COV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.56Å | |
| C1 | C10 | sing | 1.52Å | 1.55Å | |
| C1 | O1 | sing | 1.43Å | 1.43Å | |
| C20 | C17 | sing | 1.53Å | 1.62Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | C22 | sing | 1.54Å | 1.56Å | |
| C20 | O21 | sing | 1.43Å | 1.43Å | |
| C2 | C3 | sing | 1.53Å | 1.56Å | |
| C25 | C26 | sing | 1.53Å | 1.52Å | |
| C25 | C27 | sing | 1.53Å | 1.54Å | |
| C25 | C24 | sing | 1.53Å | 1.55Å | |
| C25 | O25 | sing | 1.43Å | 1.44Å | |
| C3 | C4 | sing | 1.53Å | 1.56Å | |
| C3 | O3 | sing | 1.43Å | 1.44Å | |
| C4 | C5 | sing | 1.52Å | 1.54Å | |
| C5 | C6 | doub | 1.35Å | 1.37Å | |
| C5 | C10 | sing | 1.48Å | 1.53Å | |
| C6 | C7 | sing | 1.46Å | 1.48Å | |
| C7 | C8 | doub | 1.33Å | 1.35Å | |
| C8 | C9 | sing | 1.52Å | 1.55Å | |
| C8 | C14 | sing | 1.50Å | 1.54Å | |
| C9 | C11 | sing | 1.53Å | 1.57Å | |
| C10 | C19 | doub | 1.33Å | 1.38Å | |
| C11 | C12 | sing | 1.54Å | 1.57Å | |
| C12 | C13 | sing | 1.51Å | 1.60Å | |
| C13 | C14 | sing | 1.55Å | 1.59Å | |
| C13 | C17 | sing | 1.52Å | 1.56Å | |
| C13 | C18 | sing | 1.53Å | 1.61Å | |
| C14 | C15 | sing | 1.53Å | 1.59Å | |
| C15 | C16 | sing | 1.55Å | 1.56Å | |
| C16 | C17 | sing | 1.54Å | 1.56Å | |
| C22 | C23 | sing | 1.55Å | 1.55Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C23 | C28 | sing | 1.55Å | 1.52Å | |
| C28 | O21 | sing | 1.44Å | 1.42Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H26A | sing | 1.09Å | 1.10Å | |
| C26 | H26B | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C27 | H27B | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| 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 | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C19 | H19A | sing | 1.08Å | 1.08Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H21A | sing | 1.09Å | 1.10Å | |
| C21 | H21B | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H22A | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H24A | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| O25 | HO25 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C10 | 110.9° | 108.4° |
| C2 | C1 | O1 | 108.6° | 109.7° |
| C1 | C2 | C3 | 112.1° | 109.8° |
| C2 | C1 | H1 | 109.4° | 109.7° |
| C1 | C2 | H2 | 108.6° | 109.4° |
| C1 | C2 | H2A | 108.0° | 109.4° |
| C10 | C1 | O1 | 110.2° | 109.7° |
| C1 | C10 | C5 | 114.1° | 116.8° |
