82K
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C25 | sing | 1.53Å | 1.51Å | |
| C25 | C24 | sing | 1.53Å | 1.51Å | |
| O25 | C1 | doub | 1.21Å | 1.25Å | |
| C24 | C23 | sing | 1.53Å | 1.50Å | |
| C5 | C6 | sing | 1.51Å | 1.51Å | |
| C5 | C2 | sing | 1.53Å | 1.53Å | |
| O26 | C1 | sing | 1.34Å | 1.26Å | |
| C1 | C2 | sing | 1.51Å | 1.53Å | |
| C6 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.40Å | Aromatic |
| C23 | C22 | sing | 1.53Å | 1.51Å | |
| C11 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C7 | C8 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.39Å | 1.40Å | Aromatic |
| C8 | C12 | sing | 1.51Å | 1.50Å | |
| C9 | O33 | sing | 1.36Å | 1.37Å | |
| C12 | N27 | sing | 1.46Å | 1.46Å | |
| C22 | C21 | sing | 1.53Å | 1.51Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| O33 | C21 | sing | 1.43Å | 1.43Å | |
| N27 | C13 | sing | 1.35Å | 1.33Å | |
| O28 | C13 | doub | 1.21Å | 1.23Å | |
| C13 | C14 | sing | 1.48Å | 1.50Å | |
| C14 | C19 | doub | 1.40Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.40Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C15 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| C18 | C17 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| C17 | C20 | sing | 1.51Å | 1.50Å | |
| C20 | F32 | sing | 1.40Å | 1.33Å | |
| C20 | F30 | sing | 1.40Å | 1.34Å | |
| C20 | F31 | sing | 1.40Å | 1.33Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H2 | sing | 1.08Å | 1.08Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C16 | H6 | sing | 1.08Å | 1.08Å | |
| C18 | H7 | sing | 1.08Å | 1.08Å | |
| C19 | H8 | sing | 1.08Å | 1.08Å | |
| C2 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C22 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C23 | H14 | sing | 1.09Å | 1.10Å | |
| C23 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C25 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.09Å | 1.10Å | |
| C26 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| C4 | H25 | sing | 1.09Å | 1.10Å | |
| C4 | H26 | sing | 1.09Å | 1.10Å | |
| C4 | H27 | sing | 1.09Å | 1.10Å | |
| C5 | H28 | sing | 1.09Å | 1.10Å | |
| C5 | H29 | sing | 1.09Å | 1.10Å | |
| C7 | H30 | sing | 1.08Å | 1.08Å | |
| N27 | H31 | sing | 0.97Å | 1.00Å | |
| O26 | H32 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C26 | C25 | C24 | 114.1° | 109.5° |
