H97
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C10 | C1 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| O1 | C1 | sing | 1.43Å | 1.44Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| F1 | C26 | sing | 1.40Å | 1.32Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C26 | F2 | sing | 1.40Å | 1.32Å | |
| C3 | O2 | sing | 1.43Å | 1.42Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| C4 | C3 | sing | 1.53Å | 1.54Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| F3 | C26 | sing | 1.40Å | 1.33Å | |
| C24 | O3 | sing | 1.43Å | 1.43Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C4 | C5 | sing | 1.51Å | 1.51Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| F4 | C25 | sing | 1.40Å | 1.32Å | |
| O4 | C30 | sing | 1.43Å | 1.43Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C10 | C5 | sing | 1.51Å | 1.51Å | |
| C5 | C6 | doub | 1.33Å | 1.35Å | |
| C25 | F5 | sing | 1.40Å | 1.33Å | |
| C6 | C7 | sing | 1.47Å | 1.47Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| F6 | C25 | sing | 1.40Å | 1.32Å | |
| C8 | C7 | doub | 1.33Å | 1.34Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C9 | C8 | sing | 1.52Å | 1.52Å | |
| C8 | C14 | sing | 1.50Å | 1.51Å | |
| C11 | C9 | sing | 1.53Å | 1.53Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C11 | C12 | sing | 1.54Å | 1.53Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | C13 | sing | 1.51Å | 1.52Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C18 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | C17 | sing | 1.52Å | 1.52Å | |
| C13 | C14 | sing | 1.55Å | 1.52Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | C15 | sing | 1.55Å | 1.54Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C17 | C16 | sing | 1.54Å | 1.53Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C20 | C17 | sing | 1.53Å | 1.54Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C18 | H18B | sing | 1.09Å | 1.10Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C20 | C27 | sing | 1.53Å | 1.54Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | C21 | sing | 1.47Å | 1.47Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C23 | C22 | trip | 1.17Å | 1.19Å | |
| C24 | C23 | sing | 1.47Å | 1.48Å | |
| C26 | C24 | sing | 1.53Å | 1.50Å | |
| C25 | C24 | sing | 1.53Å | 1.51Å | |
| C27 | C28 | sing | 1.53Å | 1.55Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C28 | C29 | sing | 1.53Å | 1.54Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C29 | C30 | sing | 1.53Å | 1.54Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C30 | C32 | sing | 1.53Å | 1.52Å | |
| C30 | C31 | sing | 1.53Å | 1.52Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H31A | sing | 1.09Å | 1.10Å | |
| C31 | H31B | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C32 | H32B | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C10 | C1 | C2 | 110.7° | 109.4° |
| C10 | C1 | O1 | 108.9° | 109.5° |
| C10 | C1 | H1 | 108.7° | 109.4° |
| C1 | C10 | C5 | 112.0° | 108.5° |
| C1 | C10 | H10 | 108.6° | 109.6° |
| C1 | C10 | H10A | 108.6° | 109.7° |
| C2 | C1 | O1 | 108.5° | 109.5° |
