GW6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.51Å | |
| C2 | C3 | sing | 1.55Å | 1.51Å | |
| C2 | C20 | sing | 1.55Å | 1.53Å | |
| C3 | C4 | sing | 1.53Å | 1.51Å | |
| C4 | C5 | sing | 1.52Å | 1.50Å | |
| C4 | C18 | sing | 1.55Å | 1.51Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C5 | C15 | sing | 1.54Å | 1.53Å | |
| C6 | C7 | sing | 1.53Å | 1.51Å | |
| C7 | F1 | sing | 1.40Å | 1.36Å | |
| C7 | C8 | sing | 1.52Å | 1.49Å | |
| C8 | C9 | doub | 1.33Å | 1.33Å | |
| C8 | C13 | sing | 1.50Å | 1.49Å | |
| C9 | C10 | sing | 1.47Å | 1.47Å | |
| C10 | O1 | doub | 1.22Å | 1.22Å | |
| C10 | C11 | sing | 1.47Å | 1.47Å | |
| C11 | C12 | doub | 1.32Å | 1.33Å | |
| C12 | C13 | sing | 1.49Å | 1.48Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C13 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | F2 | sing | 1.40Å | 1.36Å | |
| C15 | C16 | sing | 1.53Å | 1.54Å | |
| C16 | O2 | sing | 1.43Å | 1.42Å | |
| C16 | C17 | sing | 1.54Å | 1.52Å | |
| C17 | C18 | sing | 1.52Å | 1.52Å | |
| C18 | C19 | sing | 1.53Å | 1.52Å | |
| C18 | C20 | sing | 1.53Å | 1.53Å | |
| C20 | O3 | sing | 1.45Å | 1.44Å | |
| C20 | C26 | sing | 1.51Å | 1.52Å | |
| O3 | C21 | sing | 1.35Å | 1.37Å | |
| C21 | O4 | doub | 1.22Å | 1.23Å | |
| C21 | C22 | sing | 1.46Å | 1.43Å | |
| C22 | C23 | doub | 1.37Å | 1.38Å | Aromatic |
| C22 | O5 | sing | 1.35Å | 1.36Å | Aromatic |
| C23 | C24 | sing | 1.40Å | 1.41Å | Aromatic |
| C24 | C25 | doub | 1.35Å | 1.38Å | Aromatic |
| C25 | O5 | sing | 1.34Å | 1.36Å | Aromatic |
| C26 | O6 | doub | 1.21Å | 1.22Å | |
| C26 | S1 | sing | 1.71Å | 1.77Å | |
| S1 | C27 | sing | 1.81Å | 1.80Å | |
| C27 | F3 | sing | 1.40Å | 1.36Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C14 | H14B | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H19A | sing | 1.09Å | 1.10Å | |
| C19 | H19B | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C3 | 108.8° | 110.0° |
| C1 | C2 | C20 | 115.7° | 110.1° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.5° | 109.5° |
| C2 | C1 | H1B | 109.4° | 109.4° |
| C1 | C2 | H2 | 104.5° | 110.0° |
| C3 | C2 | C20 | 105.8° | 106.4° |
| C2 | C3 | C4 | 102.1° | 102.9° |
| C3 | C2 | H2 | 114.7° | 110.1° |
| C2 | C3 | H3 | 112.0° | 110.7° |
| C2 | C3 | H3A | 113.5° | 110.7° |
| C2 | C20 | C18 | 102.8° | 105.4° |
| C2 | C20 | O3 | 111.4° | 110.3° |
| C2 | C20 | C26 | 110.6° | 110.2° |
