51Å | |
| C15 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C26 | sing | 1.53Å | 1.50Å | |
| C12 | C10 | sing | 1.53Å | 1.52Å | |
| C27 | C25 | sing | 1.53Å | 1.51Å | |
| C11 | C10 | sing | 1.53Å | 1.54Å | |
| C11 | C25 | sing | 1.53Å | 1.53Å | |
| C10 | C13 | sing | 1.51Å | 1.50Å | |
| C10 | C7 | sing | 1.51Å | 1.51Å | |
| C13 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| O04 | C16 | sing | 1.36Å | 1.38Å | |
| O04 | C19 | sing | 1.43Å | 1.44Å | |
| C16 | C17 | doub | 1.39Å | 1.40Å | Aromatic |
| O05 | C20 | sing | 1.43Å | 1.43Å | |
| C20 | C19 | sing | 1.53Å | 1.52Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C18 | C17 | sing | 1.38Å | 1.41Å | Aromatic |
| C7 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | C6 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C6 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C21 | C24 | sing | 1.53Å | 1.52Å | |
| C21 | C23 | sing | 1.53Å | 1.53Å | |
| C9 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.38Å | Aromatic |
| C4 | O03 | sing | 1.36Å | 1.39Å | |
| O01 | C1 | sing | 1.43Å | 1.44Å | |
| C2 | O02 | sing | 1.43Å | 1.44Å | |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| O03 | C3 | sing | 1.43Å | 1.41Å | |
| C5 | H1 | sing | 1.08Å | 1.08Å | |
| C6 | H2 | sing | 1.08Å | 1.08Å | |
| C8 | H3 | sing | 1.08Å | 1.08Å | |
| C15 | H4 | sing | 1.08Å | 1.08Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C11 | H6 | sing | 1.09Å | 1.10Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.09Å | 1.10Å | |
| C22 | H9 | sing | 1.09Å | 1.10Å | |
| C22 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C24 | H13 | sing | 1.09Å | 1.10Å | |
| C26 | H14 | sing | 1.09Å | 1.10Å | |
| C26 | H15 | sing | 1.09Å | 1.10Å | |
| C28 | H16 | sing | 1.09Å | 1.10Å | |
| C28 | H17 | sing | 1.09Å | 1.10Å | |
| C28 | H18 | sing | 1.09Å | 1.10Å | |
| O01 | H19 | sing | 0.97Å | 0.95Å | |
| C1 | H20 | sing | 1.09Å | 1.10Å | |
| C1 | H21 | sing | 1.09Å | 1.10Å | |
| C2 | H22 | sing | 1.09Å | 1.10Å | |
| O02 | H23 | sing | 0.97Å | 0.95Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| C3 | H25 | sing | 1.09Å | 1.10Å | |
| C9 | H26 | sing | 1.08Å | 1.08Å | |
| C25 | H27 | sing | 1.09Å | 1.10Å | |
| C25 | H28 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C27 | H31 | sing | 1.09Å | 1.10Å | |
| C12 | H32 | sing | 1.09Å | 1.10Å | |
| C12 | H33 | sing | 1.09Å | 1.10Å | |
| C18 | H34 | sing | 1.08Å | 1.08Å | |