| C2 | C1 | H1 | 109.1° | 109.5° |
| C1 | C2 | C3 | 110.8° | 109.8° |
| C1 | C2 | H2 | 109.0° | 109.4° |
| C1 | C2 | H2A | 109.0° | 109.4° |
| O1 | C1 | H1 | 110.8° | 109.5° |
| C1 | O1 | HO1 | 109.5° | 114.0° |
| F1 | C26 | F2 | 110.0° | 109.5° |
| F1 | C26 | F3 | 114.3° | 109.4° |
| F1 | C26 | C24 | 103.9° | 109.5° |
| C3 | C2 | H2 | 109.0° | 109.4° |
| C3 | C2 | H2A | 109.0° | 109.4° |
| C2 | C3 | O2 | 108.6° | 109.4° |
| C2 | C3 | C4 | 112.1° | 109.4° |
| C2 | C3 | H3 | 108.6° | 109.5° |
| H2 | C2 | H2A | 109.9° | 109.4° |
| F2 | C26 | F3 | 109.5° | 109.5° |
| F2 | C26 | C24 | 109.9° | 109.5° |
| C3 | O2 | HO2 | 109.5° | 113.9° |
| O2 | C3 | C4 | 110.2° | 109.5° |
| O2 | C3 | H3 | 110.5° | 109.5° |
| C4 | C3 | H3 | 106.9° | 109.5° |
| C3 | C4 | C5 | 111.4° | 108.5° |
| C3 | C4 | H4 | 108.8° | 109.6° |
| C3 | C4 | H4A | 108.8° | 109.6° |
| F3 | C26 | C24 | 109.0° | 109.4° |
| C24 | O3 | HO3 | 109.5° | 114.0° |
| O3 | C24 | C23 | 115.3° | 109.4° |
| O3 | C24 | C26 | 105.1° | 109.4° |
| O3 | C24 | C25 | 109.0° | 109.5° |
| C5 | C4 | H4 | 108.8° | 109.7° |
| C5 | C4 | H4A | 108.8° | 109.6° |
| C4 | C5 | C10 | 118.9° | 118.3° |
| C4 | C5 | C6 | 120.0° | 120.9° |
| H4 | C4 | H4A | 110.1° | 109.8° |
| F4 | C25 | F5 | 110.6° | 109.5° |
| F4 | C25 | F6 | 106.3° | 109.5° |
| F4 | C25 | C24 | 107.6° | 109.5° |
| C30 | O4 | HO4 | 109.5° | 114.0° |
| O4 | C30 | C29 | 110.4° | 109.4° |
| O4 | C30 | C32 | 108.6° | 109.4° |
| O4 | C30 | C31 | 106.9° | 109.5° |
| C10 | C5 | C6 | 121.1° | 120.8° |
| C5 | C10 | H10 | 108.6° | 109.6° |
| C5 | C10 | H10A | 108.6° | 109.6° |
| C5 | C6 | C7 | 122.9° | 120.0° |
| C5 | C6 | H6 | 118.5° | 120.0° |
| F5 | C25 | F6 | 114.2° | 109.5° |
| F5 | C25 | C24 | 107.2° | 109.5° |
| C7 | C6 | H6 | 118.5° | 120.0° |
| C6 | C7 | C8 | 120.4° | 120.0° |
| C6 | C7 | H7 | 119.8° | 120.0° |
| F6 | C25 | C24 | 110.8° | 109.5° |
| C8 | C7 | H7 | 119.8° | 120.0° |
| C7 | C8 | C9 | 121.1° | 122.4° |
| C7 | C8 | C14 | 124.7° | 122.4° |
| C9 | C8 | C14 | 114.1° | 115.2° |
| C8 | C9 | C11 | 108.9° | 110.7° |
| C8 | C9 | H9 | 109.7° | 109.2° |
| C8 | C9 | H9A | 109.6° | 109.2° |
| C8 | C14 | C13 | 107.9° | 105.7° |
| C8 | C14 | C15 | 119.7° | 116.7° |
| C8 | C14 | H14 | 101.9° | 110.7° |
| C11 | C9 | H9 | 109.7° | 109.3° |
| C11 | C9 | H9A | 109.7° | 109.2° |
| C9 | C11 | C12 | 114.3° | 111.8° |
| C9 | C11 | H11 | 107.9° | 109.0° |
| C9 | C11 | H11A | 107.9° | 109.0° |
| H9 | C9 | H9A | 109.3° | 109.2° |
| H10 | C10 | H10A | 110.3° | 109.7° |
| C12 | C11 | H11 | 107.9° | 109.1° |
| C12 | C11 | H11A | 107.9° | 109.0° |
| C11 | C12 | C13 | 111.2° | 107.5° |
| C11 | C12 | H12 | 108.9° | 109.9° |
| C11 | C12 | H12A | 108.9° | 109.8° |
| H11 | C11 | H11A | 111.0° | 108.9° |
| C13 | C12 | H12 | 108.9° | 109.9° |
| C13 | C12 | H12A | 108.9° | 109.8° |
| C12 | C13 | C18 | 111.5° | 109.3° |
| C12 | C13 | C17 | 116.3° | 118.3° |
| C12 | C13 | C14 | 108.3° | 107.7° |
| H12 | C12 | H12A | 110.0° | 109.9° |
| C18 | C13 | C17 | 110.3° | 109.2° |
| C18 | C13 | C14 | 108.2° | 108.6° |
| C13 | C18 | H18 | 109.5° | 109.4° |