| C20 | C2 | H2 | 107.7° | 110.2° |
| C3 | C4 | C5 | 117.0° | 115.8° |
| C3 | C4 | C18 | 104.1° | 101.7° |
| C4 | C3 | H3 | 112.0° | 110.7° |
| C4 | C3 | H3A | 113.6° | 110.7° |
| C3 | C4 | H4 | 110.7° | 110.3° |
| C5 | C4 | C18 | 116.1° | 107.2° |
| C4 | C5 | C6 | 108.0° | 109.9° |
| C4 | C5 | C15 | 110.9° | 107.4° |
| C5 | C4 | H4 | 97.2° | 110.3° |
| C4 | C5 | H5 | 109.7° | 109.7° |
| C4 | C18 | C17 | 108.5° | 107.1° |
| C4 | C18 | C19 | 112.6° | 109.8° |
| C4 | C18 | C20 | 95.7° | 103.3° |
| C18 | C4 | H4 | 111.9° | 111.1° |
| C6 | C5 | C15 | 109.8° | 109.6° |
| C5 | C6 | C7 | 109.0° | 109.7° |
| C6 | C5 | H5 | 110.7° | 109.7° |
| C5 | C6 | H6 | 109.6° | 109.4° |
| C5 | C6 | H6A | 109.7° | 109.5° |
| C5 | C15 | C13 | 109.4° | 108.9° |
| C5 | C15 | F2 | 107.1° | 109.2° |
| C5 | C15 | C16 | 113.8° | 111.7° |
| C15 | C5 | H5 | 107.8° | 110.5° |
| C6 | C7 | F1 | 108.7° | 109.8° |
| C6 | C7 | C8 | 110.4° | 108.1° |
| C7 | C6 | H6 | 109.6° | 109.4° |
| C7 | C6 | H6A | 109.8° | 109.4° |
| C6 | C7 | H7 | 110.2° | 109.8° |
| F1 | C7 | C8 | 112.0° | 109.7° |
| F1 | C7 | H7 | 108.6° | 109.7° |
| C7 | C8 | C9 | 118.9° | 119.0° |
| C7 | C8 | C13 | 116.4° | 117.9° |
| C8 | C7 | H7 | 106.8° | 109.7° |
| C9 | C8 | C13 | 124.7° | 123.0° |
| C8 | C9 | C10 | 119.0° | 120.6° |
| C8 | C9 | H9 | 120.5° | 119.7° |
| C8 | C13 | C12 | 112.1° | 113.8° |
| C8 | C13 | C14 | 109.0° | 107.9° |
| C8 | C13 | C15 | 106.1° | 109.3° |
| C9 | C10 | O1 | 120.0° | 120.7° |
| C9 | C10 | C11 | 119.9° | 118.5° |
| C10 | C9 | H9 | 120.5° | 119.8° |
| O1 | C10 | C11 | 120.1° | 120.8° |
| C10 | C11 | C12 | 117.4° | 119.9° |
| C10 | C11 | H11 | 121.3° | 120.0° |
| C11 | C12 | C13 | 126.7° | 124.1° |
| C12 | C11 | H11 | 121.3° | 120.1° |
| C11 | C12 | H12 | 116.6° | 118.0° |
| C12 | C13 | C14 | 106.4° | 107.8° |
| C12 | C13 | C15 | 110.9° | 110.7° |
| C13 | C12 | H12 | 116.6° | 117.9° |
| C14 | C13 | C15 | 112.5° | 107.1° |
| C13 | C14 | H14 | 109.5° | 109.5° |
| C13 | C14 | H14A | 109.5° | 109.5° |
| C13 | C14 | H14B | 109.5° | 109.5° |
| C13 | C15 | F2 | 106.5° | 109.2° |
| C13 | C15 | C16 | 115.2° | 109.3° |
| F2 | C15 | C16 | 104.1° | 108.5° |
| C15 | C16 | O2 | 111.5° | 109.1° |
| C15 | C16 | C17 | 113.6° | 111.7° |
| C15 | C16 | H16 | 104.7° | 109.1° |
| O2 | C16 | C17 | 108.1° | 109.0° |
| O2 | C16 | H16 | 110.6° | 109.1° |
| C16 | O2 | HO2 | 109.5° | 114.0° |