| C17 | H35 | sing | 1.08Å | 1.08Å | |
| C14 | H36 | sing | 1.08Å | 1.08Å | |
| C19 | H37 | sing | 1.09Å | 1.10Å | |
| C19 | H38 | sing | 1.09Å | 1.10Å | |
| O05 | H39 | sing | 0.97Å | 0.95Å | |
| C23 | H40 | sing | 1.09Å | 1.10Å | |
| C23 | H41 | sing | 1.09Å | 1.10Å | |
| C23 | H42 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C28 | C26 | C12 | 109.0° | 109.5° |
| C28 | C26 | H14 | 109.6° | 109.4° |
| C28 | C26 | H15 | 109.6° | 109.5° |
| C26 | C28 | H16 | 109.5° | 109.5° |
| C26 | C28 | H17 | 109.5° | 109.5° |
| C26 | C28 | H18 | 109.5° | 109.4° |
| C14 | C15 | C16 | 119.2° | 120.0° |
| C15 | C14 | C13 | 122.0° | 120.1° |
| C14 | C15 | H4 | 120.4° | 120.1° |
| C15 | C14 | H36 | 119.0° | 120.0° |
| C15 | C16 | O04 | 118.3° | 120.1° |
| C15 | C16 | C17 | 119.5° | 119.8° |
| C16 | C15 | H4 | 120.4° | 120.0° |
| C14 | C13 | C10 | 118.8° | 119.9° |
| C14 | C13 | C18 | 119.1° | 120.1° |
| C13 | C14 | H36 | 119.0° | 120.0° |
| C26 | C12 | C10 | 112.6° | 109.4° |
| C12 | C26 | H14 | 109.6° | 109.4° |
| C12 | C26 | H15 | 109.6° | 109.5° |
| C26 | C12 | H32 | 108.7° | 109.5° |
| C26 | C12 | H33 | 108.7° | 109.4° |
| C12 | C10 | C11 | 105.1° | 109.5° |
| C12 | C10 | C13 | 112.6° | 109.5° |
| C12 | C10 | C7 | 109.1° | 109.5° |
| C10 | C12 | H32 | 108.7° | 109.5° |
| C10 | C12 | H33 | 108.7° | 109.5° |
| C27 | C25 | C11 | 111.0° | 109.5° |
| C27 | C25 | H27 | 109.1° | 109.4° |
| C27 | C25 | H28 | 109.1° | 109.5° |
| C25 | C27 | H29 | 109.5° | 109.5° |
| C25 | C27 | H30 | 109.5° | 109.5° |
| C25 | C27 | H31 | 109.5° | 109.5° |
| C10 | C11 | C25 | 112.2° | 109.5° |
| C11 | C10 | C13 | 105.8° | 109.5° |
| C11 | C10 | C7 | 108.5° | 109.5° |
| C10 | C11 | H5 | 108.8° | 109.5° |
| C10 | C11 | H6 | 108.8° | 109.5° |
| C25 | C11 | H5 | 108.8° | 109.5° |
| C25 | C11 | H6 | 108.8° | 109.4° |
| C11 | C25 | H27 | 109.1° | 109.5° |
| C11 | C25 | H28 | 109.1° | 109.5° |
| C13 | C10 | C7 | 115.2° | 109.5° |
| C10 | C13 | C18 | 122.1° | 120.0° |
| C10 | C7 | C8 | 121.8° | 119.9° |
| C10 | C7 | C6 | 119.1° | 119.9° |
| C13 | C18 | C17 | 119.9° | 120.1° |
| C13 | C18 | H34 | 120.1° | 120.0° |
| C16 | O04 | C19 | 119.2° | 117.0° |
| O04 | C16 | C17 | 122.2° | 120.1° |
| O04 | C19 | C20 | 110.1° | 109.4° |
| O04 | C19 | H37 | 109.3° | 109.5° |
| O04 | C19 | H38 | 109.3° | 109.5° |
| C16 | C17 | C18 | 120.3° | 119.9° |
| C16 | C17 | H35 | 119.9° | 120.0° |
| O05 | C20 | C19 | 109.0° | 109.5° |
