D30
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C5 | C2 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C6 | sing | 1.51Å | 1.51Å | |
| C2 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C8 | C3 | sing | 1.39Å | 1.40Å | Aromatic |
| C3 | C1 | doub | 1.40Å | 1.39Å | Aromatic |
| C3 | S7 | sing | 1.76Å | 1.70Å | |
| C6 | C12 | sing | 1.53Å | 1.52Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| O1 | C7 | sing | 1.43Å | 1.43Å | |
| C7 | C11 | sing | 1.47Å | 1.46Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C12 | C9 | sing | 1.53Å | 1.52Å | |
| C4 | C9 | sing | 1.53Å | 1.52Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C10 | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C8 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C20 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C19 | C21 | sing | 1.47Å | 1.46Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C28 | C26 | doub | 1.39Å | 1.39Å | Aromatic |
| C27 | C26 | sing | 1.39Å | 1.39Å | Aromatic |
| C26 | O25 | sing | 1.36Å | 1.38Å | |
| C29 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C30 | C28 | sing | 1.38Å | 1.39Å | Aromatic |
| C28 | H28 | sing | 1.08Å | 1.08Å | |
| C31 | C29 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | H29 | sing | 1.08Å | 1.08Å | |
| C31 | C30 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | H30 | sing | 1.08Å | 1.08Å | |
| C32 | C31 | sing | 1.51Å | 1.50Å | |
| F35 | C32 | sing | 1.40Å | 1.31Å | |
| F34 | C32 | sing | 1.40Å | 1.32Å | |
| C32 | F33 | sing | 1.40Å | 1.33Å | |
| O21 | C17 | doub | 1.21Å | 1.23Å | |
| O22 | C17 | sing | 1.34Å | 1.25Å | |
| C17 | C14 | sing | 1.51Å | 1.51Å | |
| O22 | HO22 | sing | 0.97Å | 0.95Å | |
| C14 | O11 | sing | 1.43Å | 1.43Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| O11 | C5 | sing | 1.36Å | 1.39Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C1 | C4 | sing | 1.51Å | 1.52Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C13 | S7 | sing | 1.76Å | 1.71Å | |
| C16 | C13 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | C15 | sing | 1.39Å | 1.40Å | Aromatic |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C18 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | O1 | sing | 1.36Å | 1.37Å | |
| C11 | C19 | trip | 1.17Å | 1.18Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C22 | H22B | sing | 1.09Å | 1.10Å | |