| C16 | C17 | C18 | 113.3° | 107.2° |
| C17 | C16 | H16 | 108.3° | 108.9° |
| C16 | C17 | H17 | 108.2° | 109.9° |
| C16 | C17 | H17A | 107.3° | 109.9° |
| C17 | C18 | C19 | 111.2° | 109.8° |
| C17 | C18 | C20 | 116.3° | 116.4° |
| C18 | C17 | H17 | 108.2° | 109.9° |
| C18 | C17 | H17A | 107.4° | 109.9° |
| C19 | C18 | C20 | 111.7° | 110.0° |
| C18 | C19 | H19 | 109.5° | 109.5° |
| C18 | C19 | H19A | 109.5° | 109.4° |
| C18 | C19 | H19B | 109.5° | 109.5° |
| C18 | C20 | O3 | 105.9° | 110.3° |
| C18 | C20 | C26 | 113.8° | 110.3° |
| O3 | C20 | C26 | 111.9° | 110.3° |
| C20 | O3 | C21 | 120.6° | 117.0° |
| C20 | C26 | O6 | 122.0° | 120.0° |
| C20 | C26 | S1 | 116.8° | 120.0° |
| O3 | C21 | O4 | 126.9° | 120.0° |
| O3 | C21 | C22 | 107.4° | 120.0° |
| O4 | C21 | C22 | 125.7° | 120.0° |
| C21 | C22 | C23 | 131.3° | 126.0° |
| C21 | C22 | O5 | 118.2° | 126.0° |
| C23 | C22 | O5 | 110.5° | 108.0° |
| C22 | C23 | C24 | 106.0° | 106.7° |
| C22 | C23 | H23 | 127.0° | 126.7° |
| C22 | O5 | C25 | 106.7° | 109.4° |
| C23 | C24 | C25 | 106.5° | 107.1° |
| C24 | C23 | H23 | 127.0° | 126.6° |
| C23 | C24 | H24 | 126.7° | 126.5° |
| C24 | C25 | O5 | 110.3° | 108.8° |
| C25 | C24 | H24 | 126.8° | 126.4° |
| C24 | C25 | H25 | 124.9° | 125.6° |
| O5 | C25 | H25 | 124.9° | 125.6° |
| O6 | C26 | S1 | 121.2° | 119.9° |
| C26 | S1 | C27 | 100.0° | 100.0° |
| S1 | C27 | F3 | 107.9° | 109.4° |
| S1 | C27 | H27 | 110.0° | 109.5° |
| S1 | C27 | H27A | 110.3° | 109.5° |
| F3 | C27 | H27 | 110.0° | 109.5° |
| F3 | C27 | H27A | 110.3° | 109.4° |
| H1 | C1 | H1A | 109.5° | 109.5° |
| H1 | C1 | H1B | 109.5° | 109.5° |
| H1A | C1 | H1B | 109.5° | 109.5° |
| H3 | C3 | H3A | 103.9° | 110.8° |
| H6 | C6 | H6A | 109.1° | 109.4° |
| H14 | C14 | H14A | 109.5° | 109.4° |
| H14 | C14 | H14B | 109.4° | 109.5° |
| H14A | C14 | H14B | 109.5° | 109.5° |
| H17 | C17 | H17A | 112.5° | 110.0° |
| H19 | C19 | H19A | 109.5° | 109.5° |
| H19 | C19 | H19B | 109.4° | 109.5° |
| H19A | C19 | H19B | 109.5° | 109.5° |
| H27 | C27 | H27A | 108.3° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C3 | C20 | 124.9° | 119.2° |
| C1 | C2 | C3 | H2 | 116.6° | 121.4° |
| C1 | C2 | C20 | H2 | 116.5° | 121.5° |
| C1 | C2 | C3 | C4 | 118.9° | 95.3° |
| C1 | C2 | C20 | C18 | 147.2° | 122.6° |
| C1 | C2 | C20 | O3 | 34.2° | 3.6° |
| C1 | C2 | C20 | C26 | 91.0° | 118.4° |