| O05 | C20 | C21 | 109.4° | 109.4° |
| O05 | C20 | H7 | 109.2° | 109.5° |
| C20 | O05 | H39 | 109.5° | 114.0° |
| C19 | C20 | C21 | 113.2° | 109.4° |
| C19 | C20 | H7 | 108.1° | 109.5° |
| C20 | C19 | H37 | 109.3° | 109.4° |
| C20 | C19 | H38 | 109.3° | 109.5° |
| C20 | C21 | C22 | 108.3° | 109.5° |
| C20 | C21 | C24 | 110.9° | 109.5° |
| C20 | C21 | C23 | 108.3° | 109.5° |
| C21 | C20 | H7 | 107.9° | 109.5° |
| C17 | C18 | H34 | 120.0° | 119.9° |
| C18 | C17 | H35 | 119.8° | 120.0° |
| C8 | C7 | C6 | 119.1° | 120.1° |
| C7 | C8 | C9 | 122.0° | 120.0° |
| C7 | C8 | H3 | 119.0° | 120.0° |
| C7 | C6 | C5 | 119.3° | 120.0° |
| C7 | C6 | H2 | 120.4° | 119.9° |
| C8 | C9 | C4 | 118.9° | 120.0° |
| C9 | C8 | H3 | 119.0° | 120.0° |
| C8 | C9 | H26 | 120.6° | 120.0° |
| C22 | C21 | C24 | 110.0° | 109.5° |
| C22 | C21 | C23 | 107.3° | 109.4° |
| C21 | C22 | H8 | 109.5° | 109.5° |
| C21 | C22 | H9 | 109.5° | 109.5° |
| C21 | C22 | H10 | 109.4° | 109.5° |
| C6 | C5 | C4 | 120.8° | 120.0° |
| C6 | C5 | H1 | 119.6° | 120.0° |
| C5 | C6 | H2 | 120.4° | 120.0° |
| C24 | C21 | C23 | 111.8° | 109.5° |
| C21 | C24 | H11 | 109.5° | 109.5° |
| C21 | C24 | H12 | 109.4° | 109.5° |
| C21 | C24 | H13 | 109.4° | 109.5° |
| C21 | C23 | H40 | 109.5° | 109.5° |
| C21 | C23 | H41 | 109.5° | 109.5° |
| C21 | C23 | H42 | 109.5° | 109.5° |
| C9 | C4 | C5 | 120.0° | 119.9° |
| C9 | C4 | O03 | 121.3° | 120.1° |
| C4 | C9 | H26 | 120.6° | 120.0° |
| C5 | C4 | O03 | 118.7° | 120.1° |
| C4 | C5 | H1 | 119.6° | 120.0° |
| C4 | O03 | C3 | 123.1° | 117.0° |
| O01 | C1 | C2 | 107.7° | 109.5° |
| C1 | O01 | H19 | 109.5° | 114.1° |
| O01 | C1 | H20 | 109.9° | 109.4° |
| O01 | C1 | H21 | 109.9° | 109.4° |
| O02 | C2 | C1 | 107.2° | 109.5° |
| O02 | C2 | C3 | 115.4° | 109.5° |
| O02 | C2 | H22 | 109.6° | 109.5° |
| C2 | O02 | H23 | 109.5° | 114.0° |
| C1 | C2 | C3 | 107.5° | 109.5° |
| C2 | C1 | H20 | 109.9° | 109.4° |
| C2 | C1 | H21 | 109.9° | 109.5° |
| C1 | C2 | H22 | 108.6° | 109.5° |
| C2 | C3 | O03 | 111.0° | 109.5° |
| C3 | C2 | H22 | 108.4° | 109.5° |
| C2 | C3 | H24 | 109.1° | 109.5° |
| C2 | C3 | H25 | 109.1° | 109.5° |
| O03 | C3 | H24 | 109.1° | 109.5° |
| O03 | C3 | H25 | 109.1° | 109.4° |
| H5 | C11 | H6 | 109.4° | 109.5° |
| H8 | C22 | H9 | 109.4° | 109.4° |
| H8 | C22 | H10 | 109.5° | 109.4° |
| H9 | C22 | H10 | 109.5° | 109.5° |
| H11 | C24 | H12 | 109.5° | 109.4° |
| H11 | C24 | H13 | 109.5° | 109.4° |