| C1 | C10 | C19 | 121.7° | 121.6° |
| C10 | C1 | H1 | 107.7° | 109.7° |
| O1 | C1 | H1 | 110.1° | 109.7° |
| C1 | O1 | HO1 | 109.5° | 114.0° |
| C17 | C20 | C21 | 108.6° | 109.8° |
| C17 | C20 | C22 | 117.9° | 109.8° |
| C17 | C20 | O21 | 110.0° | 109.9° |
| C20 | C17 | C13 | 118.3° | 110.3° |
| C20 | C17 | C16 | 112.9° | 109.8° |
| C20 | C17 | H17 | 98.7° | 110.3° |
| C21 | C20 | C22 | 105.9° | 109.8° |
| C21 | C20 | O21 | 108.2° | 109.9° |
| C20 | C21 | H21 | 109.5° | 109.5° |
| C20 | C21 | H21A | 109.5° | 109.4° |
| C20 | C21 | H21B | 109.5° | 109.5° |
| C22 | C20 | O21 | 105.8° | 107.7° |
| C20 | C22 | C23 | 101.8° | 102.2° |
| C20 | C22 | H22 | 112.1° | 110.9° |
| C20 | C22 | H22A | 113.7° | 110.9° |
| C20 | O21 | C28 | 110.5° | 109.9° |
| C2 | C3 | C4 | 112.6° | 109.8° |
| C2 | C3 | O3 | 108.7° | 109.4° |
| C3 | C2 | H2 | 108.6° | 109.4° |
| C3 | C2 | H2A | 108.0° | 109.4° |
| C2 | C3 | H3 | 107.6° | 109.5° |
| C26 | C25 | C27 | 109.2° | 109.5° |
| C26 | C25 | C24 | 114.0° | 109.5° |
| C26 | C25 | O25 | 107.2° | 109.5° |
| C25 | C26 | H26 | 109.5° | 109.5° |
| C25 | C26 | H26A | 109.5° | 109.4° |
| C25 | C26 | H26B | 109.5° | 109.5° |
| C27 | C25 | C24 | 110.0° | 109.4° |
| C27 | C25 | O25 | 107.2° | 109.5° |
| C25 | C27 | H27 | 109.5° | 109.5° |
| C25 | C27 | H27A | 109.5° | 109.5° |
| C25 | C27 | H27B | 109.4° | 109.5° |
| C24 | C25 | O25 | 109.1° | 109.4° |
| C25 | C24 | C23 | 118.4° | 109.5° |
| C25 | C24 | H24 | 106.6° | 109.5° |
| C25 | C24 | H24A | 104.5° | 109.5° |
| C25 | O25 | HO25 | 109.5° | 114.0° |
| C4 | C3 | O3 | 108.5° | 109.4° |
| C3 | C4 | C5 | 113.0° | 108.3° |
| C4 | C3 | H3 | 107.8° | 109.4° |
| C3 | C4 | H4 | 108.3° | 109.7° |
| C3 | C4 | H4A | 107.5° | 109.7° |
| O3 | C3 | H3 | 111.7° | 109.4° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| C4 | C5 | C6 | 117.5° | 121.6° |
| C4 | C5 | C10 | 115.0° | 116.8° |
| C5 | C4 | H4 | 108.3° | 109.7° |
| C5 | C4 | H4A | 107.5° | 109.7° |
| C6 | C5 | C10 | 127.5° | 121.6° |
| C5 | C6 | C7 | 128.0° | 120.0° |
| C5 | C6 | H6 | 116.0° | 120.0° |
| C5 | C10 | C19 | 124.3° | 121.6° |
| C6 | C7 | C8 | 126.2° | 120.0° |
| C7 | C6 | H6 | 116.0° | 120.0° |
| C6 | C7 | H7 | 116.9° | 120.0° |
| C7 | C8 | C9 | 124.5° | 122.4° |
| C7 | C8 | C14 | 123.3° | 122.4° |
| C8 | C7 | H7 | 116.9° | 120.0° |
| C9 | C8 | C14 | 112.2° | 115.2° |
| C8 | C9 | C11 | 111.7° | 110.8° |