| C23 | C18 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C24 | C23 | sing | 1.51Å | 1.52Å | |
| O25 | C24 | sing | 1.43Å | 1.43Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C2 | C6 | 117.6° | 117.8° |
| C5 | C2 | C1 | 120.3° | 119.7° |
| C2 | C5 | C10 | 120.6° | 120.6° |
| C2 | C5 | O11 | 119.5° | 119.7° |
| C6 | C2 | C1 | 122.1° | 122.6° |
| C2 | C6 | C12 | 110.6° | 110.6° |
| C2 | C6 | H6 | 109.1° | 109.2° |
| C2 | C6 | H6A | 108.9° | 109.2° |
| C2 | C1 | C3 | 118.9° | 119.7° |
| C2 | C1 | C4 | 122.6° | 122.6° |
| C8 | C3 | C1 | 120.6° | 120.5° |
| C8 | C3 | S7 | 117.9° | 119.7° |
| C3 | C8 | C10 | 120.1° | 119.7° |
| C3 | C8 | H8 | 120.0° | 120.2° |
| C1 | C3 | S7 | 121.4° | 119.8° |
| C3 | C1 | C4 | 118.5° | 117.8° |
| C3 | S7 | C13 | 104.9° | 103.0° |
| C12 | C6 | H6 | 109.1° | 109.3° |
| C12 | C6 | H6A | 108.9° | 109.3° |
| C6 | C12 | C9 | 112.8° | 108.4° |
| C6 | C12 | H12 | 108.4° | 109.7° |
| C6 | C12 | H12A | 107.6° | 109.7° |
| H6 | C6 | H6A | 110.4° | 109.2° |
| O1 | C7 | C11 | 108.4° | 109.5° |
| O1 | C7 | H7 | 109.8° | 109.5° |
| O1 | C7 | H7A | 110.1° | 109.5° |
| C7 | O1 | C15 | 121.4° | 117.0° |
| C11 | C7 | H7 | 109.8° | 109.5° |
| C11 | C7 | H7A | 110.1° | 109.5° |
| C7 | C11 | C19 | 175.3° | 180.0° |
| H7 | C7 | H7A | 108.6° | 109.4° |
| C12 | C9 | C4 | 113.4° | 108.3° |
| C12 | C9 | H9 | 108.2° | 109.7° |
| C12 | C9 | H9A | 107.3° | 109.6° |
| C9 | C12 | H12 | 108.4° | 109.7° |
| C9 | C12 | H12A | 107.6° | 109.6° |
| C4 | C9 | H9 | 108.2° | 109.7° |
| C4 | C9 | H9A | 107.3° | 109.8° |
| C9 | C4 | C1 | 114.3° | 110.6° |
| C9 | C4 | H4 | 107.9° | 109.2° |
| C9 | C4 | H4A | 106.7° | 109.3° |
| H9 | C9 | H9A | 112.6° | 109.7° |
| C5 | C10 | C8 | 119.5° | 119.8° |
| C5 | C10 | H10 | 120.2° | 120.1° |
| C10 | C5 | O11 | 119.9° | 119.7° |
| C8 | C10 | H10 | 120.2° | 120.1° |
| C10 | C8 | H8 | 120.0° | 120.1° |
| C23 | C20 | C16 | 121.4° | 120.2° |
| C23 | C20 | H20 | 119.3° | 119.9° |
| C20 | C23 | C18 | 119.3° | 120.2° |
| C20 | C23 | C24 | 122.3° | 119.9° |
| C16 | C20 | H20 | 119.3° | 119.9° |
| C20 | C16 | C13 | 119.3° | 119.9° |
| C20 | C16 | H16 | 120.3° | 120.0° |
| C19 | C21 | C22 | 108.5° | 109.5° |
| C19 | C21 | H21 | 109.8° | 109.5° |
| C19 | C21 | H21A | 110.0° | 109.5° |
| C21 | C19 | C11 | 174.2° | 180.0° |
| C22 | C21 | H21 | 109.8° | 109.5° |
| C22 | C21 | H21A | 110.0° | 109.5° |