| H12 | C24 | H13 | 109.5° | 109.5° |
| H14 | C26 | H15 | 109.5° | 109.5° |
| H16 | C28 | H17 | 109.5° | 109.5° |
| H16 | C28 | H18 | 109.5° | 109.5° |
| H17 | C28 | H18 | 109.5° | 109.5° |
| H20 | C1 | H21 | 109.5° | 109.5° |
| H24 | C3 | H25 | 109.5° | 109.5° |
| H27 | C25 | H28 | 109.5° | 109.5° |
| H29 | C27 | H30 | 109.4° | 109.5° |
| H29 | C27 | H31 | 109.5° | 109.5° |
| H30 | C27 | H31 | 109.5° | 109.5° |
| H32 | C12 | H33 | 109.4° | 109.5° |
| H37 | C19 | H38 | 109.5° | 109.5° |
| H40 | C23 | H41 | 109.5° | 109.5° |
| H40 | C23 | H42 | 109.5° | 109.5° |
| H41 | C23 | H42 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C28 | C26 | C12 | H14 | 119.9° | 119.9° |
| C28 | C26 | C12 | H15 | 119.9° | 120.0° |
| C28 | C26 | C12 | C10 | 164.7° | 174.8° |
| C28 | C26 | H14 | H15 | 120.3° | 120.0° |
| C26 | C28 | H16 | H17 | 120.0° | 120.0° |
| C26 | C28 | H16 | H18 | 120.0° | 120.0° |
| C26 | C28 | H17 | H18 | 120.0° | 120.0° |
| C28 | C26 | C12 | H32 | 74.9° | 65.2° |
| C28 | C26 | C12 | H33 | 44.2° | 54.8° |
| C14 | C15 | C16 | H4 | 180.0° | 179.9° |
| C15 | C14 | C13 | H36 | 180.0° | 180.0° |
| C15 | C14 | C13 | C10 | 177.6° | 180.0° |
| C15 | C14 | C13 | C18 | 0.3° | 0.3° |
| C14 | C15 | C16 | O04 | 178.6° | 180.0° |
| C14 | C15 | C16 | C17 | 1.4° | 0.2° |
| C16 | C15 | C14 | C13 | 0.7° | 0.0° |
| C15 | C16 | O04 | C17 | 179.9° | 179.8° |
| C15 | C16 | O04 | C19 | 166.4° | 180.0° |
| C15 | C16 | C17 | C18 | 1.1° | 0.2° |
| C15 | C16 | C17 | H35 | 178.9° | 179.8° |
| C16 | C15 | C14 | H36 | 179.3° | 180.0° |
| C14 | C13 | C10 | C12 | 29.2° | 116.9° |
| C14 | C13 | C10 | C11 | 85.0° | 3.1° |
| C14 | C13 | C10 | C18 | 177.2° | 179.7° |
| C14 | C13 | C10 | C7 | 155.2° | 123.1° |
| C14 | C13 | C18 | C17 | 0.7° | 0.2° |
| C13 | C14 | C15 | H4 | 179.2° | 180.0° |
| C14 | C13 | C18 | H34 | 179.3° | 179.8° |
| C26 | C12 | C10 | H32 | 120.5° | 120.0° |
| C26 | C12 | C10 | H33 | 120.5° | 120.0° |
| C26 | C12 | C10 | C11 | 172.4° | 58.8° |
| C26 | C12 | C10 | C13 | 72.8° | 61.2° |
| C26 | C12 | C10 | C7 | 56.3° | 178.8° |
| C12 | C26 | H14 | H15 | 120.2° | 120.0° |
| C12 | C26 | C28 | H16 | 180.0° | 60.0° |
| C12 | C26 | C28 | H17 | 60.0° | 60.0° |
| C12 | C26 | C28 | H18 | 60.0° | 180.0° |
| C26 | C12 | H32 | H33 | 118.6° | 120.0° |
| C12 | C10 | C11 | C13 | 119.4° | 120.0° |
| C12 | C10 | C11 | C7 | 116.5° | 120.0° |
| C12 | C10 | C11 | C25 | 160.6° | 60.0° |