| C8 | C9 | H9 | 108.7° | 109.2° |
| C8 | C9 | H9A | 108.2° | 109.3° |
| C8 | C14 | C13 | 111.0° | 105.8° |
| C8 | C14 | C15 | 120.1° | 116.7° |
| C8 | C14 | H14 | 98.7° | 110.7° |
| C9 | C11 | C12 | 112.9° | 111.8° |
| C11 | C9 | H9 | 108.7° | 109.2° |
| C11 | C9 | H9A | 108.2° | 109.2° |
| C9 | C11 | H11 | 108.4° | 109.1° |
| C9 | C11 | H11A | 107.5° | 109.0° |
| C10 | C19 | H19 | 104.9° | 119.9° |
| C10 | C19 | H19A | 127.6° | 120.0° |
| C11 | C12 | C13 | 115.8° | 107.6° |
| C12 | C11 | H11 | 108.4° | 109.0° |
| C12 | C11 | H11A | 107.6° | 109.0° |
| C11 | C12 | H12 | 107.4° | 109.8° |
| C11 | C12 | H12A | 106.0° | 109.9° |
| C12 | C13 | C14 | 106.0° | 107.7° |
| C12 | C13 | C17 | 118.1° | 118.4° |
| C12 | C13 | C18 | 107.2° | 109.3° |
| C13 | C12 | H12 | 107.4° | 109.9° |
| C13 | C12 | H12A | 105.9° | 109.8° |
| C14 | C13 | C17 | 96.8° | 103.2° |
| C14 | C13 | C18 | 112.9° | 109.1° |
| C13 | C14 | C15 | 102.3° | 101.1° |
| C13 | C14 | H14 | 117.6° | 110.8° |
| C17 | C13 | C18 | 115.2° | 108.8° |
| C13 | C17 | C16 | 103.2° | 105.0° |
| C13 | C17 | H17 | 109.2° | 110.3° |
| C13 | C18 | H18 | 109.5° | 109.5° |
| C13 | C18 | H18A | 109.5° | 109.5° |
| C13 | C18 | H18B | 109.5° | 109.5° |
| C14 | C15 | C16 | 103.8° | 102.8° |
| C15 | C14 | H14 | 108.1° | 111.2° |
| C14 | C15 | H15 | 111.4° | 110.8° |
| C14 | C15 | H15A | 112.6° | 110.8° |
| C15 | C16 | C17 | 105.3° | 106.4° |
| C16 | C15 | H15 | 111.4° | 110.7° |
| C16 | C15 | H15A | 112.6° | 110.8° |
| C15 | C16 | H16 | 110.9° | 110.1° |
| C15 | C16 | H16A | 111.8° | 110.0° |
| C17 | C16 | H16 | 110.9° | 110.4° |
| C17 | C16 | H16A | 111.8° | 109.7° |
| C16 | C17 | H17 | 115.0° | 111.0° |
| C22 | C23 | C24 | 113.0° | 111.1° |
| C22 | C23 | C28 | 100.7° | 101.0° |
| C23 | C22 | H22 | 112.1° | 110.8° |
| C23 | C22 | H22A | 113.7° | 110.9° |
| C22 | C23 | H23 | 115.1° | 111.1° |
| C24 | C23 | C28 | 115.1° | 111.1° |
| C24 | C23 | H23 | 100.7° | 110.9° |
| C23 | C24 | H24 | 106.6° | 109.5° |
| C23 | C24 | H24A | 104.5° | 109.4° |
| C23 | C28 | O21 | 106.0° | 105.1° |
| C28 | C23 | H23 | 113.0° | 111.2° |
| C23 | C28 | H28 | 110.7° | 110.3° |
| C23 | C28 | H28A | 111.4° | 110.3° |
| O21 | C28 | H28 | 110.6° | 110.4° |
| O21 | C28 | H28A | 111.5° | 110.2° |
| H2 | C2 | H2A | 111.6° | 109.4° |
| H26 | C26 | H26A | 109.4° | 109.5° |
| H26 | C26 | H26B | 109.5° | 109.5° |