| C21 | C22 | H22 | 109.5° | 109.5° |
| C21 | C22 | H22A | 109.4° | 109.5° |
| C21 | C22 | H22B | 109.4° | 109.5° |
| H21 | C21 | H21A | 108.8° | 109.5° |
| C28 | C26 | C27 | 119.5° | 119.9° |
| C28 | C26 | O25 | 120.6° | 120.1° |
| C26 | C28 | C30 | 121.1° | 120.0° |
| C26 | C28 | H28 | 119.4° | 120.0° |
| C27 | C26 | O25 | 119.9° | 120.1° |
| C26 | C27 | C29 | 119.8° | 120.0° |
| C26 | C27 | H27 | 120.1° | 120.0° |
| C26 | O25 | C24 | 125.5° | 117.0° |
| C29 | C27 | H27 | 120.1° | 120.0° |
| C27 | C29 | C31 | 120.3° | 120.0° |
| C27 | C29 | H29 | 119.8° | 120.0° |
| C30 | C28 | H28 | 119.5° | 120.0° |
| C28 | C30 | C31 | 119.4° | 120.1° |
| C28 | C30 | H30 | 120.3° | 120.0° |
| C31 | C29 | H29 | 119.9° | 119.9° |
| C29 | C31 | C30 | 120.0° | 120.1° |
| C29 | C31 | C32 | 119.6° | 119.9° |
| C31 | C30 | H30 | 120.3° | 119.9° |
| C30 | C31 | C32 | 120.4° | 120.0° |
| C31 | C32 | F35 | 107.3° | 109.5° |
| C31 | C32 | F34 | 110.5° | 109.5° |
| C31 | C32 | F33 | 111.0° | 109.5° |
| F35 | C32 | F34 | 110.4° | 109.4° |
| F35 | C32 | F33 | 108.6° | 109.4° |
| F34 | C32 | F33 | 109.1° | 109.5° |
| O21 | C17 | O22 | 121.0° | 120.0° |
| O21 | C17 | C14 | 116.3° | 120.0° |
| O22 | C17 | C14 | 122.6° | 120.0° |
| C17 | O22 | HO22 | 109.5° | 117.0° |
| C17 | C14 | O11 | 112.9° | 109.5° |
| C17 | C14 | H14 | 108.4° | 109.5° |
| C17 | C14 | H14A | 107.6° | 109.5° |
| O11 | C14 | H14 | 108.4° | 109.5° |
| O11 | C14 | H14A | 107.6° | 109.5° |
| C14 | O11 | C5 | 122.3° | 117.0° |
| H14 | C14 | H14A | 112.1° | 109.4° |
| H12 | C12 | H12A | 112.1° | 109.8° |
| C1 | C4 | H4 | 107.9° | 109.2° |
| C1 | C4 | H4A | 106.8° | 109.2° |
| H4 | C4 | H4A | 113.4° | 109.2° |
| S7 | C13 | C16 | 120.6° | 120.1° |
| S7 | C13 | C15 | 120.4° | 120.1° |
| C16 | C13 | C15 | 119.1° | 119.8° |
| C13 | C16 | H16 | 120.4° | 120.1° |
| C13 | C15 | C18 | 121.0° | 119.9° |
| C13 | C15 | O1 | 119.8° | 120.1° |
| C18 | C15 | O1 | 119.2° | 120.1° |
| C15 | C18 | C23 | 119.9° | 120.1° |
| C15 | C18 | H18 | 120.0° | 120.0° |
| H22 | C22 | H22A | 109.4° | 109.5° |
| H22 | C22 | H22B | 109.4° | 109.5° |
| H22A | C22 | H22B | 109.6° | 109.4° |
| C23 | C18 | H18 | 120.0° | 120.0° |
| C18 | C23 | C24 | 118.4° | 119.9° |
| C23 | C24 | O25 | 107.6° | 109.4° |
| C23 | C24 | H24 | 110.1° | 109.5° |
| C23 | C24 | H24A | 110.5° | 109.5° |
| O25 | C24 | H24 | 110.1° | 109.5° |