| C12 | C10 | C13 | C7 | 125.9° | 120.0° |
| C12 | C10 | C13 | C18 | 153.6° | 63.4° |
| C12 | C10 | C7 | C8 | 83.9° | 2.6° |
| C12 | C10 | C7 | C6 | 94.0° | 177.1° |
| C12 | C10 | C11 | H5 | 40.2° | 60.0° |
| C12 | C10 | C11 | H6 | 78.9° | 180.0° |
| C10 | C12 | C26 | H14 | 44.8° | 65.2° |
| C10 | C12 | C26 | H15 | 75.4° | 54.8° |
| C10 | C12 | H32 | H33 | 118.6° | 120.1° |
| C27 | C25 | C11 | C10 | 166.9° | 175.0° |
| C27 | C25 | C11 | H27 | 120.2° | 120.0° |
| C27 | C25 | C11 | H28 | 120.2° | 120.0° |
| C27 | C25 | C11 | H5 | 46.5° | 65.0° |
| C27 | C25 | C11 | H6 | 72.6° | 55.0° |
| C27 | C25 | H27 | H28 | 119.3° | 120.0° |
| C25 | C27 | H29 | H30 | 120.0° | 120.0° |
| C25 | C27 | H29 | H31 | 120.0° | 120.0° |
| C25 | C27 | H30 | H31 | 120.0° | 120.0° |
| C10 | C11 | C25 | H5 | 120.4° | 120.0° |
| C10 | C11 | C25 | H6 | 120.4° | 120.0° |
| C11 | C10 | C13 | C7 | 119.8° | 120.0° |
| C11 | C10 | C13 | C18 | 92.2° | 176.6° |
| C11 | C10 | C7 | C8 | 30.0° | 122.7° |
| C11 | C10 | C7 | C6 | 152.1° | 57.1° |
| C10 | C11 | H5 | H6 | 118.7° | 120.0° |
| C10 | C11 | C25 | H27 | 46.7° | 55.0° |
| C10 | C11 | C25 | H28 | 72.8° | 65.0° |
| C11 | C10 | C12 | H32 | 67.1° | 61.1° |
| C11 | C10 | C12 | H33 | 52.0° | 178.8° |
| C25 | C11 | C10 | C13 | 41.3° | 180.0° |
| C25 | C11 | C10 | C7 | 82.8° | 60.0° |
| C25 | C11 | H5 | H6 | 118.8° | 119.9° |
| C11 | C25 | H27 | H28 | 119.3° | 120.0° |
| C11 | C25 | C27 | H29 | 180.0° | 180.0° |
| C11 | C25 | C27 | H30 | 60.0° | 60.0° |
| C11 | C25 | C27 | H31 | 60.0° | 60.0° |
| C10 | C13 | C18 | C17 | 177.9° | 180.0° |
| C13 | C10 | C7 | C8 | 148.3° | 117.3° |
| C13 | C10 | C7 | C6 | 33.8° | 62.9° |
| C13 | C10 | C11 | H5 | 79.2° | 60.0° |
| C13 | C10 | C11 | H6 | 161.7° | 60.0° |
| C13 | C10 | C12 | H32 | 47.6° | 178.8° |
| C13 | C10 | C12 | H33 | 166.7° | 58.8° |
| C10 | C13 | C18 | H34 | 2.1° | 0.0° |
| C10 | C13 | C14 | H36 | 2.4° | 0.0° |
| C7 | C10 | C13 | C18 | 27.6° | 56.6° |
| C10 | C7 | C8 | C6 | 177.9° | 179.7° |
| C10 | C7 | C8 | C9 | 179.2° | 180.0° |
| C10 | C7 | C6 | C5 | 179.9° | 179.8° |
| C10 | C7 | C6 | H2 | 0.1° | 0.3° |
| C10 | C7 | C8 | H3 | 0.8° | 0.3° |
| C7 | C10 | C11 | H5 | 156.7° | 180.0° |
| C7 | C10 | C11 | H6 | 37.6° | 60.0° |
| C7 | C10 | C12 | H32 | 176.8° | 58.9° |
| C7 | C10 | C12 | H33 | 64.1° | 61.2° |
| C13 | C18 | C17 | C16 | 0.0° | 0.0° |
| C13 | C18 | C17 | H34 | 180.0° | 180.0° |
| C13 | C18 | C17 | H35 | 180.0° | 180.0° |