| C26 | C25 | H18 | 108.3° | 109.5° |
| C26 | C25 | H19 | 108.3° | 109.5° |
| C25 | C26 | H20 | 109.5° | 109.5° |
| C25 | C26 | H21 | 109.5° | 109.5° |
| C25 | C26 | H22 | 109.4° | 109.5° |
| C25 | C24 | C23 | 113.5° | 109.4° |
| C25 | C24 | H16 | 108.4° | 109.5° |
| C25 | C24 | H17 | 108.4° | 109.5° |
| C24 | C25 | H18 | 108.3° | 109.5° |
| C24 | C25 | H19 | 108.3° | 109.5° |
| O25 | C1 | O26 | 124.2° | 120.0° |
| O25 | C1 | C2 | 117.6° | 120.0° |
| C24 | C23 | C22 | 113.7° | 109.4° |
| C24 | C23 | H14 | 108.4° | 109.5° |
| C24 | C23 | H15 | 108.4° | 109.5° |
| C23 | C24 | H16 | 108.5° | 109.5° |
| C23 | C24 | H17 | 108.5° | 109.5° |
| C6 | C5 | C2 | 114.3° | 109.5° |
| C5 | C6 | C11 | 121.2° | 119.9° |
| C5 | C6 | C7 | 120.6° | 119.9° |
| C6 | C5 | H28 | 108.2° | 109.4° |
| C6 | C5 | H29 | 108.2° | 109.5° |
| C5 | C2 | C1 | 109.1° | 109.5° |
| C5 | C2 | C3 | 112.8° | 109.4° |
| C5 | C2 | H9 | 107.8° | 109.5° |
| C2 | C5 | H28 | 108.3° | 109.5° |
| C2 | C5 | H29 | 108.3° | 109.5° |
| O26 | C1 | C2 | 118.2° | 120.0° |
| C1 | O26 | H32 | 109.5° | 117.0° |
| C1 | C2 | C3 | 111.5° | 109.5° |
| C1 | C2 | H9 | 107.8° | 109.5° |
| C11 | C6 | C7 | 118.2° | 120.2° |
| C6 | C11 | C10 | 121.2° | 120.0° |
| C6 | C11 | H2 | 119.4° | 120.0° |
| C6 | C7 | C8 | 122.0° | 120.0° |
| C6 | C7 | H30 | 119.0° | 120.0° |
| C23 | C22 | C21 | 113.4° | 109.5° |
| C23 | C22 | H12 | 108.5° | 109.5° |
| C23 | C22 | H13 | 108.5° | 109.5° |
| C22 | C23 | H14 | 108.4° | 109.5° |
| C22 | C23 | H15 | 108.4° | 109.5° |
| C11 | C10 | C9 | 119.8° | 119.9° |
| C11 | C10 | H1 | 120.1° | 120.0° |
| C10 | C11 | H2 | 119.4° | 120.0° |
| C2 | C3 | C4 | 112.8° | 109.5° |
| C3 | C2 | H9 | 107.7° | 109.4° |
| C2 | C3 | H23 | 108.6° | 109.4° |
| C2 | C3 | H24 | 108.7° | 109.5° |
| C7 | C8 | C9 | 118.2° | 120.0° |
| C7 | C8 | C12 | 121.2° | 120.0° |
| C8 | C7 | H30 | 119.0° | 120.0° |
| C10 | C9 | C8 | 120.7° | 119.9° |
| C10 | C9 | O33 | 123.6° | 120.0° |
| C9 | C10 | H1 | 120.1° | 120.1° |
| C9 | C8 | C12 | 120.6° | 120.0° |
| C8 | C9 | O33 | 115.7° | 120.1° |
| C8 | C12 | N27 | 113.5° | 109.5° |
| C8 | C12 | H3 | 108.5° | 109.4° |
| C8 | C12 | H4 | 108.4° | 109.5° |
| C9 | O33 | C21 | 117.9° | 117.0° |
| C12 | N27 | C13 | 120.8° | 120.0° |
| N27 | C12 | H3 | 108.4° | 109.5° |
| N27 | C12 | H4 | 108.5° | 109.5° |