| C13 | C18 | H18A | 109.5° | 109.5° |
| C13 | C18 | H18B | 109.5° | 109.5° |
| C17 | C13 | C14 | 101.6° | 103.3° |
| C13 | C17 | C16 | 102.6° | 105.0° |
| C13 | C17 | C20 | 116.6° | 110.3° |
| C13 | C17 | H17 | 111.3° | 110.3° |
| C13 | C14 | C15 | 103.7° | 101.1° |
| C13 | C14 | H14 | 118.4° | 110.8° |
| C15 | C14 | H14 | 106.2° | 111.2° |
| C14 | C15 | C16 | 103.8° | 102.8° |
| C14 | C15 | H15 | 111.4° | 110.8° |
| C14 | C15 | H15A | 111.4° | 110.8° |
| C16 | C15 | H15 | 111.4° | 110.7° |
| C16 | C15 | H15A | 111.4° | 110.9° |
| C15 | C16 | C17 | 107.1° | 106.4° |
| C15 | C16 | H16 | 110.2° | 110.1° |
| C15 | C16 | H16A | 110.3° | 110.1° |
| H15 | C15 | H15A | 107.5° | 110.6° |
| C17 | C16 | H16 | 110.3° | 110.4° |
| C17 | C16 | H16A | 110.2° | 109.7° |
| C16 | C17 | C20 | 114.3° | 109.8° |
| C16 | C17 | H17 | 113.8° | 110.8° |
| H16 | C16 | H16A | 108.7° | 110.1° |
| C20 | C17 | H17 | 98.7° | 110.4° |
| C17 | C20 | C21 | 111.7° | 109.5° |
| C17 | C20 | C27 | 111.3° | 109.5° |
| C17 | C20 | H20 | 106.8° | 109.5° |
| H18 | C18 | H18A | 109.4° | 109.5° |
| H18 | C18 | H18B | 109.5° | 109.4° |
| H18A | C18 | H18B | 109.5° | 109.5° |
| C21 | C20 | C27 | 110.1° | 109.4° |
| C21 | C20 | H20 | 108.1° | 109.5° |
| C20 | C21 | C22 | 112.0° | 109.5° |
| C20 | C21 | H21 | 108.7° | 109.5° |
| C20 | C21 | H21A | 108.7° | 109.5° |
| C27 | C20 | H20 | 108.6° | 109.4° |
| C20 | C27 | C28 | 115.5° | 109.4° |
| C20 | C27 | H27 | 107.5° | 109.5° |
| C20 | C27 | H27A | 107.5° | 109.5° |
| C22 | C21 | H21 | 108.7° | 109.5° |
| C22 | C21 | H21A | 108.6° | 109.4° |
| C21 | C22 | C23 | 179.9° | 180.0° |
| H21 | C21 | H21A | 110.3° | 109.5° |
| C22 | C23 | C24 | 179.7° | 180.0° |
| C23 | C24 | C26 | 106.9° | 109.5° |
| C23 | C24 | C25 | 113.0° | 109.5° |
| C26 | C24 | C25 | 106.8° | 109.5° |
| C28 | C27 | H27 | 107.5° | 109.5° |
| C28 | C27 | H27A | 107.5° | 109.5° |
| C27 | C28 | C29 | 115.1° | 109.4° |
| C27 | C28 | H28 | 107.7° | 109.5° |
| C27 | C28 | H28A | 107.6° | 109.4° |
| H27 | C27 | H27A | 111.4° | 109.5° |
| C29 | C28 | H28 | 107.6° | 109.5° |
| C29 | C28 | H28A | 107.7° | 109.4° |
| C28 | C29 | C30 | 115.6° | 109.5° |
| C28 | C29 | H29 | 107.5° | 109.5° |
| C28 | C29 | H29A | 107.5° | 109.5° |
| H28 | C28 | H28A | 111.3° | 109.5° |
| C30 | C29 | H29 | 107.5° | 109.5° |
| C30 | C29 | H29A | 107.5° | 109.4° |
| C29 | C30 | C32 | 111.6° | 109.5° |
| C29 | C30 | C31 | 111.4° | 109.5° |
| H29 | C29 | H29A | 111.4° | 109.5° |
| C32 | C30 | C31 | 107.9° | 109.5° |
| C30 | C32 | H32 | 109.5° | 109.4° |
| C30 | C32 | H32A | 109.5° | 109.4° |
| C30 | C32 | H32B | 109.5° | 109.4° |
| C30 | C31 | H31 | 109.5° | 109.5° |
| C30 | C31 | H31A | 109.5° | 109.5° |
| C30 | C31 | H31B | 109.5° | 109.4° |
| H31 | C31 | H31A | 109.5° | 109.5° |
| H31 | C31 | H31B | 109.5° | 109.5° |
| H31A | C31 | H31B | 109.4° | 109.4° |
| H32 | C32 | H32A | 109.5° | 109.5° |
| H32 | C32 | H32B | 109.5° | 109.5° |
| H32A | C32 | H32B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C10 | C1 | C2 | O1 | 119.5° | 120.0° |
| C10 | C1 | C2 | H1 | 119.6° | 119.9° |