| H26A | C26 | H26B | 109.5° | 109.5° |
| H27 | C27 | H27A | 109.5° | 109.5° |
| H27 | C27 | H27B | 109.5° | 109.5° |
| H27A | C27 | H27B | 109.5° | 109.4° |
| H4 | C4 | H4A | 112.3° | 109.7° |
| H9 | C9 | H9A | 111.3° | 109.1° |
| H11 | C11 | H11A | 112.2° | 109.0° |
| H12 | C12 | H12A | 114.6° | 109.9° |
| H15 | C15 | H15A | 105.2° | 110.8° |
| H16 | C16 | H16A | 106.3° | 110.1° |
| H18 | C18 | H18A | 109.5° | 109.5° |
| H18 | C18 | H18B | 109.4° | 109.4° |
| H18A | C18 | H18B | 109.5° | 109.4° |
| H19 | C19 | H19A | 127.5° | 120.1° |
| H21 | C21 | H21A | 109.4° | 109.5° |
| H21 | C21 | H21B | 109.5° | 109.5° |
| H21A | C21 | H21B | 109.5° | 109.4° |
| H22 | C22 | H22A | 103.7° | 110.9° |
| H24 | C24 | H24A | 116.7° | 109.5° |
| H28 | C28 | H28A | 106.8° | 110.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C10 | O1 | 120.2° | 119.7° |
| C2 | C1 | C10 | H1 | 119.7° | 119.7° |
| C2 | C1 | O1 | H1 | 119.7° | 120.5° |
| C1 | C2 | C3 | H2 | 120.0° | 120.1° |
| C1 | C2 | C3 | H2A | 118.9° | 120.1° |
| C1 | C2 | C3 | C4 | 53.5° | 66.2° |
| C1 | C2 | C3 | O3 | 66.8° | 173.7° |
| C2 | C1 | C10 | C5 | 51.4° | 46.6° |
| C2 | C1 | C10 | C19 | 127.3° | 133.4° |
| C1 | C2 | H2 | H2A | 118.9° | 119.9° |
| C1 | C2 | C3 | H3 | 172.1° | 53.9° |
| C2 | C1 | O1 | HO1 | 101.5° | 179.9° |
| C10 | C1 | O1 | H1 | 118.7° | 120.5° |
| C10 | C1 | C2 | C3 | 54.5° | 57.7° |
| C1 | C10 | C5 | C4 | 47.6° | 43.1° |
| C1 | C10 | C5 | C6 | 132.2° | 136.9° |
| C1 | C10 | C5 | C19 | 178.7° | 180.0° |
| C10 | C1 | C2 | H2 | 174.5° | 62.4° |
| C10 | C1 | C2 | H2A | 64.3° | 177.8° |
| C1 | C10 | C19 | H19 | 0.7° | 0.0° |
| C1 | C10 | C19 | H19A | 179.3° | 180.0° |
| C10 | C1 | O1 | HO1 | 136.8° | 61.1° |
| O1 | C1 | C2 | C3 | 175.7° | 62.0° |
| O1 | C1 | C10 | C5 | 171.7° | 73.1° |
| O1 | C1 | C10 | C19 | 7.0° | 106.8° |
| O1 | C1 | C2 | H2 | 64.3° | 177.9° |
| O1 | C1 | C2 | H2A | 56.9° | 58.0° |
| C17 | C20 | C21 | C22 | 127.5° | 120.8° |
| C17 | C20 | C21 | O21 | 119.4° | 120.9° |
| C17 | C20 | C22 | O21 | 123.6° | 119.6° |
| C20 | C17 | C13 | C12 | 71.9° | 92.3° |
| C20 | C17 | C13 | C14 | 175.9° | 149.0° |
| C20 | C17 | C13 | C16 | 125.5° | 118.3° |
| C20 | C17 | C13 | H17 | 111.7° | 122.1° |
| C20 | C17 | C13 | C18 | 56.6° | 33.2° |
| C20 | C17 | C16 | C15 | 161.6° | 123.1° |
| C20 | C17 | C16 | H17 | 112.2° | 122.2° |