| C2 | C1 | H1 | H1A | 120.0° | 120.0° |
| C2 | C1 | H1 | H1B | 120.0° | 120.0° |
| C2 | C1 | H1A | H1B | 120.0° | 120.0° |
| C1 | C2 | C3 | H3 | 1.1° | 23.1° |
| C1 | C2 | C3 | H3A | 118.5° | 146.4° |
| C3 | C2 | C20 | H2 | 123.0° | 119.3° |
| C2 | C3 | C4 | H3 | 120.0° | 118.4° |
| C2 | C3 | C4 | H3A | 122.6° | 118.3° |
| C2 | C3 | C4 | C5 | 167.0° | 157.3° |
| C2 | C3 | C4 | C18 | 37.5° | 41.5° |
| C3 | C2 | C20 | C18 | 26.7° | 3.4° |
| C3 | C2 | C20 | O3 | 86.3° | 115.6° |
| C3 | C2 | C20 | C26 | 148.5° | 122.4° |
| C3 | C2 | C1 | H1 | 126.0° | 54.5° |
| C3 | C2 | C1 | H1A | 5.9° | 174.6° |
| C3 | C2 | C1 | H1B | 114.1° | 65.5° |
| C2 | C3 | H3 | H3A | 122.9° | 123.2° |
| C2 | C3 | C4 | H4 | 82.9° | 76.4° |
| C20 | C2 | C3 | C4 | 6.0° | 23.9° |
| C2 | C20 | C18 | C4 | 47.6° | 29.2° |
| C2 | C20 | C18 | C17 | 161.4° | 146.3° |
| C2 | C20 | C18 | C19 | 69.5° | 88.0° |
| C2 | C20 | C18 | O3 | 117.0° | 119.0° |
| C2 | C20 | C18 | C26 | 119.7° | 118.9° |
| C2 | C20 | O3 | C26 | 124.5° | 122.0° |
| C2 | C20 | O3 | C21 | 90.5° | 174.0° |
| C2 | C20 | C26 | O6 | 0.0° | 129.3° |
| C2 | C20 | C26 | S1 | 179.5° | 50.7° |
| C20 | C2 | C1 | H1 | 115.2° | 62.4° |
| C20 | C2 | C1 | H1A | 124.8° | 57.6° |
| C20 | C2 | C1 | H1B | 4.8° | 177.6° |
| C20 | C2 | C3 | H3 | 126.0° | 142.3° |
| C20 | C2 | C3 | H3A | 116.7° | 94.4° |
| C3 | C4 | C5 | C18 | 123.6° | 112.6° |
| C3 | C4 | C5 | H4 | 117.7° | 126.2° |
| C3 | C4 | C18 | H4 | 119.6° | 117.4° |
| C3 | C4 | C5 | C6 | 62.4° | 63.9° |
| C3 | C4 | C5 | C15 | 177.2° | 176.9° |
| C3 | C4 | C18 | C17 | 173.2° | 167.8° |
| C3 | C4 | C18 | C19 | 63.4° | 73.0° |
| C3 | C4 | C18 | C20 | 53.0° | 44.3° |
| C4 | C3 | C2 | H2 | 124.5° | 143.3° |
| C4 | C3 | H3 | H3A | 123.0° | 123.2° |
| C3 | C4 | C5 | H5 | 58.3° | 56.7° |
| C5 | C4 | C18 | H4 | 110.3° | 120.6° |
| C4 | C5 | C6 | C15 | 121.0° | 117.8° |
| C4 | C5 | C6 | H5 | 120.1° | 120.7° |
| C4 | C5 | C15 | H5 | 120.1° | 119.6° |
| C4 | C5 | C6 | C7 | 178.7° | 178.4° |
| C4 | C5 | C15 | C13 | 176.5° | 177.7° |
| C4 | C5 | C15 | F2 | 68.4° | 63.1° |
| C4 | C5 | C15 | C16 | 46.1° | 56.9° |
| C5 | C4 | C18 | C17 | 56.7° | 70.2° |
| C5 | C4 | C18 | C19 | 66.7° | 49.0° |
| C5 | C4 | C18 | C20 | 176.9° | 166.3° |
| C5 | C4 | C3 | H3 | 73.0° | 84.3° |
| C5 | C4 | C3 | H3A | 44.4° | 39.0° |
| C4 | C5 | C6 | H6 | 61.3° | 61.6° |
| C4 | C5 | C6 | H6A | 58.5° | 58.3° |