| O25 | C24 | H24A | 110.5° | 109.4° |
| H24 | C24 | H24A | 108.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C2 | C6 | C1 | 179.7° | 179.7° |
| C5 | C2 | C1 | C3 | 0.3° | 0.1° |
| C5 | C2 | C6 | C12 | 156.3° | 162.5° |
| C5 | C2 | C6 | H6 | 36.3° | 77.3° |
| C5 | C2 | C6 | H6A | 84.1° | 42.2° |
| C2 | C5 | C10 | O11 | 178.4° | 180.0° |
| C2 | C5 | C10 | C8 | 0.5° | 0.1° |
| C2 | C5 | C10 | H10 | 179.5° | 180.0° |
| C2 | C5 | O11 | C14 | 174.2° | 180.0° |
| C5 | C2 | C1 | C4 | 179.8° | 179.5° |
| C6 | C2 | C1 | C3 | 179.4° | 179.6° |
| C2 | C6 | C12 | H6 | 120.0° | 120.3° |
| C2 | C6 | C12 | H6A | 119.5° | 120.3° |
| C2 | C6 | H6 | H6A | 119.6° | 119.4° |
| C2 | C6 | C12 | C9 | 51.1° | 51.1° |
| C6 | C2 | C5 | C10 | 180.0° | 179.8° |
| C6 | C2 | C5 | O11 | 1.5° | 0.2° |
| C2 | C6 | C12 | H12 | 68.9° | 170.8° |
| C2 | C6 | C12 | H12A | 169.7° | 68.6° |
| C6 | C2 | C1 | C4 | 0.2° | 0.8° |
| C2 | C1 | C3 | C8 | 0.8° | 0.3° |
| C2 | C1 | C3 | C4 | 179.6° | 179.6° |
| C2 | C1 | C3 | S7 | 179.7° | 179.8° |
| C1 | C2 | C6 | C12 | 24.0° | 17.8° |
| C1 | C2 | C6 | H6 | 144.0° | 102.5° |
| C1 | C2 | C6 | H6A | 95.6° | 138.1° |
| C2 | C1 | C4 | C9 | 3.2° | 17.8° |
| C1 | C2 | C5 | C10 | 0.3° | 0.1° |
| C1 | C2 | C5 | O11 | 178.8° | 180.0° |
| C2 | C1 | C4 | H4 | 116.8° | 138.1° |
| C2 | C1 | C4 | H4A | 121.0° | 102.5° |
| C8 | C3 | C1 | S7 | 179.0° | 179.9° |
| C3 | C8 | C10 | C5 | 0.0° | 0.1° |
| C3 | C8 | C10 | H8 | 180.0° | 179.8° |
| C3 | C8 | C10 | H10 | 180.0° | 179.9° |
| C8 | C3 | C1 | C4 | 179.7° | 179.3° |
| C8 | C3 | S7 | C13 | 83.8° | 5.7° |
| C3 | C1 | C4 | C9 | 176.3° | 162.5° |
| C1 | C3 | C8 | C10 | 0.6° | 0.3° |
| C1 | C3 | C8 | H8 | 179.4° | 180.0° |
| C3 | C1 | C4 | H4 | 63.7° | 42.3° |
| C3 | C1 | C4 | H4A | 58.5° | 77.1° |
| C1 | C3 | S7 | C13 | 95.2° | 174.3° |
| S7 | C3 | C8 | C10 | 179.6° | 179.8° |
| S7 | C3 | C8 | H8 | 0.4° | 0.0° |
| S7 | C3 | C1 | C4 | 0.7° | 0.6° |
| C3 | S7 | C13 | C16 | 10.9° | 103.8° |
| C3 | S7 | C13 | C15 | 169.9° | 76.3° |
| C12 | C6 | H6 | H6A | 119.6° | 119.5° |
| C6 | C12 | C9 | H12 | 120.0° | 119.7° |
| C6 | C12 | C9 | H12A | 118.5° | 119.7° |
| C6 | C12 | C9 | C4 | 56.1° | 69.8° |
| C6 | C12 | C9 | H9 | 176.1° | 49.9° |
| C6 | C12 | C9 | H9A | 62.2° | 170.4° |
| C6 | C12 | H12 | H12A | 118.6° | 120.6° |
| H6 | C6 | C12 | C9 | 171.1° | 69.2° |
| H6 | C6 | C12 | H12 | 51.1° | 50.5° |