| C12 | N27 | H31 | 119.6° | 120.0° |
| C22 | C21 | O33 | 109.1° | 109.5° |
| C22 | C21 | H10 | 109.6° | 109.4° |
| C22 | C21 | H11 | 109.6° | 109.4° |
| C21 | C22 | H12 | 108.5° | 109.4° |
| C21 | C22 | H13 | 108.5° | 109.5° |
| C4 | C3 | H23 | 108.6° | 109.5° |
| C4 | C3 | H24 | 108.6° | 109.5° |
| C3 | C4 | H25 | 109.5° | 109.5° |
| C3 | C4 | H26 | 109.5° | 109.4° |
| C3 | C4 | H27 | 109.4° | 109.5° |
| O33 | C21 | H10 | 109.6° | 109.5° |
| O33 | C21 | H11 | 109.5° | 109.5° |
| N27 | C13 | O28 | 122.2° | 120.0° |
| N27 | C13 | C14 | 117.7° | 120.0° |
| C13 | N27 | H31 | 119.6° | 120.0° |
| O28 | C13 | C14 | 120.1° | 120.0° |
| C13 | C14 | C19 | 122.9° | 120.2° |
| C13 | C14 | C15 | 118.0° | 120.1° |
| C19 | C14 | C15 | 119.1° | 119.7° |
| C14 | C19 | C18 | 120.3° | 119.9° |
| C14 | C19 | H8 | 119.8° | 120.1° |
| C14 | C15 | C16 | 120.7° | 119.8° |
| C14 | C15 | H5 | 119.7° | 120.1° |
| C19 | C18 | C17 | 120.1° | 120.1° |
| C19 | C18 | H7 | 119.9° | 120.0° |
| C18 | C19 | H8 | 119.8° | 120.1° |
| C15 | C16 | C17 | 119.8° | 120.1° |
| C16 | C15 | H5 | 119.7° | 120.0° |
| C15 | C16 | H6 | 120.1° | 120.0° |
| C18 | C17 | C16 | 120.0° | 120.3° |
| C18 | C17 | C20 | 120.3° | 119.8° |
| C17 | C18 | H7 | 120.0° | 120.0° |
| C16 | C17 | C20 | 119.7° | 119.8° |
| C17 | C16 | H6 | 120.2° | 119.9° |
| C17 | C20 | F32 | 112.3° | 109.5° |
| C17 | C20 | F30 | 112.8° | 109.4° |
| C17 | C20 | F31 | 113.3° | 109.5° |
| F32 | C20 | F30 | 105.7° | 109.4° |
| F32 | C20 | F31 | 105.5° | 109.5° |
| F30 | C20 | F31 | 106.6° | 109.5° |
| H3 | C12 | H4 | 109.5° | 109.5° |
| H10 | C21 | H11 | 109.5° | 109.5° |
| H12 | C22 | H13 | 109.4° | 109.5° |
| H14 | C23 | H15 | 109.5° | 109.5° |
| H16 | C24 | H17 | 109.5° | 109.5° |
| H18 | C25 | H19 | 109.5° | 109.5° |
| H20 | C26 | H21 | 109.5° | 109.5° |
| H20 | C26 | H22 | 109.5° | 109.4° |
| H21 | C26 | H22 | 109.5° | 109.4° |
| H23 | C3 | H24 | 109.4° | 109.5° |
| H25 | C4 | H26 | 109.5° | 109.5° |
| H25 | C4 | H27 | 109.5° | 109.5° |
| H26 | C4 | H27 | 109.5° | 109.5° |
| H28 | C5 | H29 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C26 | C25 | C24 | H18 | 120.7° | 120.0° |
| C26 | C25 | C24 | H19 | 120.7° | 120.0° |
| C26 | C25 | C24 | C23 | 59.1° | 180.0° |
| C26 | C25 | C24 | H16 | 61.5° | 60.0° |
| C26 | C25 | C24 | H17 | 179.8° | 60.0° |