| C18 | C4 | C5 | C6 | 173.9° | 176.6° |
| C18 | C4 | C5 | C15 | 53.6° | 64.2° |
| C4 | C18 | C17 | C16 | 53.3° | 64.8° |
| C4 | C18 | C17 | C19 | 124.3° | 119.2° |
| C4 | C18 | C17 | C20 | 106.4° | 115.0° |
| C4 | C18 | C19 | C20 | 106.4° | 113.0° |
| C4 | C18 | C20 | O3 | 69.4° | 89.8° |
| C4 | C18 | C20 | C26 | 167.3° | 148.1° |
| C18 | C4 | C3 | H3 | 157.5° | 159.9° |
| C18 | C4 | C3 | H3A | 85.2° | 76.8° |
| C18 | C4 | C5 | H5 | 65.3° | 56.0° |
| C4 | C18 | C17 | H17 | 66.6° | 54.7° |
| C4 | C18 | C17 | H17A | 171.7° | 175.9° |
| C4 | C18 | C19 | H19 | 81.9° | 67.9° |
| C4 | C18 | C19 | H19A | 38.1° | 172.2° |
| C4 | C18 | C19 | H19B | 158.1° | 52.1° |
| C6 | C5 | C15 | H5 | 120.7° | 121.0° |
| C5 | C6 | C7 | H6 | 120.0° | 120.1° |
| C5 | C6 | C7 | H6A | 120.2° | 120.1° |
| C5 | C6 | C7 | F1 | 177.1° | 174.8° |
| C5 | C6 | C7 | C8 | 53.8° | 55.2° |
| C6 | C5 | C15 | C13 | 64.2° | 62.9° |
| C6 | C5 | C15 | F2 | 50.8° | 56.3° |
| C6 | C5 | C15 | C16 | 165.4° | 176.3° |
| C6 | C5 | C4 | H4 | 55.3° | 62.3° |
| C5 | C6 | H6 | H6A | 120.2° | 120.0° |
| C5 | C6 | C7 | H7 | 64.0° | 64.5° |
| C15 | C5 | C6 | C7 | 60.3° | 63.8° |
| C5 | C15 | C13 | C8 | 58.8° | 54.8° |
| C5 | C15 | C13 | C12 | 179.3° | 179.1° |
| C5 | C15 | C13 | C14 | 60.3° | 61.8° |
| C5 | C15 | C13 | F2 | 115.5° | 119.2° |
| C5 | C15 | C13 | C16 | 129.6° | 122.3° |
| C5 | C15 | F2 | C16 | 120.8° | 122.0° |
| C5 | C15 | C16 | O2 | 76.6° | 66.4° |
| C5 | C15 | C16 | C17 | 45.9° | 54.1° |
| C15 | C5 | C4 | H4 | 65.1° | 56.9° |
| C15 | C5 | C6 | H6 | 59.7° | 56.3° |
| C15 | C5 | C6 | H6A | 179.5° | 176.2° |
| C5 | C15 | C16 | H16 | 163.8° | 174.6° |
| C6 | C7 | F1 | C8 | 122.3° | 118.6° |
| C6 | C7 | F1 | H7 | 120.0° | 120.7° |
| C6 | C7 | C8 | H7 | 119.9° | 119.7° |
| C6 | C7 | C8 | C9 | 124.4° | 128.4° |
| C6 | C7 | C8 | C13 | 54.9° | 51.8° |
| C7 | C6 | C5 | H5 | 58.6° | 57.7° |
| C7 | C6 | H6 | H6A | 120.2° | 119.8° |
| F1 | C7 | C8 | H7 | 118.8° | 120.6° |
| F1 | C7 | C8 | C9 | 3.1° | 8.7° |
| F1 | C7 | C8 | C13 | 176.2° | 171.5° |
| F1 | C7 | C6 | H6 | 57.1° | 54.7° |
| F1 | C7 | C6 | H6A | 62.7° | 65.1° |
| C7 | C8 | C9 | C13 | 179.2° | 179.8° |
| C7 | C8 | C9 | C10 | 179.8° | 179.1° |
| C7 | C8 | C13 | C12 | 177.3° | 176.4° |
| C7 | C8 | C13 | C14 | 65.2° | 64.0° |
| C7 | C8 | C13 | C15 | 56.1° | 52.1° |
| C8 | C7 | C6 | H6 | 66.2° | 64.9° |