| C18 | C13 | C14 | H36 | 179.7° | 179.7° |
| C16 | O04 | C19 | C20 | 178.1° | 180.0° |
| O04 | C16 | C17 | C18 | 179.0° | 180.0° |
| O04 | C16 | C15 | H4 | 1.4° | 0.1° |
| O04 | C16 | C17 | H35 | 1.0° | 0.0° |
| C16 | O04 | C19 | H37 | 61.8° | 60.1° |
| C16 | O04 | C19 | H38 | 58.0° | 60.0° |
| C19 | O04 | C16 | C17 | 13.7° | 0.2° |
| O04 | C19 | C20 | O05 | 58.0° | 65.1° |
| O04 | C19 | C20 | H37 | 120.1° | 120.0° |
| O04 | C19 | C20 | H38 | 120.1° | 120.0° |
| O04 | C19 | C20 | C21 | 180.0° | 175.0° |
| O04 | C19 | C20 | H7 | 60.5° | 55.0° |
| O04 | C19 | H37 | H38 | 119.7° | 120.0° |
| C16 | C17 | C18 | H35 | 180.0° | 180.0° |
| C17 | C16 | C15 | H4 | 178.6° | 179.7° |
| C16 | C17 | C18 | H34 | 180.0° | 180.0° |
| O05 | C20 | C19 | C21 | 122.0° | 119.9° |
| O05 | C20 | C19 | H7 | 118.6° | 120.1° |
| O05 | C20 | C21 | H7 | 118.7° | 120.0° |
| O05 | C20 | C21 | C22 | 68.4° | 180.0° |
| O05 | C20 | C21 | C24 | 52.4° | 60.0° |
| O05 | C20 | C21 | C23 | 175.5° | 60.0° |
| O05 | C20 | C19 | H37 | 178.1° | 54.9° |
| O05 | C20 | C19 | H38 | 62.0° | 175.0° |
| C19 | C20 | C21 | H7 | 119.6° | 120.0° |
| C19 | C20 | C21 | C22 | 169.8° | 60.0° |
| C19 | C20 | C21 | C24 | 69.3° | 60.0° |
| C19 | C20 | C21 | C23 | 53.7° | 180.0° |
| C20 | C19 | H37 | H38 | 119.7° | 120.1° |
| C19 | C20 | O05 | H39 | 180.0° | 59.9° |
| C20 | C21 | C22 | C24 | 121.4° | 120.1° |
| C20 | C21 | C22 | C23 | 116.7° | 120.0° |
| C20 | C21 | C24 | C23 | 121.0° | 120.0° |
| C20 | C21 | C22 | H8 | 180.0° | 60.0° |
| C20 | C21 | C22 | H9 | 60.0° | 180.0° |
| C20 | C21 | C22 | H10 | 60.0° | 59.9° |
| C20 | C21 | C24 | H11 | 180.0° | 60.0° |
| C20 | C21 | C24 | H12 | 60.0° | 180.0° |
| C20 | C21 | C24 | H13 | 60.0° | 59.9° |
| C21 | C20 | C19 | H37 | 59.9° | 65.0° |
| C21 | C20 | C19 | H38 | 59.9° | 55.0° |
| C21 | C20 | O05 | H39 | 55.7° | 60.0° |
| C20 | C21 | C23 | H40 | 180.0° | 60.0° |
| C20 | C21 | C23 | H41 | 60.0° | 180.0° |
| C20 | C21 | C23 | H42 | 60.0° | 60.0° |
| C7 | C8 | C9 | H3 | 180.0° | 179.7° |
| C8 | C7 | C6 | C5 | 1.9° | 0.1° |
| C7 | C8 | C9 | C4 | 0.7° | 0.5° |
| C8 | C7 | C6 | H2 | 178.1° | 180.0° |
| C7 | C8 | C9 | H26 | 179.3° | 180.0° |
| C6 | C7 | C8 | C9 | 1.3° | 0.3° |
| C7 | C6 | C5 | H2 | 180.0° | 179.9° |
| C7 | C6 | C5 | C4 | 1.9° | 0.1° |
| C7 | C6 | C5 | H1 | 178.1° | 179.9° |
| C6 | C7 | C8 | H3 | 178.7° | 180.0° |
| C8 | C9 | C4 | H26 | 180.0° | 179.5° |