| C10 | C1 | O1 | H1 | 119.5° | 120.0° |
| C10 | C1 | O1 | HO1 | 180.0° | 60.0° |
| C10 | C1 | C2 | C3 | 60.1° | 63.6° |
| C10 | C1 | C2 | H2 | 179.9° | 56.5° |
| C10 | C1 | C2 | H2A | 59.9° | 176.3° |
| C1 | C10 | C5 | C4 | 43.3° | 51.4° |
| C1 | C10 | C5 | H10 | 120.0° | 119.7° |
| C1 | C10 | C5 | H10A | 120.0° | 119.8° |
| C1 | C10 | C5 | C6 | 138.6° | 128.7° |
| C1 | C10 | H10 | H10A | 119.0° | 120.5° |
| C2 | C1 | O1 | H1 | 119.8° | 120.1° |
| C2 | C1 | O1 | HO1 | 59.4° | 179.9° |
| C1 | C2 | C3 | H2 | 120.0° | 120.1° |
| C1 | C2 | C3 | H2A | 120.0° | 120.1° |
| C1 | C2 | H2 | H2A | 119.4° | 119.8° |
| C1 | C2 | C3 | O2 | 63.3° | 176.4° |
| C1 | C2 | C3 | C4 | 58.7° | 63.6° |
| C1 | C2 | C3 | H3 | 176.5° | 56.4° |
| C2 | C1 | C10 | C5 | 51.0° | 54.6° |
| C2 | C1 | C10 | H10 | 69.0° | 174.4° |
| C2 | C1 | C10 | H10A | 171.0° | 65.1° |
| O1 | C1 | C2 | C3 | 179.6° | 56.4° |
| O1 | C1 | C2 | H2 | 60.4° | 176.5° |
| O1 | C1 | C2 | H2A | 59.6° | 63.7° |
| O1 | C1 | C10 | C5 | 170.3° | 65.4° |
| O1 | C1 | C10 | H10 | 50.3° | 54.3° |
| O1 | C1 | C10 | H10A | 69.7° | 174.9° |
| H1 | C1 | O1 | HO1 | 60.4° | 60.0° |
| H1 | C1 | C2 | C3 | 59.5° | 176.5° |
| H1 | C1 | C2 | H2 | 60.5° | 63.4° |
| H1 | C1 | C2 | H2A | 179.5° | 56.4° |
| H1 | C1 | C10 | C5 | 68.8° | 174.5° |
| H1 | C1 | C10 | H10 | 171.1° | 65.7° |
| H1 | C1 | C10 | H10A | 51.2° | 54.8° |
| F1 | C26 | F2 | F3 | 126.5° | 120.0° |
| F1 | C26 | F2 | C24 | 113.8° | 120.1° |
| F1 | C26 | F3 | C24 | 115.7° | 120.0° |
| F1 | C26 | C24 | O3 | 26.6° | 60.0° |
| F1 | C26 | C24 | C23 | 149.7° | 59.9° |
| F1 | C26 | C24 | C25 | 89.2° | 180.0° |
| C3 | C2 | H2 | H2A | 119.5° | 119.9° |
| C2 | C3 | O2 | C4 | 123.2° | 119.9° |
| C2 | C3 | O2 | H3 | 119.0° | 120.0° |
| C2 | C3 | O2 | HO2 | 180.0° | 180.0° |
| C2 | C3 | C4 | H3 | 118.8° | 120.0° |
| C2 | C3 | C4 | C5 | 47.4° | 54.7° |
| C2 | C3 | C4 | H4 | 167.4° | 65.1° |
| C2 | C3 | C4 | H4A | 72.6° | 174.4° |
| H2 | C2 | C3 | O2 | 56.6° | 63.5° |
| H2 | C2 | C3 | C4 | 178.6° | 56.5° |
| H2 | C2 | C3 | H3 | 63.5° | 176.5° |
| H2A | C2 | C3 | O2 | 176.7° | 56.3° |
| H2A | C2 | C3 | C4 | 61.3° | 176.3° |
| H2A | C2 | C3 | H3 | 56.5° | 63.7° |
| F2 | C26 | F3 | C24 | 120.3° | 120.0° |
| F2 | C26 | C24 | O3 | 91.1° | 60.0° |
| F2 | C26 | C24 | C23 | 32.0° | 180.0° |
| F2 | C26 | C24 | C25 | 153.2° | 60.0° |
| O2 | C3 | C4 | H3 | 120.1° | 120.1° |
| O2 | C3 | C4 | C5 | 73.6° | 174.6° |
| O2 | C3 | C4 | H4 | 46.4° | 54.8° |
| O2 | C3 | C4 | H4A | 166.4° | 65.7° |
| HO2 | O2 | C3 | C4 | 56.9° | 60.1° |
| HO2 | O2 | C3 | H3 | 61.0° | 60.0° |
| C3 | C4 | C5 | H4 | 120.0° | 119.7° |
| C3 | C4 | C5 | H4A | 120.0° | 119.6° |
| C3 | C4 | H4 | H4A | 119.2° | 120.4° |
| C3 | C4 | C5 | C10 | 41.0° | 51.4° |
| C3 | C4 | C5 | C6 | 140.9° | 128.7° |
| H3 | C3 | C4 | C5 | 166.3° | 65.3° |
| H3 | C3 | C4 | H4 | 73.7° | 174.9° |
| H3 | C3 | C4 | H4A | 46.3° | 54.4° |
| F3 | C26 | C24 | O3 | 148.8° | 180.0° |
| F3 | C26 | C24 | C23 | 88.1° | 60.1° |
| F3 | C26 | C24 | C25 | 33.1° | 60.0° |
| O3 | C24 | C25 | F4 | 61.9° | 60.0° |
| O3 | C24 | C25 | F5 | 57.0° | 60.0° |