| C8 | C7 | C6 | H6A | 174.0° | 175.3° |
| C7 | C8 | C9 | H9 | 0.2° | 0.9° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C8 | C9 | C10 | O1 | 176.3° | 177.8° |
| C8 | C9 | C10 | C11 | 3.4° | 2.1° |
| C9 | C8 | C13 | C12 | 2.0° | 3.8° |
| C9 | C8 | C13 | C14 | 115.5° | 115.7° |
| C9 | C8 | C13 | C15 | 123.1° | 128.2° |
| C9 | C8 | C7 | H7 | 115.7° | 111.9° |
| C13 | C8 | C9 | C10 | 1.0° | 1.2° |
| C8 | C13 | C12 | C11 | 3.0° | 3.5° |
| C8 | C13 | C12 | C14 | 119.1° | 119.6° |
| C8 | C13 | C12 | C15 | 118.4° | 123.6° |
| C8 | C13 | C14 | C15 | 117.4° | 117.6° |
| C8 | C13 | C15 | F2 | 56.7° | 64.4° |
| C8 | C13 | C15 | C16 | 171.6° | 177.1° |
| C13 | C8 | C7 | H7 | 65.0° | 67.9° |
| C13 | C8 | C9 | H9 | 179.0° | 178.9° |
| C8 | C13 | C12 | H12 | 177.0° | 176.5° |
| C8 | C13 | C14 | H14 | 84.4° | 77.5° |
| C8 | C13 | C14 | H14A | 35.6° | 162.5° |
| C8 | C13 | C14 | H14B | 155.7° | 42.5° |
| C9 | C10 | O1 | C11 | 179.7° | 179.9° |
| C9 | C10 | C11 | C12 | 2.5° | 2.5° |
| C9 | C10 | C11 | H11 | 177.5° | 177.4° |
| O1 | C10 | C11 | C12 | 177.2° | 177.4° |
| O1 | C10 | C9 | H9 | 3.7° | 2.3° |
| O1 | C10 | C11 | H11 | 2.8° | 2.7° |
| C10 | C11 | C12 | H11 | 180.0° | 179.9° |
| C10 | C11 | C12 | C13 | 0.8° | 0.5° |
| C11 | C10 | C9 | H9 | 176.6° | 177.8° |
| C10 | C11 | C12 | H12 | 179.2° | 179.5° |
| C11 | C12 | C13 | H12 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 116.1° | 116.1° |
| C11 | C12 | C13 | C15 | 121.3° | 127.1° |
| C12 | C13 | C14 | C15 | 121.5° | 119.1° |
| C12 | C13 | C15 | F2 | 65.3° | 61.7° |
| C12 | C13 | C15 | C16 | 49.6° | 56.8° |
| C13 | C12 | C11 | H11 | 179.2° | 179.6° |
| C12 | C13 | C14 | H14 | 36.7° | 159.2° |
| C12 | C13 | C14 | H14A | 156.7° | 39.2° |
| C12 | C13 | C14 | H14B | 83.3° | 80.8° |
| C14 | C13 | C15 | F2 | 175.8° | 179.0° |
| C14 | C13 | C15 | C16 | 69.3° | 60.5° |
| C14 | C13 | C12 | H12 | 63.9° | 63.9° |
| C13 | C14 | H14 | H14A | 120.0° | 120.0° |
| C13 | C14 | H14 | H14B | 120.0° | 120.0° |
| C13 | C14 | H14A | H14B | 120.0° | 120.0° |
| C13 | C15 | F2 | C16 | 122.2° | 119.0° |
| C13 | C15 | C16 | O2 | 50.9° | 54.2° |
| C13 | C15 | C16 | C17 | 173.3° | 174.7° |
| C13 | C15 | C5 | H5 | 56.5° | 58.1° |
| C15 | C13 | C12 | H12 | 58.6° | 52.9° |
| C15 | C13 | C14 | H14 | 158.2° | 40.1° |
| C15 | C13 | C14 | H14A | 81.8° | 79.9° |
| C15 | C13 | C14 | H14B | 38.3° | 160.1° |