| H6 | C6 | C12 | H12A | 70.3° | 171.1° |
| H6A | C6 | C12 | C9 | 68.4° | 171.4° |
| H6A | C6 | C12 | H12 | 171.6° | 68.9° |
| H6A | C6 | C12 | H12A | 50.1° | 51.7° |
| O1 | C7 | C11 | H7 | 120.0° | 120.0° |
| O1 | C7 | C11 | H7A | 120.4° | 120.0° |
| O1 | C7 | H7 | H7A | 120.4° | 120.0° |
| C7 | O1 | C15 | C13 | 175.4° | 180.0° |
| C7 | O1 | C15 | C18 | 6.0° | 0.0° |
| O1 | C7 | C11 | C19 | 83.6° | 91.1° |
| C11 | C7 | H7 | H7A | 120.5° | 120.0° |
| C7 | C11 | C19 | C21 | 48.5° | 95.2° |
| C11 | C7 | O1 | C15 | 69.3° | 180.0° |
| H7 | C7 | O1 | C15 | 170.7° | 60.0° |
| H7 | C7 | C11 | C19 | 36.4° | 28.9° |
| H7A | C7 | O1 | C15 | 51.2° | 59.9° |
| H7A | C7 | C11 | C19 | 155.9° | 148.9° |
| C12 | C9 | C4 | H9 | 120.0° | 119.7° |
| C12 | C9 | C4 | H9A | 118.3° | 119.7° |
| C12 | C9 | H9 | H9A | 118.4° | 120.5° |
| C9 | C12 | H12 | H12A | 118.6° | 120.5° |
| C12 | C9 | C4 | C1 | 30.5° | 51.1° |
| C12 | C9 | C4 | H4 | 89.5° | 171.4° |
| C12 | C9 | C4 | H4A | 148.3° | 69.2° |
| C4 | C9 | H9 | H9A | 118.4° | 120.6° |
| C4 | C9 | C12 | H12 | 63.9° | 170.4° |
| C4 | C9 | C12 | H12A | 174.6° | 49.9° |
| C9 | C4 | C1 | H4 | 120.0° | 120.2° |
| C9 | C4 | C1 | H4A | 117.8° | 120.4° |
| C9 | C4 | H4 | H4A | 118.0° | 119.5° |
| H9 | C9 | C12 | H12 | 56.1° | 69.8° |
| H9 | C9 | C12 | H12A | 65.4° | 169.6° |
| H9 | C9 | C4 | C1 | 150.4° | 68.6° |
| H9 | C9 | C4 | H4 | 30.5° | 51.7° |
| H9 | C9 | C4 | H4A | 91.7° | 171.1° |
| H9A | C9 | C12 | H12 | 177.8° | 50.7° |
| H9A | C9 | C12 | H12A | 56.3° | 69.9° |
| H9A | C9 | C4 | C1 | 87.8° | 170.8° |
| H9A | C9 | C4 | H4 | 152.2° | 68.9° |
| H9A | C9 | C4 | H4A | 30.0° | 50.5° |
| C5 | C10 | C8 | H10 | 180.0° | 180.0° |
| C10 | C5 | O11 | C14 | 7.3° | 0.0° |
| C5 | C10 | C8 | H8 | 180.0° | 179.9° |
| C8 | C10 | C5 | O11 | 178.9° | 179.9° |
| H10 | C10 | C5 | O11 | 1.1° | 0.0° |
| H10 | C10 | C8 | H8 | 0.0° | 0.1° |
| C23 | C20 | C16 | H20 | 180.0° | 179.7° |
| C23 | C20 | C16 | C13 | 1.1° | 0.0° |
| C23 | C20 | C16 | H16 | 178.9° | 180.0° |
| C20 | C23 | C18 | C15 | 1.3° | 0.0° |
| C20 | C23 | C18 | C24 | 178.4° | 179.9° |
| C20 | C23 | C18 | H18 | 178.7° | 180.0° |
| C20 | C23 | C24 | O25 | 109.7° | 90.0° |
| C20 | C23 | C24 | H24 | 10.3° | 150.0° |
| C20 | C23 | C24 | H24A | 129.5° | 30.0° |
| C20 | C16 | C13 | S7 | 179.7° | 180.0° |
| C20 | C16 | C13 | H16 | 180.0° | 180.0° |
| C20 | C16 | C13 | C15 | 1.2° | 0.0° |