| O3 | C24 | C25 | F6 | 177.7° | 180.0° |
| O3 | C24 | C23 | C22 | 66.0° | 145.6° |
| O3 | C24 | C23 | C26 | 116.5° | 119.9° |
| O3 | C24 | C23 | C25 | 126.3° | 120.0° |
| O3 | C24 | C26 | C25 | 115.7° | 120.0° |
| HO3 | O3 | C24 | C23 | 180.0° | 60.0° |
| HO3 | O3 | C24 | C26 | 62.4° | 180.0° |
| HO3 | O3 | C24 | C25 | 51.7° | 60.0° |
| C5 | C4 | H4 | H4A | 119.2° | 120.5° |
| C4 | C5 | C10 | C6 | 178.1° | 180.0° |
| C4 | C5 | C6 | C7 | 179.9° | 175.1° |
| C4 | C5 | C6 | H6 | 0.1° | 4.8° |
| C4 | C5 | C10 | H10 | 76.7° | 171.1° |
| C4 | C5 | C10 | H10A | 163.3° | 68.4° |
| H4 | C4 | C5 | C10 | 160.9° | 68.3° |
| H4 | C4 | C5 | C6 | 20.9° | 111.6° |
| H4A | C4 | C5 | C10 | 79.0° | 171.0° |
| H4A | C4 | C5 | C6 | 99.1° | 9.0° |
| F4 | C25 | F5 | F6 | 119.9° | 120.0° |
| F4 | C25 | F5 | C24 | 117.0° | 120.0° |
| F4 | C25 | F6 | C24 | 116.6° | 120.0° |
| F4 | C25 | C24 | C23 | 168.5° | 180.0° |
| F4 | C25 | C24 | C26 | 51.2° | 60.0° |
| O4 | C30 | C29 | C28 | 64.0° | 59.5° |
| O4 | C30 | C29 | C32 | 120.9° | 120.0° |
| O4 | C30 | C29 | C31 | 118.5° | 120.0° |
| O4 | C30 | C29 | H29 | 176.0° | 60.6° |
| O4 | C30 | C29 | H29A | 56.0° | 179.4° |
| O4 | C30 | C32 | C31 | 115.5° | 120.0° |
| O4 | C30 | C31 | H31 | 180.0° | 65.2° |
| O4 | C30 | C31 | H31A | 60.0° | 174.8° |
| O4 | C30 | C31 | H31B | 60.0° | 54.8° |
| O4 | C30 | C32 | H32 | 180.0° | 60.0° |
| O4 | C30 | C32 | H32A | 60.0° | 180.0° |
| O4 | C30 | C32 | H32B | 60.0° | 60.0° |
| HO4 | O4 | C30 | C29 | 180.0° | 180.0° |
| HO4 | O4 | C30 | C32 | 57.4° | 60.0° |
| HO4 | O4 | C30 | C31 | 58.8° | 60.0° |
| C10 | C5 | C6 | C7 | 2.0° | 4.9° |
| C10 | C5 | C6 | H6 | 178.0° | 175.1° |
| C5 | C10 | H10 | H10A | 118.9° | 120.4° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | C8 | 157.0° | 174.6° |
| C5 | C6 | C7 | H7 | 23.0° | 5.4° |
| C6 | C5 | C10 | H10 | 101.4° | 8.9° |
| C6 | C5 | C10 | H10A | 18.6° | 111.6° |
| F5 | C25 | F6 | C24 | 121.1° | 120.0° |
| F5 | C25 | C24 | C23 | 72.6° | 60.0° |
| F5 | C25 | C24 | C26 | 170.2° | 180.0° |
| C6 | C7 | C8 | H7 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 2.1° | 0.2° |
| C6 | C7 | C8 | C14 | 179.7° | 180.0° |
| H6 | C6 | C7 | C8 | 23.0° | 5.4° |
| H6 | C6 | C7 | H7 | 157.0° | 174.6° |
| F6 | C25 | C24 | C23 | 52.6° | 60.0° |
| F6 | C25 | C24 | C26 | 64.6° | 60.0° |
| C7 | C8 | C9 | C14 | 177.8° | 179.8° |
| C7 | C8 | C9 | C11 | 124.8° | 129.8° |
| C7 | C8 | C9 | H9 | 115.2° | 109.9° |
| C7 | C8 | C9 | H9A | 4.8° | 9.5° |
| C7 | C8 | C14 | C13 | 115.0° | 121.9° |
| C7 | C8 | C14 | C15 | 3.0° | 10.4° |
| C7 | C8 | C14 | H14 | 119.6° | 118.1° |
| H7 | C7 | C8 | C9 | 177.9° | 179.7° |
| H7 | C7 | C8 | C14 | 0.3° | 0.1° |
| C8 | C9 | C11 | H9 | 120.0° | 120.3° |
| C8 | C9 | C11 | H9A | 120.0° | 120.3° |
| C8 | C9 | H9 | H9A | 120.2° | 119.4° |
| C8 | C9 | C11 | C12 | 46.7° | 48.6° |
| C8 | C9 | C11 | H11 | 166.7° | 169.2° |
| C8 | C9 | C11 | H11A | 73.3° | 72.0° |
| C9 | C8 | C14 | C13 | 62.7° | 57.9° |
| C9 | C8 | C14 | C15 | 179.3° | 169.4° |
| C9 | C8 | C14 | H14 | 62.7° | 62.1° |
| C14 | C8 | C9 | C11 | 53.0° | 50.0° |