| C13 | C15 | C16 | H16 | 68.7° | 64.8° |
| F2 | C15 | C16 | O2 | 167.1° | 173.2° |
| F2 | C15 | C16 | C17 | 70.4° | 66.3° |
| F2 | C15 | C5 | H5 | 171.5° | 177.3° |
| F2 | C15 | C16 | H16 | 47.6° | 54.2° |
| C15 | C16 | O2 | C17 | 125.6° | 122.2° |
| C15 | C16 | O2 | H16 | 116.0° | 119.0° |
| C15 | C16 | C17 | H16 | 115.9° | 120.5° |
| C15 | C16 | C17 | C18 | 50.1° | 57.5° |
| C16 | C15 | C5 | H5 | 74.0° | 62.7° |
| C15 | C16 | O2 | HO2 | 76.6° | 180.0° |
| C15 | C16 | C17 | H17 | 69.9° | 62.0° |
| C15 | C16 | C17 | H17A | 168.4° | 176.8° |
| O2 | C16 | C17 | H16 | 119.8° | 118.9° |
| O2 | C16 | C17 | C18 | 74.2° | 63.1° |
| O2 | C16 | C17 | H17 | 165.7° | 177.5° |
| O2 | C16 | C17 | H17A | 44.1° | 56.3° |
| C16 | C17 | C18 | H17 | 120.0° | 119.4° |
| C16 | C17 | C18 | H17A | 118.4° | 119.4° |
| C16 | C17 | C18 | C19 | 71.0° | 54.4° |
| C16 | C17 | C18 | C20 | 159.8° | 179.7° |
| C17 | C16 | O2 | HO2 | 157.8° | 57.8° |
| C16 | C17 | H17 | H17A | 118.4° | 121.1° |
| C17 | C18 | C19 | C20 | 131.7° | 129.4° |
| C17 | C18 | C20 | O3 | 44.5° | 27.3° |
| C17 | C18 | C20 | C26 | 78.9° | 94.8° |
| C17 | C18 | C4 | H4 | 53.5° | 50.4° |
| C18 | C17 | C16 | H16 | 165.9° | 178.0° |
| C18 | C17 | H17 | H17A | 118.5° | 121.1° |
| C17 | C18 | C19 | H19 | 40.0° | 174.6° |
| C17 | C18 | C19 | H19A | 160.0° | 54.6° |
| C17 | C18 | C19 | H19B | 80.0° | 65.4° |
| C19 | C18 | C20 | O3 | 173.5° | 153.0° |
| C19 | C18 | C20 | C26 | 50.2° | 30.9° |
| C19 | C18 | C4 | H4 | 177.0° | 169.6° |
| C19 | C18 | C17 | H17 | 169.1° | 173.9° |
| C19 | C18 | C17 | H17A | 47.4° | 64.9° |
| C18 | C19 | H19 | H19A | 120.0° | 119.9° |
| C18 | C19 | H19 | H19B | 120.0° | 120.0° |
| C18 | C19 | H19A | H19B | 120.0° | 120.0° |
| C18 | C20 | O3 | C26 | 124.5° | 122.1° |
| C18 | C20 | O3 | C21 | 158.4° | 70.0° |
| C18 | C20 | C26 | O6 | 115.2° | 114.8° |
| C18 | C20 | C26 | S1 | 65.3° | 65.2° |
| C18 | C20 | C2 | H2 | 96.3° | 115.9° |
| C20 | C18 | C4 | H4 | 66.6° | 73.1° |
| C20 | C18 | C17 | H17 | 39.8° | 60.3° |
| C20 | C18 | C17 | H17A | 81.9° | 60.9° |
| C20 | C18 | C19 | H19 | 171.7° | 45.2° |
| C20 | C18 | C19 | H19A | 68.3° | 74.8° |
| C20 | C18 | C19 | H19B | 51.7° | 165.2° |
| C20 | O3 | C21 | O4 | 14.8° | 3.2° |
| C20 | O3 | C21 | C22 | 166.5° | 176.7° |
| O3 | C20 | C26 | O6 | 124.9° | 7.3° |
| O3 | C20 | C26 | S1 | 54.6° | 172.8° |