| C26 | C25 | H18 | H19 | 117.9° | 120.0° |
| C25 | C26 | H20 | H21 | 120.0° | 120.1° |
| C25 | C26 | H20 | H22 | 120.0° | 120.0° |
| C25 | C26 | H21 | H22 | 119.9° | 120.0° |
| C25 | C24 | C23 | H16 | 120.6° | 120.0° |
| C25 | C24 | C23 | H17 | 120.6° | 120.0° |
| C25 | C24 | C23 | C22 | 171.3° | 180.0° |
| C25 | C24 | C23 | H14 | 50.7° | 60.0° |
| C25 | C24 | C23 | H15 | 68.1° | 60.0° |
| C25 | C24 | H16 | H17 | 118.1° | 120.0° |
| C24 | C25 | H18 | H19 | 117.9° | 120.0° |
| C24 | C25 | C26 | H20 | 180.0° | 180.0° |
| C24 | C25 | C26 | H21 | 60.0° | 60.0° |
| C24 | C25 | C26 | H22 | 60.0° | 60.0° |
| O25 | C1 | C2 | C5 | 91.0° | 119.9° |
| O25 | C1 | O26 | C2 | 178.2° | 179.8° |
| O25 | C1 | C2 | C3 | 143.8° | 0.0° |
| O25 | C1 | C2 | H9 | 25.8° | 120.0° |
| O25 | C1 | O26 | H32 | 0.0° | 0.2° |
| C24 | C23 | C22 | H14 | 120.6° | 120.0° |
| C24 | C23 | C22 | H15 | 120.6° | 120.0° |
| C24 | C23 | C22 | C21 | 109.9° | 180.0° |
| C24 | C23 | C22 | H12 | 129.5° | 60.0° |
| C24 | C23 | C22 | H13 | 10.7° | 60.0° |
| C24 | C23 | H14 | H15 | 118.1° | 120.1° |
| C23 | C24 | H16 | H17 | 118.2° | 120.1° |
| C23 | C24 | C25 | H18 | 179.8° | 60.0° |
| C23 | C24 | C25 | H19 | 61.5° | 60.0° |
| C6 | C5 | C2 | H28 | 120.7° | 119.9° |
| C6 | C5 | C2 | H29 | 120.7° | 120.0° |
| C6 | C5 | C2 | C1 | 179.9° | 65.0° |
| C5 | C6 | C11 | C7 | 179.6° | 179.9° |
| C5 | C6 | C11 | C10 | 179.4° | 180.0° |
| C6 | C5 | C2 | C3 | 55.6° | 175.0° |
| C5 | C6 | C7 | C8 | 179.3° | 180.0° |
| C5 | C6 | C11 | H2 | 0.6° | 0.1° |
| C6 | C5 | C2 | H9 | 63.1° | 55.0° |
| C6 | C5 | H28 | H29 | 117.7° | 120.0° |
| C5 | C6 | C7 | H30 | 0.7° | 0.1° |
| C5 | C2 | C1 | O26 | 87.4° | 60.2° |
| C5 | C2 | C1 | C3 | 125.2° | 120.0° |
| C5 | C2 | C1 | H9 | 116.8° | 120.0° |
| C2 | C5 | C6 | C11 | 110.3° | 90.0° |
| C2 | C5 | C6 | C7 | 70.1° | 90.0° |
| C5 | C2 | C3 | H9 | 118.8° | 120.0° |
| C5 | C2 | C3 | C4 | 177.5° | 175.0° |
| C5 | C2 | C3 | H23 | 62.0° | 65.0° |
| C5 | C2 | C3 | H24 | 57.0° | 55.0° |
| C2 | C5 | H28 | H29 | 117.8° | 120.1° |
| O26 | C1 | C2 | C3 | 37.9° | 179.8° |
| O26 | C1 | C2 | H9 | 155.9° | 59.8° |
| C1 | C2 | C3 | H9 | 118.0° | 120.0° |
| C1 | C2 | C3 | C4 | 59.4° | 65.0° |
| C1 | C2 | C3 | H23 | 61.1° | 55.0° |
| C1 | C2 | C3 | H24 | 179.9° | 175.0° |
| C1 | C2 | C5 | H28 | 59.2° | 175.0° |