| C8 | C9 | C4 | C5 | 0.7° | 0.5° |
| C8 | C9 | C4 | O03 | 179.9° | 179.8° |
| C22 | C21 | C24 | C23 | 119.2° | 119.9° |
| C22 | C21 | C20 | H7 | 50.3° | 60.0° |
| C21 | C22 | H8 | H9 | 120.0° | 120.0° |
| C21 | C22 | H8 | H10 | 120.0° | 120.0° |
| C21 | C22 | H9 | H10 | 120.0° | 120.1° |
| C22 | C21 | C24 | H11 | 60.1° | 180.0° |
| C22 | C21 | C24 | H12 | 179.8° | 60.0° |
| C22 | C21 | C24 | H13 | 59.8° | 60.1° |
| C22 | C21 | C23 | H40 | 63.3° | 60.0° |
| C22 | C21 | C23 | H41 | 56.8° | 60.0° |
| C22 | C21 | C23 | H42 | 176.7° | 180.0° |
| C6 | C5 | C4 | C9 | 1.3° | 0.3° |
| C6 | C5 | C4 | H1 | 180.0° | 180.0° |
| C6 | C5 | C4 | O03 | 179.4° | 180.0° |
| C24 | C21 | C20 | H7 | 171.1° | 180.0° |
| C24 | C21 | C22 | H8 | 58.6° | 60.1° |
| C24 | C21 | C22 | H9 | 61.4° | 59.9° |
| C24 | C21 | C22 | H10 | 178.6° | 180.0° |
| C21 | C24 | H11 | H12 | 120.0° | 120.1° |
| C21 | C24 | H11 | H13 | 120.0° | 119.9° |
| C21 | C24 | H12 | H13 | 120.0° | 120.0° |
| C24 | C21 | C23 | H40 | 57.5° | 180.0° |
| C24 | C21 | C23 | H41 | 177.5° | 59.9° |
| C24 | C21 | C23 | H42 | 62.5° | 60.0° |
| C23 | C21 | C20 | H7 | 65.8° | 60.0° |
| C23 | C21 | C22 | H8 | 63.3° | 180.0° |
| C23 | C21 | C22 | H9 | 176.7° | 60.0° |
| C23 | C21 | C22 | H10 | 56.7° | 60.0° |
| C23 | C21 | C24 | H11 | 59.0° | 60.0° |
| C23 | C21 | C24 | H12 | 61.0° | 60.0° |
| C23 | C21 | C24 | H13 | 179.0° | 180.0° |
| C21 | C23 | H40 | H41 | 120.0° | 120.0° |
| C21 | C23 | H40 | H42 | 120.0° | 120.0° |
| C21 | C23 | H41 | H42 | 120.0° | 120.0° |
| C9 | C4 | C5 | O03 | 179.3° | 179.7° |
| C9 | C4 | O03 | C3 | 12.8° | 0.3° |
| C9 | C4 | C5 | H1 | 178.7° | 179.7° |
| C4 | C9 | C8 | H3 | 179.4° | 179.8° |
| C5 | C4 | O03 | C3 | 167.9° | 180.0° |
| C4 | C5 | C6 | H2 | 178.1° | 180.0° |
| C5 | C4 | C9 | H26 | 179.4° | 180.0° |
| C4 | O03 | C3 | C2 | 73.1° | 180.0° |
| O03 | C4 | C5 | H1 | 0.6° | 0.0° |
| C4 | O03 | C3 | H24 | 47.2° | 60.0° |
| C4 | O03 | C3 | H25 | 166.7° | 60.0° |
| O03 | C4 | C9 | H26 | 0.1° | 0.3° |
| O01 | C1 | C2 | O02 | 66.8° | 65.0° |
| O01 | C1 | C2 | H20 | 119.7° | 120.0° |
| O01 | C1 | C2 | H21 | 119.7° | 120.0° |
| O01 | C1 | C2 | C3 | 168.6° | 175.0° |
| O01 | C1 | H20 | H21 | 120.8° | 120.0° |
| O01 | C1 | C2 | H22 | 51.5° | 55.0° |
| O02 | C2 | C1 | C3 | 124.6° | 120.0° |
| O02 | C2 | C1 | H22 | 118.3° | 120.0° |
| O02 | C2 | C3 | H22 | 123.3° | 120.0° |
| O02 | C2 | C3 | O03 | 59.6° | 65.0° |