| O3 | C20 | C2 | H2 | 150.7° | 125.2° |
| C26 | C20 | O3 | C21 | 33.9° | 52.0° |
| C20 | C26 | O6 | S1 | 179.5° | 179.9° |
| C20 | C26 | S1 | C27 | 178.6° | 180.0° |
| C26 | C20 | C2 | H2 | 25.5° | 3.1° |
| O3 | C21 | O4 | C22 | 178.5° | 179.9° |
| O3 | C21 | C22 | C23 | 10.6° | 180.0° |
| O3 | C21 | C22 | O5 | 169.7° | 0.4° |
| O4 | C21 | C22 | C23 | 168.1° | 0.1° |
| O4 | C21 | C22 | O5 | 11.5° | 179.7° |
| C21 | C22 | C23 | O5 | 179.7° | 179.7° |
| C21 | C22 | C23 | C24 | 179.7° | 180.0° |
| C21 | C22 | O5 | C25 | 179.7° | 179.9° |
| C21 | C22 | C23 | H23 | 0.3° | 0.1° |
| C22 | C23 | C24 | H23 | 180.0° | 179.9° |
| C22 | C23 | C24 | C25 | 0.0° | 0.0° |
| C23 | C22 | O5 | C25 | 0.0° | 0.5° |
| C22 | C23 | C24 | H24 | 180.0° | 180.0° |
| O5 | C22 | C23 | C24 | 0.0° | 0.3° |
| C22 | O5 | C25 | C24 | 0.0° | 0.4° |
| O5 | C22 | C23 | H23 | 180.0° | 179.8° |
| C22 | O5 | C25 | H25 | 180.0° | 179.8° |
| C23 | C24 | C25 | H24 | 180.0° | 180.0° |
| C23 | C24 | C25 | O5 | 0.0° | 0.3° |
| C23 | C24 | C25 | H25 | 180.0° | 180.0° |
| C24 | C25 | O5 | H25 | 180.0° | 179.7° |
| C25 | C24 | C23 | H23 | 180.0° | 179.9° |
| O5 | C25 | C24 | H24 | 180.0° | 179.7° |
| O6 | C26 | S1 | C27 | 1.9° | 0.1° |
| C26 | S1 | C27 | F3 | 50.6° | 75.0° |
| C26 | S1 | C27 | H27 | 69.4° | 165.0° |
| C26 | S1 | C27 | H27A | 171.2° | 44.9° |
| S1 | C27 | F3 | H27 | 120.0° | 120.0° |
| S1 | C27 | F3 | H27A | 120.6° | 120.0° |
| S1 | C27 | H27 | H27A | 120.6° | 120.1° |
| F3 | C27 | H27 | H27A | 120.6° | 120.0° |
| H1 | C1 | H1A | H1B | 120.0° | 120.0° |
| H1 | C1 | C2 | H2 | 3.0° | 176.0° |
| H1A | C1 | C2 | H2 | 117.0° | 64.0° |
| H1B | C1 | C2 | H2 | 123.0° | 56.0° |
| H2 | C2 | C3 | H3 | 115.5° | 98.4° |
| H2 | C2 | C3 | H3A | 1.8° | 24.9° |
| H3 | C3 | C4 | H4 | 37.1° | 41.9° |
| H3A | C3 | C4 | H4 | 154.4° | 165.2° |
| H4 | C4 | C5 | H5 | 176.0° | 177.1° |
| H5 | C5 | C6 | H6 | 178.6° | 177.8° |
| H5 | C5 | C6 | H6A | 61.6° | 62.3° |
| H6 | C6 | C7 | H7 | 176.1° | 175.4° |
| H6A | C6 | C7 | H7 | 56.2° | 55.7° |
| H11 | C11 | C12 | H12 | 0.8° | 0.4° |
| H14 | C14 | H14A | H14B | 120.0° | 120.0° |
| H16 | C16 | O2 | HO2 | 39.4° | 61.0° |
| H16 | C16 | C17 | H17 | 45.9° | 58.6° |
| H16 | C16 | C17 | H17A | 75.7° | 62.6° |
| H19 | C19 | H19A | H19B | 120.0° | 120.1° |
| H23 | C23 | C24 | H24 | 0.0° | 0.1° |
| H24 | C24 | C25 | H25 | 0.0° | 0.0° |