| C17 | C20 | C22 | C23 | 146.4° | 140.9° |
| C17 | C20 | O21 | C28 | 127.9° | 117.7° |
| C20 | C17 | C16 | H16 | 41.6° | 3.6° |
| C20 | C17 | C16 | H16A | 76.8° | 117.9° |
| C17 | C20 | C21 | H21 | 73.4° | 53.1° |
| C17 | C20 | C21 | H21A | 46.6° | 173.1° |
| C17 | C20 | C21 | H21B | 166.6° | 67.0° |
| C17 | C20 | C22 | H22 | 26.4° | 22.7° |
| C17 | C20 | C22 | H22A | 90.9° | 100.9° |
| C21 | C20 | C22 | O21 | 114.7° | 119.6° |
| C21 | C20 | C17 | C13 | 161.5° | 57.4° |
| C21 | C20 | C17 | C16 | 77.8° | 172.7° |
| C21 | C20 | C22 | C23 | 91.9° | 98.3° |
| C21 | C20 | O21 | C28 | 113.6° | 121.4° |
| C21 | C20 | C17 | H17 | 44.1° | 64.7° |
| C20 | C21 | H21 | H21A | 120.0° | 120.0° |
| C20 | C21 | H21 | H21B | 120.0° | 120.1° |
| C20 | C21 | H21A | H21B | 120.0° | 120.0° |
| C21 | C20 | C22 | H22 | 148.0° | 143.5° |
| C21 | C20 | C22 | H22A | 30.8° | 19.9° |
| C22 | C20 | C17 | C13 | 78.2° | 178.2° |
| C22 | C20 | C17 | C16 | 42.5° | 66.5° |
| C20 | C22 | C23 | H22 | 120.0° | 118.2° |
| C20 | C22 | C23 | H22A | 122.7° | 118.2° |
| C20 | C22 | C23 | C24 | 158.9° | 152.1° |
| C20 | C22 | C23 | C28 | 35.6° | 34.1° |
| C22 | C20 | O21 | C28 | 0.5° | 1.8° |
| C22 | C20 | C17 | H17 | 164.4° | 56.1° |
| C22 | C20 | C21 | H21 | 54.1° | 173.9° |
| C22 | C20 | C21 | H21A | 174.1° | 66.1° |
| C22 | C20 | C21 | H21B | 65.9° | 53.8° |
| C20 | C22 | H22 | H22A | 123.1° | 123.6° |
| C20 | C22 | C23 | H23 | 86.2° | 83.9° |
| O21 | C20 | C17 | C13 | 43.3° | 63.5° |
| O21 | C20 | C17 | C16 | 164.0° | 51.8° |
| O21 | C20 | C22 | C23 | 22.8° | 21.3° |
| C20 | O21 | C28 | C23 | 24.5° | 24.5° |
| O21 | C20 | C17 | H17 | 74.1° | 174.4° |
| O21 | C20 | C21 | H21 | 167.2° | 67.8° |
| O21 | C20 | C21 | H21A | 72.8° | 52.2° |
| O21 | C20 | C21 | H21B | 47.2° | 172.1° |
| O21 | C20 | C22 | H22 | 97.3° | 96.9° |
| O21 | C20 | C22 | H22A | 145.5° | 139.5° |
| C20 | O21 | C28 | H28 | 95.5° | 94.4° |
| C20 | O21 | C28 | H28A | 145.8° | 143.4° |
| C2 | C3 | C4 | O3 | 120.4° | 120.1° |
| C2 | C3 | C4 | H3 | 118.5° | 120.1° |
| C2 | C3 | O3 | H3 | 118.6° | 119.9° |
| C2 | C3 | C4 | C5 | 48.0° | 57.7° |
| C3 | C2 | C1 | H1 | 64.1° | 177.4° |
| C3 | C2 | H2 | H2A | 118.9° | 119.8° |
| C2 | C3 | C4 | H4 | 168.0° | 62.0° |
| C2 | C3 | C4 | H4A | 70.4° | 177.4° |
| C2 | C3 | O3 | HO3 | 161.1° | 180.0° |
| C26 | C25 | C27 | C24 | 125.8° | 120.0° |