| O02 | C2 | C1 | H20 | 173.5° | 175.0° |
| O02 | C2 | C1 | H21 | 52.9° | 55.0° |
| O02 | C2 | C3 | H24 | 179.8° | 175.0° |
| O02 | C2 | C3 | H25 | 60.6° | 55.0° |
| C1 | C2 | C3 | H22 | 117.2° | 120.0° |
| C1 | C2 | C3 | O03 | 179.1° | 175.0° |
| C2 | C1 | O01 | H19 | 180.0° | 180.0° |
| C2 | C1 | H20 | H21 | 120.8° | 120.1° |
| C1 | C2 | O02 | H23 | 180.0° | 60.0° |
| C1 | C2 | C3 | H24 | 60.7° | 55.0° |
| C1 | C2 | C3 | H25 | 58.9° | 65.0° |
| C2 | C3 | O03 | H24 | 120.2° | 120.0° |
| C2 | C3 | O03 | H25 | 120.2° | 120.0° |
| C3 | C2 | C1 | H20 | 48.9° | 55.0° |
| C3 | C2 | C1 | H21 | 71.7° | 65.0° |
| C3 | C2 | O02 | H23 | 60.3° | 60.0° |
| C2 | C3 | H24 | H25 | 119.3° | 120.0° |
| O03 | C3 | C2 | H22 | 63.7° | 55.0° |
| O03 | C3 | H24 | H25 | 119.3° | 120.0° |
| H1 | C5 | C6 | H2 | 1.9° | 0.0° |
| H3 | C8 | C9 | H26 | 0.6° | 0.3° |
| H4 | C15 | C14 | H36 | 0.8° | 0.0° |
| H5 | C11 | C25 | H27 | 73.7° | 175.1° |
| H5 | C11 | C25 | H28 | 166.7° | 55.0° |
| H6 | C11 | C25 | H27 | 167.2° | 65.0° |
| H6 | C11 | C25 | H28 | 47.6° | 175.0° |
| H7 | C20 | C19 | H37 | 59.6° | 175.0° |
| H7 | C20 | C19 | H38 | 179.4° | 65.0° |
| H7 | C20 | O05 | H39 | 62.2° | 180.0° |
| H8 | C22 | H9 | H10 | 120.0° | 120.0° |
| H11 | C24 | H12 | H13 | 120.0° | 119.9° |
| H14 | C26 | C28 | H16 | 60.1° | 60.0° |
| H14 | C26 | C28 | H17 | 59.9° | 180.0° |
| H14 | C26 | C28 | H18 | 179.9° | 60.0° |
| H14 | C26 | C12 | H32 | 165.2° | 54.7° |
| H14 | C26 | C12 | H33 | 75.7° | 174.7° |
| H15 | C26 | C28 | H16 | 60.1° | 180.0° |
| H15 | C26 | C28 | H17 | 179.9° | 60.0° |
| H15 | C26 | C28 | H18 | 59.9° | 60.0° |
| H15 | C26 | C12 | H32 | 45.1° | 174.8° |
| H15 | C26 | C12 | H33 | 164.1° | 65.2° |
| H16 | C28 | H17 | H18 | 120.0° | 120.0° |
| H19 | O01 | C1 | H20 | 60.3° | 60.0° |
| H19 | O01 | C1 | H21 | 60.3° | 60.0° |
| H20 | C1 | C2 | H22 | 68.2° | 65.0° |
| H21 | C1 | C2 | H22 | 171.2° | 175.0° |
| H22 | C2 | O02 | H23 | 62.4° | 180.0° |
| H22 | C2 | C3 | H24 | 56.5° | 65.0° |
| H22 | C2 | C3 | H25 | 176.1° | 175.0° |
| H27 | C25 | C27 | H29 | 59.8° | 60.0° |
| H27 | C25 | C27 | H30 | 60.2° | 180.0° |
| H27 | C25 | C27 | H31 | 179.8° | 60.0° |
| H28 | C25 | C27 | H29 | 59.8° | 60.0° |
| H28 | C25 | C27 | H30 | 179.8° | 59.9° |
| H28 | C25 | C27 | H31 | 60.2° | 180.0° |
| H29 | C27 | H30 | H31 | 120.0° | 120.0° |
| H34 | C18 | C17 | H35 | 0.0° | 0.0° |
| H40 | C23 | H41 | H42 | 120.0° | 120.0° |