| C14 | C8 | C9 | H9 | 67.0° | 70.3° |
| C14 | C8 | C9 | H9A | 173.0° | 170.3° |
| C8 | C14 | C13 | C12 | 63.3° | 66.4° |
| C8 | C14 | C13 | C18 | 57.6° | 51.9° |
| C8 | C14 | C13 | C17 | 173.7° | 167.7° |
| C8 | C14 | C13 | C15 | 127.9° | 122.1° |
| C8 | C14 | C13 | H14 | 114.8° | 120.0° |
| C8 | C14 | C15 | H14 | 114.4° | 128.3° |
| C8 | C14 | C15 | C16 | 151.2° | 156.2° |
| C8 | C14 | C15 | H15 | 31.2° | 37.9° |
| C8 | C14 | C15 | H15A | 88.8° | 85.3° |
| C11 | C9 | H9 | H9A | 120.3° | 119.4° |
| C9 | C11 | C12 | H11 | 120.0° | 120.6° |
| C9 | C11 | C12 | H11A | 120.0° | 120.6° |
| C9 | C11 | H11 | H11A | 118.0° | 118.8° |
| C9 | C11 | C12 | C13 | 51.8° | 59.1° |
| C9 | C11 | C12 | H12 | 68.2° | 60.5° |
| C9 | C11 | C12 | H12A | 171.8° | 178.6° |
| H9 | C9 | C11 | C12 | 73.3° | 71.7° |
| H9 | C9 | C11 | H11 | 46.7° | 48.9° |
| H9 | C9 | C11 | H11A | 166.7° | 167.7° |
| H9A | C9 | C11 | C12 | 166.7° | 168.9° |
| H9A | C9 | C11 | H11 | 73.3° | 70.5° |
| H9A | C9 | C11 | H11A | 46.7° | 48.3° |
| C12 | C11 | H11 | H11A | 118.0° | 118.9° |
| C11 | C12 | C13 | H12 | 120.0° | 119.5° |
| C11 | C12 | C13 | H12A | 120.0° | 119.4° |
| C11 | C12 | H12 | H12A | 119.3° | 120.9° |
| C11 | C12 | C13 | C18 | 60.0° | 49.7° |
| C11 | C12 | C13 | C17 | 172.5° | 175.6° |
| C11 | C12 | C13 | C14 | 58.9° | 68.0° |
| H11 | C11 | C12 | C13 | 171.8° | 179.7° |
| H11 | C11 | C12 | H12 | 51.8° | 60.1° |
| H11 | C11 | C12 | H12A | 68.2° | 60.9° |
| H11A | C11 | C12 | C13 | 68.2° | 61.5° |
| H11A | C11 | C12 | H12 | 171.7° | 178.9° |
| H11A | C11 | C12 | H12A | 51.8° | 58.0° |
| C13 | C12 | H12 | H12A | 119.3° | 121.0° |
| C12 | C13 | C18 | C17 | 130.8° | 130.9° |
| C12 | C13 | C18 | C14 | 119.0° | 117.2° |
| C12 | C13 | C17 | C14 | 117.3° | 118.8° |
| C12 | C13 | C14 | C15 | 168.8° | 171.6° |
| C12 | C13 | C14 | H14 | 51.5° | 53.6° |
| C12 | C13 | C17 | C16 | 159.0° | 149.4° |
| C12 | C13 | C17 | C20 | 75.2° | 92.3° |
| C12 | C13 | C17 | H17 | 37.0° | 30.0° |
| C12 | C13 | C18 | H18 | 180.0° | 64.8° |
| C12 | C13 | C18 | H18A | 60.0° | 175.3° |
| C12 | C13 | C18 | H18B | 60.0° | 55.2° |
| H12 | C12 | C13 | C18 | 180.0° | 169.3° |
| H12 | C12 | C13 | C17 | 52.4° | 64.9° |
| H12 | C12 | C13 | C14 | 61.1° | 51.6° |
| H12A | C12 | C13 | C18 | 60.0° | 69.7° |
| H12A | C12 | C13 | C17 | 67.5° | 56.1° |
| H12A | C12 | C13 | C14 | 178.9° | 172.6° |
| C18 | C13 | C17 | C14 | 114.5° | 115.4° |
| C18 | C13 | C14 | C15 | 70.3° | 70.2° |
| C18 | C13 | C14 | H14 | 172.4° | 171.9° |
| C18 | C13 | C17 | C16 | 72.8° | 84.7° |
| C18 | C13 | C17 | C20 | 52.9° | 33.6° |
| C18 | C13 | C17 | H17 | 165.1° | 155.9° |
| C13 | C18 | H18 | H18A | 120.0° | 120.0° |
| C13 | C18 | H18 | H18B | 120.0° | 120.0° |
| C13 | C18 | H18A | H18B | 120.0° | 120.1° |
| C17 | C13 | C14 | C15 | 45.8° | 45.7° |
| C17 | C13 | C14 | H14 | 71.5° | 72.3° |
| C13 | C17 | C16 | C15 | 22.8° | 4.4° |
| C13 | C17 | C16 | C20 | 127.2° | 118.6° |
| C13 | C17 | C16 | H17 | 120.3° | 119.1° |
| C13 | C17 | C16 | H16 | 97.2° | 115.0° |
| C13 | C17 | C16 | H16A | 142.8° | 123.5° |