| C26 | C25 | C27 | O25 | 115.8° | 120.0° |
| C26 | C25 | C24 | O25 | 119.7° | 120.0° |
| C26 | C25 | C24 | C23 | 66.0° | 175.0° |
| C25 | C26 | H26 | H26A | 120.0° | 119.9° |
| C25 | C26 | H26 | H26B | 120.0° | 120.1° |
| C25 | C26 | H26A | H26B | 120.0° | 120.0° |
| C26 | C25 | C27 | H27 | 30.5° | 60.0° |
| C26 | C25 | C27 | H27A | 150.5° | 180.0° |
| C26 | C25 | C27 | H27B | 89.5° | 60.1° |
| C26 | C25 | C24 | H24 | 173.9° | 55.0° |
| C26 | C25 | C24 | H24A | 49.7° | 65.0° |
| C26 | C25 | O25 | HO25 | 168.4° | 60.0° |
| C27 | C25 | C24 | O25 | 117.2° | 120.0° |
| C27 | C25 | C24 | C23 | 170.9° | 55.0° |
| C27 | C25 | C26 | H26 | 129.9° | 60.1° |
| C27 | C25 | C26 | H26A | 110.1° | 180.0° |
| C27 | C25 | C26 | H26B | 10.0° | 60.0° |
| C25 | C27 | H27 | H27A | 120.0° | 120.0° |
| C25 | C27 | H27 | H27B | 120.0° | 120.0° |
| C25 | C27 | H27A | H27B | 120.0° | 120.0° |
| C27 | C25 | C24 | H24 | 50.9° | 65.0° |
| C27 | C25 | C24 | H24A | 73.3° | 175.0° |
| C27 | C25 | O25 | HO25 | 51.3° | 60.0° |
| C25 | C24 | C23 | C22 | 147.3° | 175.0° |
| C25 | C24 | C23 | H24 | 120.0° | 120.0° |
| C25 | C24 | C23 | H24A | 115.8° | 120.0° |
| C25 | C24 | C23 | C28 | 97.7° | 73.4° |
| C24 | C25 | C26 | H26 | 106.6° | 180.0° |
| C24 | C25 | C26 | H26A | 13.4° | 60.0° |
| C24 | C25 | C26 | H26B | 133.4° | 60.0° |
| C24 | C25 | C27 | H27 | 95.3° | 60.0° |
| C24 | C25 | C27 | H27A | 24.7° | 60.0° |
| C24 | C25 | C27 | H27B | 144.7° | 179.9° |
| C25 | C24 | C23 | H23 | 24.1° | 50.8° |
| C25 | C24 | H24 | H24A | 116.3° | 120.1° |
| C24 | C25 | O25 | HO25 | 67.7° | 180.0° |
| O25 | C25 | C24 | C23 | 53.7° | 65.0° |
| O25 | C25 | C26 | H26 | 14.2° | 60.0° |
| O25 | C25 | C26 | H26A | 134.1° | 60.0° |
| O25 | C25 | C26 | H26B | 105.8° | 180.0° |
| O25 | C25 | C27 | H27 | 146.3° | 180.0° |
| O25 | C25 | C27 | H27A | 93.7° | 59.9° |
| O25 | C25 | C27 | H27B | 26.3° | 60.0° |
| O25 | C25 | C24 | H24 | 66.4° | 175.0° |
| O25 | C25 | C24 | H24A | 169.4° | 55.0° |
| C4 | C3 | O3 | H3 | 118.7° | 119.8° |
| C3 | C4 | C5 | H4 | 120.0° | 119.7° |
| C3 | C4 | C5 | H4A | 118.5° | 119.7° |
| C3 | C4 | C5 | C6 | 134.6° | 133.4° |
| C3 | C4 | C5 | C10 | 45.2° | 46.6° |
| C4 | C3 | C2 | H2 | 173.5° | 53.9° |
| C4 | C3 | C2 | H2A | 65.4° | 173.7° |
| C3 | C4 | H4 | H4A | 118.5° | 120.6° |
| C4 | C3 | O3 | HO3 | 76.2° | 59.6° |
| O3 | C3 | C4 | C5 | 72.3° | 177.8° |