| C16 | C20 | C23 | C18 | 1.2° | 0.0° |
| C16 | C20 | C23 | C24 | 179.5° | 179.9° |
| H20 | C20 | C16 | C13 | 178.9° | 179.7° |
| H20 | C20 | C16 | H16 | 1.1° | 0.3° |
| H20 | C20 | C23 | C18 | 178.8° | 179.7° |
| H20 | C20 | C23 | C24 | 0.5° | 0.2° |
| C19 | C21 | C22 | H21 | 120.0° | 120.0° |
| C19 | C21 | C22 | H21A | 120.4° | 120.0° |
| C19 | C21 | H21 | H21A | 120.4° | 120.0° |
| C19 | C21 | C22 | H22 | 68.3° | 60.0° |
| C19 | C21 | C22 | H22A | 171.7° | 60.0° |
| C19 | C21 | C22 | H22B | 51.6° | 180.0° |
| C22 | C21 | H21 | H21A | 120.4° | 120.0° |
| C22 | C21 | C19 | C11 | 49.8° | 55.9° |
| C21 | C22 | H22 | H22A | 120.0° | 120.0° |
| C21 | C22 | H22 | H22B | 120.0° | 120.0° |
| C21 | C22 | H22A | H22B | 120.0° | 120.0° |
| H21 | C21 | C19 | C11 | 169.8° | 64.1° |
| H21 | C21 | C22 | H22 | 51.7° | 180.0° |
| H21 | C21 | C22 | H22A | 68.3° | 60.0° |
| H21 | C21 | C22 | H22B | 171.6° | 60.0° |
| H21A | C21 | C19 | C11 | 70.6° | 175.9° |
| H21A | C21 | C22 | H22 | 171.3° | 60.0° |
| H21A | C21 | C22 | H22A | 51.3° | 180.0° |
| H21A | C21 | C22 | H22B | 68.7° | 60.0° |
| C28 | C26 | C27 | O25 | 179.6° | 179.8° |
| C28 | C26 | C27 | C29 | 0.3° | 0.2° |
| C28 | C26 | C27 | H27 | 179.7° | 179.8° |
| C26 | C28 | C30 | H28 | 180.0° | 180.0° |
| C26 | C28 | C30 | C31 | 0.6° | 0.0° |
| C26 | C28 | C30 | H30 | 179.4° | 180.0° |
| C28 | C26 | O25 | C24 | 19.9° | 0.2° |
| C26 | C27 | C29 | H27 | 180.0° | 180.0° |
| C27 | C26 | C28 | C30 | 0.7° | 0.3° |
| C27 | C26 | C28 | H28 | 179.3° | 179.8° |
| C26 | C27 | C29 | C31 | 0.0° | 0.0° |
| C26 | C27 | C29 | H29 | 180.0° | 180.0° |
| C27 | C26 | O25 | C24 | 160.4° | 180.0° |
| O25 | C26 | C27 | C29 | 180.0° | 180.0° |
| O25 | C26 | C27 | H27 | 0.1° | 0.0° |
| O25 | C26 | C28 | C30 | 179.7° | 179.9° |
| O25 | C26 | C28 | H28 | 0.3° | 0.0° |
| C26 | O25 | C24 | C23 | 169.2° | 180.0° |
| C26 | O25 | C24 | H24 | 70.8° | 59.9° |
| C26 | O25 | C24 | H24A | 48.4° | 60.1° |
| C27 | C29 | C31 | H29 | 180.0° | 180.0° |
| C27 | C29 | C31 | C30 | 0.1° | 0.3° |
| C27 | C29 | C31 | C32 | 179.4° | 180.0° |
| H27 | C27 | C29 | C31 | 179.9° | 180.0° |
| H27 | C27 | C29 | H29 | 0.1° | 0.0° |
| C28 | C30 | C31 | C29 | 0.3° | 0.3° |
| C28 | C30 | C31 | H30 | 180.0° | 180.0° |
| C28 | C30 | C31 | C32 | 179.8° | 180.0° |
| H28 | C28 | C30 | C31 | 179.4° | 180.0° |
| H28 | C28 | C30 | H30 | 0.6° | 0.0° |