| C1 | C2 | C5 | H29 | 59.4° | 55.0° |
| C2 | C1 | O26 | H32 | 178.2° | 180.0° |
| C6 | C11 | C10 | H2 | 180.0° | 180.0° |
| C11 | C6 | C7 | C8 | 0.4° | 0.0° |
| C6 | C11 | C10 | C9 | 0.4° | 0.0° |
| C6 | C11 | C10 | H1 | 179.6° | 179.7° |
| C11 | C6 | C5 | H28 | 129.0° | 30.0° |
| C11 | C6 | C5 | H29 | 10.4° | 150.0° |
| C11 | C6 | C7 | H30 | 179.6° | 180.0° |
| C7 | C6 | C11 | C10 | 0.2° | 0.0° |
| C6 | C7 | C8 | H30 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 0.7° | 0.1° |
| C6 | C7 | C8 | C12 | 179.7° | 180.0° |
| C7 | C6 | C11 | H2 | 179.8° | 180.0° |
| C7 | C6 | C5 | H28 | 50.7° | 150.0° |
| C7 | C6 | C5 | H29 | 169.2° | 30.1° |
| C23 | C22 | C21 | H12 | 120.6° | 120.0° |
| C23 | C22 | C21 | H13 | 120.6° | 120.1° |
| C23 | C22 | C21 | O33 | 90.5° | 180.0° |
| C23 | C22 | C21 | H10 | 29.4° | 60.0° |
| C23 | C22 | C21 | H11 | 149.6° | 60.0° |
| C23 | C22 | H12 | H13 | 118.2° | 120.1° |
| C22 | C23 | H14 | H15 | 118.1° | 120.0° |
| C22 | C23 | C24 | H16 | 68.1° | 60.0° |
| C22 | C23 | C24 | H17 | 50.7° | 60.0° |
| C11 | C10 | C9 | H1 | 180.0° | 179.7° |
| C11 | C10 | C9 | C8 | 0.7° | 0.1° |
| C11 | C10 | C9 | O33 | 179.0° | 179.7° |
| C2 | C3 | C4 | H23 | 120.5° | 119.9° |
| C2 | C3 | C4 | H24 | 120.5° | 120.0° |
| C2 | C3 | H23 | H24 | 118.5° | 120.0° |
| C2 | C3 | C4 | H25 | 180.0° | 180.0° |
| C2 | C3 | C4 | H26 | 60.0° | 60.0° |
| C2 | C3 | C4 | H27 | 60.0° | 60.0° |
| C3 | C2 | C5 | H28 | 176.3° | 55.0° |
| C3 | C2 | C5 | H29 | 65.1° | 65.0° |
| C7 | C8 | C9 | C10 | 0.9° | 0.1° |
| C7 | C8 | C9 | C12 | 179.6° | 179.9° |
| C7 | C8 | C9 | O33 | 179.3° | 179.7° |
| C7 | C8 | C12 | N27 | 126.6° | 100.0° |
| C7 | C8 | C12 | H3 | 112.8° | 20.0° |
| C7 | C8 | C12 | H4 | 6.0° | 140.0° |
| C10 | C9 | C8 | O33 | 178.4° | 179.8° |
| C10 | C9 | C8 | C12 | 179.6° | 180.0° |
| C10 | C9 | O33 | C21 | 1.0° | 0.1° |
| C9 | C10 | C11 | H2 | 179.6° | 180.0° |
| C9 | C8 | C12 | N27 | 53.0° | 80.0° |
| C8 | C9 | O33 | C21 | 177.3° | 179.7° |
| C8 | C9 | C10 | H1 | 179.3° | 179.7° |
| C9 | C8 | C12 | H3 | 67.6° | 160.0° |
| C9 | C8 | C12 | H4 | 173.6° | 40.0° |
| C9 | C8 | C7 | H30 | 179.3° | 180.0° |
| C12 | C8 | C9 | O33 | 1.1° | 0.2° |
| C8 | C12 | N27 | H3 | 120.6° | 120.0° |
| C8 | C12 | N27 | H4 | 120.6° | 120.0° |
| C8 | C12 | N27 | C13 | 165.9° | 180.0° |
| C8 | C12 | H3 | H4 | 118.2° | 120.0° |