| C13 | C17 | C20 | H17 | 119.2° | 122.2° |
| C17 | C13 | C18 | H18 | 49.2° | 164.4° |
| C17 | C13 | C18 | H18A | 70.8° | 44.4° |
| C17 | C13 | C18 | H18B | 169.2° | 75.7° |
| C13 | C17 | C20 | C21 | 109.2° | 174.3° |
| C13 | C17 | C20 | C27 | 127.2° | 65.7° |
| C13 | C17 | C20 | H20 | 8.9° | 54.3° |
| C13 | C14 | C15 | H14 | 125.5° | 117.6° |
| C13 | C14 | C15 | C16 | 31.1° | 42.1° |
| C13 | C14 | C15 | H15 | 89.0° | 76.2° |
| C13 | C14 | C15 | H15A | 151.1° | 160.6° |
| C14 | C13 | C17 | C16 | 41.7° | 30.7° |
| C14 | C13 | C17 | C20 | 167.4° | 149.0° |
| C14 | C13 | C17 | H17 | 80.4° | 88.8° |
| C14 | C13 | C18 | H18 | 61.0° | 52.4° |
| C14 | C13 | C18 | H18A | 179.0° | 67.5° |
| C14 | C13 | C18 | H18B | 59.0° | 172.4° |
| C14 | C15 | C16 | H15 | 120.0° | 118.3° |
| C14 | C15 | C16 | H15A | 120.0° | 118.4° |
| C14 | C15 | H15 | H15A | 122.3° | 123.2° |
| C14 | C15 | C16 | C17 | 4.9° | 23.8° |
| C14 | C15 | C16 | H16 | 124.9° | 143.4° |
| C14 | C15 | C16 | H16A | 115.1° | 95.1° |
| H14 | C14 | C15 | C16 | 94.4° | 75.6° |
| H14 | C14 | C15 | H15 | 145.6° | 166.2° |
| H14 | C14 | C15 | H15A | 25.6° | 43.0° |
| C16 | C15 | H15 | H15A | 122.3° | 123.4° |
| C15 | C16 | C17 | H16 | 120.0° | 119.5° |
| C15 | C16 | C17 | H16A | 120.0° | 119.0° |
| C15 | C16 | H16 | H16A | 121.0° | 121.5° |
| C15 | C16 | C17 | C20 | 150.0° | 123.1° |
| C15 | C16 | C17 | H17 | 97.5° | 114.7° |
| H15 | C15 | C16 | C17 | 115.1° | 94.6° |
| H15 | C15 | C16 | H16 | 4.9° | 25.1° |
| H15 | C15 | C16 | H16A | 124.9° | 146.6° |
| H15A | C15 | C16 | C17 | 124.9° | 142.2° |
| H15A | C15 | C16 | H16 | 115.1° | 98.1° |
| H15A | C15 | C16 | H16A | 4.9° | 23.4° |
| C17 | C16 | H16 | H16A | 121.0° | 121.3° |
| C16 | C17 | C20 | H17 | 121.2° | 122.5° |
| C16 | C17 | C20 | C21 | 10.4° | 59.0° |
| C16 | C17 | C20 | C27 | 113.2° | 179.0° |
| C16 | C17 | C20 | H20 | 128.5° | 61.0° |
| H16 | C16 | C17 | C20 | 30.1° | 3.6° |
| H16 | C16 | C17 | H17 | 142.5° | 125.8° |
| H16A | C16 | C17 | C20 | 90.0° | 117.9° |
| H16A | C16 | C17 | H17 | 22.5° | 4.4° |
| C17 | C20 | C21 | C27 | 124.2° | 120.0° |
| C17 | C20 | C21 | H20 | 117.3° | 120.1° |
| C17 | C20 | C27 | H20 | 117.3° | 120.0° |
| C17 | C20 | C21 | C22 | 173.8° | 175.0° |
| C17 | C20 | C21 | H21 | 53.7° | 55.0° |
| C17 | C20 | C21 | H21A | 66.2° | 65.0° |
| C17 | C20 | C27 | C28 | 83.3° | 55.3° |
| C17 | C20 | C27 | H27 | 36.7° | 64.7° |
| C17 | C20 | C27 | H27A | 156.7° | 175.3° |
| H17 | C17 | C20 | C21 | 131.5° | 63.5° |
| H17 | C17 | C20 | C27 | 8.0° | 56.5° |
| H17 | C17 | C20 | H20 | 110.4° | 176.5° |
| H18 | C18 | H18A | H18B | 120.0° | 120.0° |
| C21 | C20 | C27 | H20 | 118.2° | 120.0° |
| C20 | C21 | C22 | H21 | 120.0° | 120.0° |
| C20 | C21 | C22 | H21A | 120.0° | 120.0° |
| C20 | C21 | H21 | H21A | 119.0° | 120.0° |
| C20 | C21 | C22 | C23 | 163.9° | 166.9° |
| C21 | C20 | C27 | C28 | 41.2° | 64.7° |
| C21 | C20 | C27 | H27 | 161.2° | 175.3° |
| C21 | C20 | C27 | H27A | 78.8° | 55.3° |
| C27 | C20 | C21 | C22 | 62.0° | 65.0° |
| C27 | C20 | C21 | H21 | 178.0° | 175.0° |
| C27 | C20 | C21 | H21A | 58.0° | 55.0° |