| O3 | C3 | C2 | H2 | 53.2° | 66.2° |
| O3 | C3 | C2 | H2A | 174.3° | 53.6° |
| O3 | C3 | C4 | H4 | 47.7° | 58.1° |
| O3 | C3 | C4 | H4A | 169.2° | 62.5° |
| C4 | C5 | C6 | C10 | 179.8° | 180.0° |
| C4 | C5 | C6 | C7 | 180.0° | 180.0° |
| C4 | C5 | C10 | C19 | 131.1° | 137.0° |
| C5 | C4 | C3 | H3 | 166.5° | 62.5° |
| C5 | C4 | H4 | H4A | 118.6° | 120.6° |
| C4 | C5 | C6 | H6 | 0.0° | 0.1° |
| C5 | C6 | C7 | H6 | 180.0° | 179.9° |
| C5 | C6 | C7 | C8 | 146.0° | 180.0° |
| C6 | C5 | C10 | C19 | 49.1° | 43.0° |
| C6 | C5 | C4 | H4 | 14.6° | 106.9° |
| C6 | C5 | C4 | H4A | 106.9° | 13.7° |
| C5 | C6 | C7 | H7 | 34.0° | 0.1° |
| C10 | C5 | C6 | C7 | 0.2° | 0.1° |
| C5 | C10 | C1 | H1 | 68.2° | 166.3° |
| C10 | C5 | C4 | H4 | 165.2° | 73.1° |
| C10 | C5 | C4 | H4A | 73.2° | 166.3° |
| C10 | C5 | C6 | H6 | 179.8° | 180.0° |
| C5 | C10 | C19 | H19 | 179.3° | 180.0° |
| C5 | C10 | C19 | H19A | 0.7° | 0.1° |
| C6 | C7 | C8 | H7 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 0.1° | 0.1° |
| C6 | C7 | C8 | C14 | 179.2° | 179.8° |
| C7 | C8 | C9 | C14 | 179.3° | 179.7° |
| C7 | C8 | C9 | C11 | 124.8° | 129.8° |
| C7 | C8 | C14 | C13 | 115.9° | 121.8° |
| C7 | C8 | C14 | C15 | 3.2° | 10.3° |
| C8 | C7 | C6 | H6 | 34.0° | 0.1° |
| C7 | C8 | C9 | H9 | 115.2° | 110.0° |
| C7 | C8 | C9 | H9A | 5.8° | 9.4° |
| C7 | C8 | C14 | H14 | 120.0° | 118.1° |
| C8 | C9 | C11 | H9 | 120.0° | 120.3° |
| C8 | C9 | C11 | H9A | 119.0° | 120.4° |
| C8 | C9 | C11 | C12 | 45.4° | 48.5° |
| C9 | C8 | C14 | C13 | 63.4° | 57.9° |
| C9 | C8 | C14 | C15 | 177.5° | 169.3° |
| C9 | C8 | C7 | H7 | 179.9° | 180.0° |
| C8 | C9 | H9 | H9A | 119.1° | 119.4° |
| C8 | C9 | C11 | H11 | 165.5° | 169.2° |
| C8 | C9 | C11 | H11A | 73.1° | 72.0° |
| C9 | C8 | C14 | H14 | 60.7° | 62.2° |
| C14 | C8 | C9 | C11 | 54.5° | 49.9° |
| C8 | C14 | C13 | C12 | 59.3° | 66.3° |
| C8 | C14 | C13 | C15 | 129.3° | 122.1° |
| C8 | C14 | C13 | H14 | 112.6° | 120.0° |
| C8 | C14 | C13 | C17 | 178.8° | 167.7° |
| C8 | C14 | C13 | C18 | 57.8° | 52.2° |
| C8 | C14 | C15 | H14 | 111.9° | 128.3° |
| C8 | C14 | C15 | C16 | 154.1° | 156.2° |
| C14 | C8 | C7 | H7 | 0.8° | 0.3° |
| C14 | C8 | C9 | H9 | 65.5° | 70.3° |
| C14 | C8 | C9 | H9A | 173.5° | 170.3° |
| C8 | C14 | C15 | H15 | 34.1° | 37.9° |
| C8 | C14 | C15 | H15A | 83.8° | 85.4° |
| C9 | C11 | C12 | H11 | 120.0° | 120.7° |