| C12 | C8 | C7 | H30 | 0.3° | 0.1° |
| C8 | C12 | N27 | H31 | 14.1° | 0.0° |
| C9 | O33 | C21 | C22 | 143.8° | 179.9° |
| O33 | C9 | C10 | H1 | 1.0° | 0.1° |
| C9 | O33 | C21 | H10 | 23.9° | 60.1° |
| C9 | O33 | C21 | H11 | 96.2° | 60.0° |
| C12 | N27 | C13 | H31 | 180.0° | 179.9° |
| C12 | N27 | C13 | O28 | 6.5° | 0.1° |
| C12 | N27 | C13 | C14 | 174.6° | 180.0° |
| N27 | C12 | H3 | H4 | 118.2° | 120.0° |
| C22 | C21 | O33 | H10 | 119.9° | 120.0° |
| C22 | C21 | O33 | H11 | 119.9° | 120.0° |
| C22 | C21 | H10 | H11 | 120.2° | 119.9° |
| C21 | C22 | H12 | H13 | 118.2° | 120.0° |
| C21 | C22 | C23 | H14 | 10.7° | 60.0° |
| C21 | C22 | C23 | H15 | 129.5° | 60.0° |
| C4 | C3 | C2 | H9 | 58.7° | 55.1° |
| C4 | C3 | H23 | H24 | 118.5° | 120.1° |
| C3 | C4 | H25 | H26 | 120.0° | 119.9° |
| C3 | C4 | H25 | H27 | 120.0° | 120.0° |
| C3 | C4 | H26 | H27 | 120.0° | 120.0° |
| O33 | C21 | H10 | H11 | 120.2° | 120.1° |
| O33 | C21 | C22 | H12 | 148.9° | 60.0° |
| O33 | C21 | C22 | H13 | 30.1° | 60.0° |
| N27 | C13 | O28 | C14 | 178.9° | 179.9° |
| N27 | C13 | C14 | C19 | 19.5° | 180.0° |
| N27 | C13 | C14 | C15 | 160.2° | 0.3° |
| C13 | N27 | C12 | H3 | 73.5° | 60.0° |
| C13 | N27 | C12 | H4 | 45.3° | 60.0° |
| O28 | C13 | C14 | C19 | 159.5° | 0.0° |
| O28 | C13 | C14 | C15 | 20.8° | 179.8° |
| O28 | C13 | N27 | H31 | 173.5° | 180.0° |
| C13 | C14 | C19 | C15 | 179.7° | 179.8° |
| C13 | C14 | C19 | C18 | 179.4° | 179.7° |
| C13 | C14 | C15 | C16 | 179.5° | 180.0° |
| C13 | C14 | C15 | H5 | 0.5° | 0.0° |
| C13 | C14 | C19 | H8 | 0.6° | 0.0° |
| C14 | C13 | N27 | H31 | 5.5° | 0.1° |
| C14 | C19 | C18 | H8 | 180.0° | 179.8° |
| C19 | C14 | C15 | C16 | 0.8° | 0.2° |
| C14 | C19 | C18 | C17 | 0.6° | 0.5° |
| C19 | C14 | C15 | H5 | 179.2° | 179.7° |
| C14 | C19 | C18 | H7 | 179.4° | 179.8° |
| C15 | C14 | C19 | C18 | 0.9° | 0.5° |
| C14 | C15 | C16 | H5 | 180.0° | 179.9° |
| C14 | C15 | C16 | C17 | 0.4° | 0.1° |
| C14 | C15 | C16 | H6 | 179.6° | 179.9° |
| C15 | C14 | C19 | H8 | 179.1° | 179.7° |
| C19 | C18 | C17 | H7 | 180.0° | 179.7° |
| C19 | C18 | C17 | C16 | 0.2° | 0.2° |
| C19 | C18 | C17 | C20 | 179.6° | 179.7° |
| C15 | C16 | C17 | C18 | 0.1° | 0.1° |
| C15 | C16 | C17 | H6 | 180.0° | 179.9° |
| C15 | C16 | C17 | C20 | 179.5° | 180.0° |
| C18 | C17 | C16 | C20 | 179.5° | 179.9° |