| C29 | C31 | C30 | C32 | 179.5° | 179.7° |
| C29 | C31 | C30 | H30 | 179.8° | 179.7° |
| C29 | C31 | C32 | F35 | 45.8° | 30.0° |
| C29 | C31 | C32 | F34 | 166.2° | 150.0° |
| C29 | C31 | C32 | F33 | 72.7° | 90.0° |
| H29 | C29 | C31 | C30 | 179.9° | 179.7° |
| H29 | C29 | C31 | C32 | 0.6° | 0.0° |
| C30 | C31 | C32 | F35 | 134.7° | 150.3° |
| C30 | C31 | C32 | F34 | 14.3° | 30.3° |
| C30 | C31 | C32 | F33 | 106.8° | 89.7° |
| H30 | C30 | C31 | C32 | 0.3° | 0.0° |
| C31 | C32 | F35 | F34 | 120.4° | 120.0° |
| C31 | C32 | F35 | F33 | 120.1° | 120.0° |
| C31 | C32 | F34 | F33 | 122.3° | 120.0° |
| F35 | C32 | F34 | F33 | 119.2° | 120.0° |
| O21 | C17 | O22 | C14 | 179.0° | 180.0° |
| O21 | C17 | O22 | HO22 | 0.0° | 0.0° |
| O21 | C17 | C14 | O11 | 162.4° | 0.0° |
| O21 | C17 | C14 | H14 | 77.5° | 120.0° |
| O21 | C17 | C14 | H14A | 43.9° | 120.0° |
| O22 | C17 | C14 | O11 | 18.5° | 180.0° |
| O22 | C17 | C14 | H14 | 101.5° | 60.0° |
| O22 | C17 | C14 | H14A | 137.0° | 60.0° |
| C14 | C17 | O22 | HO22 | 179.1° | 179.9° |
| C17 | C14 | O11 | H14 | 120.0° | 120.0° |
| C17 | C14 | O11 | H14A | 118.5° | 120.0° |
| C17 | C14 | H14 | H14A | 118.6° | 120.0° |
| C17 | C14 | O11 | C5 | 73.6° | 180.0° |
| O11 | C14 | H14 | H14A | 118.6° | 120.0° |
| H14 | C14 | O11 | C5 | 166.4° | 60.0° |
| H14A | C14 | O11 | C5 | 45.0° | 60.0° |
| C1 | C4 | H4 | H4A | 118.0° | 119.4° |
| S7 | C13 | C16 | C15 | 179.2° | 180.0° |
| S7 | C13 | C16 | H16 | 0.4° | 0.1° |
| S7 | C13 | C15 | C18 | 179.5° | 180.0° |
| S7 | C13 | C15 | O1 | 0.9° | 0.1° |
| C16 | C13 | C15 | C18 | 1.3° | 0.0° |
| C16 | C13 | C15 | O1 | 180.0° | 180.0° |
| C15 | C13 | C16 | H16 | 178.8° | 180.0° |
| C13 | C15 | C18 | O1 | 178.6° | 180.0° |
| C13 | C15 | C18 | C23 | 1.4° | 0.0° |
| C13 | C15 | C18 | H18 | 178.6° | 180.0° |
| C15 | C18 | C23 | H18 | 180.0° | 180.0° |
| C15 | C18 | C23 | C24 | 179.7° | 179.9° |
| O1 | C15 | C18 | C23 | 180.0° | 180.0° |
| O1 | C15 | C18 | H18 | 0.0° | 0.0° |
| H22 | C22 | H22A | H22B | 120.0° | 120.0° |
| C18 | C23 | C24 | O25 | 68.6° | 90.1° |
| C18 | C23 | C24 | H24 | 171.4° | 29.9° |
| C18 | C23 | C24 | H24A | 52.2° | 150.0° |
| H18 | C18 | C23 | C24 | 0.3° | 0.1° |
| C23 | C24 | O25 | H24 | 120.0° | 120.0° |
| C23 | C24 | O25 | H24A | 120.8° | 119.9° |
| C23 | C24 | H24 | H24A | 120.8° | 120.0° |
| O25 | C24 | H24 | H24A | 120.8° | 120.0° |