| C20 | C27 | C28 | H27 | 120.0° | 120.0° |
| C20 | C27 | C28 | H27A | 120.0° | 120.0° |
| C20 | C27 | H27 | H27A | 117.5° | 120.0° |
| C20 | C27 | C28 | C29 | 112.3° | 175.0° |
| C20 | C27 | C28 | H28 | 127.7° | 55.0° |
| C20 | C27 | C28 | H28A | 7.7° | 65.0° |
| H20 | C20 | C21 | C22 | 56.5° | 55.0° |
| H20 | C20 | C21 | H21 | 63.5° | 65.0° |
| H20 | C20 | C21 | H21A | 176.5° | 175.0° |
| H20 | C20 | C27 | C28 | 159.4° | 175.3° |
| H20 | C20 | C27 | H27 | 80.6° | 55.4° |
| H20 | C20 | C27 | H27A | 39.4° | 64.7° |
| C22 | C21 | H21 | H21A | 119.0° | 120.0° |
| C21 | C22 | C23 | C24 | 162.7° | 158.7° |
| H21 | C21 | C22 | C23 | 43.9° | 73.1° |
| H21A | C21 | C22 | C23 | 76.1° | 46.9° |
| C22 | C23 | C24 | C26 | 50.5° | 94.5° |
| C22 | C23 | C24 | C25 | 167.7° | 25.6° |
| C23 | C24 | C26 | C25 | 121.2° | 120.1° |
| C28 | C27 | H27 | H27A | 117.6° | 120.0° |
| C27 | C28 | C29 | H28 | 120.0° | 120.0° |
| C27 | C28 | C29 | H28A | 120.0° | 119.9° |
| C27 | C28 | H28 | H28A | 117.7° | 120.0° |
| C27 | C28 | C29 | C30 | 161.4° | 174.9° |
| C27 | C28 | C29 | H29 | 78.6° | 54.8° |
| C27 | C28 | C29 | H29A | 41.3° | 65.2° |
| H27 | C27 | C28 | C29 | 7.7° | 65.0° |
| H27 | C27 | C28 | H28 | 112.3° | 175.0° |
| H27 | C27 | C28 | H28A | 127.7° | 55.0° |
| H27A | C27 | C28 | C29 | 127.7° | 55.0° |
| H27A | C27 | C28 | H28 | 7.8° | 65.0° |
| H27A | C27 | C28 | H28A | 112.3° | 175.0° |
| C29 | C28 | H28 | H28A | 117.7° | 120.0° |
| C28 | C29 | C30 | H29 | 120.0° | 120.1° |
| C28 | C29 | C30 | H29A | 120.0° | 120.0° |
| C28 | C29 | H29 | H29A | 117.4° | 120.0° |
| C28 | C29 | C30 | C32 | 56.9° | 179.4° |
| C28 | C29 | C30 | C31 | 177.5° | 60.6° |
| H28 | C28 | C29 | C30 | 41.3° | 65.1° |
| H28 | C28 | C29 | H29 | 161.4° | 174.9° |
| H28 | C28 | C29 | H29A | 78.7° | 54.8° |
| H28A | C28 | C29 | C30 | 78.7° | 54.9° |
| H28A | C28 | C29 | H29 | 41.4° | 65.1° |
| H28A | C28 | C29 | H29A | 161.3° | 174.9° |
| C30 | C29 | H29 | H29A | 117.5° | 119.9° |
| C29 | C30 | C32 | C31 | 122.6° | 120.0° |
| C29 | C30 | C31 | H31 | 59.4° | 174.8° |
| C29 | C30 | C31 | H31A | 60.7° | 54.8° |
| C29 | C30 | C31 | H31B | 179.4° | 65.2° |
| C29 | C30 | C32 | H32 | 58.1° | 60.0° |
| C29 | C30 | C32 | H32A | 178.1° | 60.0° |
| C29 | C30 | C32 | H32B | 61.9° | 180.0° |
| H29 | C29 | C30 | C32 | 63.1° | 59.4° |
| H29 | C29 | C30 | C31 | 57.5° | 179.4° |
| H29A | C29 | C30 | C32 | 176.9° | 60.6° |
| H29A | C29 | C30 | C31 | 62.5° | 59.4° |
| C32 | C30 | C31 | H31 | 63.4° | 54.8° |
| C32 | C30 | C31 | H31A | 176.6° | 65.3° |
| C32 | C30 | C31 | H31B | 56.6° | 174.8° |
| C30 | C32 | H32 | H32A | 120.0° | 119.9° |
| C30 | C32 | H32 | H32B | 120.0° | 119.9° |
| C30 | C32 | H32A | H32B | 120.0° | 120.0° |
| C30 | C31 | H31 | H31A | 120.0° | 120.1° |
| C30 | C31 | H31 | H31B | 120.0° | 120.0° |
| C30 | C31 | H31A | H31B | 120.0° | 120.0° |
| C31 | C30 | C32 | H32 | 64.5° | 180.0° |
| C31 | C30 | C32 | H32A | 55.5° | 60.0° |
| C31 | C30 | C32 | H32B | 175.5° | 60.0° |
| H31 | C31 | H31A | H31B | 120.0° | 120.0° |
| H32 | C32 | H32A | H32B | 120.0° | 120.1° |