| C18 | C17 | C20 | F32 | 123.4° | 90.0° |
| C18 | C17 | C20 | F30 | 4.0° | 30.0° |
| C18 | C17 | C20 | F31 | 117.2° | 150.0° |
| C18 | C17 | C16 | H6 | 180.0° | 179.9° |
| C17 | C18 | C19 | H8 | 179.4° | 179.7° |
| C16 | C17 | C20 | F32 | 56.1° | 90.0° |
| C16 | C17 | C20 | F30 | 175.4° | 150.1° |
| C16 | C17 | C20 | F31 | 63.4° | 30.1° |
| C17 | C16 | C15 | H5 | 179.6° | 180.0° |
| C16 | C17 | C18 | H7 | 179.8° | 179.9° |
| C17 | C20 | F32 | F30 | 123.5° | 120.0° |
| C17 | C20 | F32 | F31 | 123.9° | 120.0° |
| C17 | C20 | F30 | F31 | 124.9° | 120.0° |
| C20 | C17 | C16 | H6 | 0.5° | 0.1° |
| C20 | C17 | C18 | H7 | 0.4° | 0.0° |
| F32 | C20 | F30 | F31 | 111.9° | 120.0° |
| H1 | C10 | C11 | H2 | 0.4° | 0.3° |
| H3 | C12 | N27 | H31 | 106.5° | 119.9° |
| H4 | C12 | N27 | H31 | 134.7° | 120.0° |
| H5 | C15 | C16 | H6 | 0.4° | 0.1° |
| H7 | C18 | C19 | H8 | 0.6° | 0.0° |
| H9 | C2 | C3 | H23 | 179.2° | 175.0° |
| H9 | C2 | C3 | H24 | 61.8° | 65.0° |
| H9 | C2 | C5 | H28 | 57.6° | 64.9° |
| H9 | C2 | C5 | H29 | 176.1° | 175.1° |
| H10 | C21 | C22 | H12 | 91.2° | 60.0° |
| H10 | C21 | C22 | H13 | 150.0° | 180.0° |
| H11 | C21 | C22 | H12 | 29.0° | 180.0° |
| H11 | C21 | C22 | H13 | 89.8° | 60.0° |
| H12 | C22 | C23 | H14 | 109.9° | 180.0° |
| H12 | C22 | C23 | H15 | 8.9° | 60.0° |
| H13 | C22 | C23 | H14 | 131.3° | 60.0° |
| H13 | C22 | C23 | H15 | 109.9° | 180.0° |
| H14 | C23 | C24 | H16 | 171.3° | 180.0° |
| H14 | C23 | C24 | H17 | 69.9° | 59.9° |
| H15 | C23 | C24 | H16 | 52.5° | 60.0° |
| H15 | C23 | C24 | H17 | 171.3° | 180.0° |
| H16 | C24 | C25 | H18 | 59.2° | 180.0° |
| H16 | C24 | C25 | H19 | 177.8° | 60.0° |
| H17 | C24 | C25 | H18 | 59.6° | 60.0° |
| H17 | C24 | C25 | H19 | 59.1° | 180.0° |
| H18 | C25 | C26 | H20 | 59.3° | 60.0° |
| H18 | C25 | C26 | H21 | 60.7° | 180.0° |
| H18 | C25 | C26 | H22 | 179.3° | 60.0° |
| H19 | C25 | C26 | H20 | 59.3° | 60.0° |
| H19 | C25 | C26 | H21 | 179.3° | 60.0° |
| H19 | C25 | C26 | H22 | 60.7° | NaN° |
| H20 | C26 | H21 | H22 | 120.0° | 119.9° |
| H23 | C3 | C4 | H25 | 59.5° | 60.0° |
| H23 | C3 | C4 | H26 | 179.5° | 180.0° |
| H23 | C3 | C4 | H27 | 60.5° | 59.9° |
| H24 | C3 | C4 | H25 | 59.5° | 60.0° |
| H24 | C3 | C4 | H26 | 60.5° | 60.0° |
| H24 | C3 | C4 | H27 | 179.5° | 180.0° |
| H25 | C4 | H26 | H27 | 120.0° | 120.0° |