| C9 | C11 | C12 | H11A | 118.5° | 120.5° |
| C9 | C11 | C12 | C13 | 47.1° | 59.0° |
| C11 | C9 | H9 | H9A | 119.1° | 119.3° |
| C9 | C11 | H11 | H11A | 118.6° | 118.9° |
| C9 | C11 | C12 | H12 | 72.9° | 60.5° |
| C9 | C11 | C12 | H12A | 164.2° | 178.5° |
| C19 | C10 | C1 | H1 | 113.0° | 13.7° |
| C10 | C19 | H19 | H19A | 180.0° | 180.0° |
| C11 | C12 | C13 | H12 | 120.0° | 119.5° |
| C11 | C12 | C13 | H12A | 117.1° | 119.5° |
| C11 | C12 | C13 | C14 | 52.3° | 67.9° |
| C11 | C12 | C13 | C17 | 159.4° | 175.6° |
| C11 | C12 | C13 | C18 | 68.6° | 50.4° |
| C12 | C11 | C9 | H9 | 74.5° | 71.8° |
| C12 | C11 | C9 | H9A | 164.5° | 168.9° |
| C12 | C11 | H11 | H11A | 118.6° | 118.8° |
| C11 | C12 | H12 | H12A | 117.4° | 121.0° |
| C12 | C13 | C14 | C17 | 121.8° | 125.9° |
| C12 | C13 | C14 | C18 | 117.1° | 118.5° |
| C12 | C13 | C17 | C18 | 128.4° | 125.5° |
| C12 | C13 | C14 | C15 | 171.4° | 171.6° |
| C12 | C13 | C17 | C16 | 162.6° | 149.5° |
| C13 | C12 | C11 | H11 | 167.1° | 179.7° |
| C13 | C12 | C11 | H11A | 71.4° | 61.5° |
| C13 | C12 | H12 | H12A | 117.4° | 120.9° |
| C12 | C13 | C14 | H14 | 53.2° | 53.7° |
| C12 | C13 | C17 | H17 | 39.8° | 29.9° |
| C12 | C13 | C18 | H18 | 0.1° | 57.3° |
| C12 | C13 | C18 | H18A | 120.1° | 177.3° |
| C12 | C13 | C18 | H18B | 119.9° | 62.7° |
| C14 | C13 | C17 | C18 | 119.3° | 115.7° |
| C13 | C14 | C15 | H14 | 124.7° | 117.6° |
| C13 | C14 | C15 | C16 | 30.7° | 42.0° |
| C14 | C13 | C17 | C16 | 50.4° | 30.7° |
| C14 | C13 | C12 | H12 | 67.7° | 51.6° |
| C14 | C13 | C12 | H12A | 169.5° | 172.5° |
| C13 | C14 | C15 | H15 | 89.3° | 76.3° |
| C13 | C14 | C15 | H15A | 152.8° | 160.4° |
| C14 | C13 | C17 | H17 | 72.5° | 88.9° |
| C14 | C13 | C18 | H18 | 116.3° | 60.2° |
| C14 | C13 | C18 | H18A | 3.7° | 59.9° |
| C14 | C13 | C18 | H18B | 123.7° | 179.8° |
| C17 | C13 | C14 | C15 | 49.6° | 45.6° |
| C13 | C17 | C16 | C15 | 32.7° | 4.5° |
| C13 | C17 | C16 | H17 | 118.8° | 119.2° |
| C17 | C13 | C12 | H12 | 39.4° | 64.9° |
| C17 | C13 | C12 | H12A | 83.5° | 56.1° |
| C17 | C13 | C14 | H14 | 68.6° | 72.2° |
| C13 | C17 | C16 | H16 | 87.3° | 115.0° |
| C13 | C17 | C16 | H16A | 154.2° | 123.5° |
| C17 | C13 | C18 | H18 | 133.8° | 172.1° |
| C17 | C13 | C18 | H18A | 106.2° | 52.1° |
| C17 | C13 | C18 | H18B | 13.8° | 67.9° |
| C18 | C13 | C14 | C15 | 71.5° | 69.9° |
| C18 | C13 | C17 | C16 | 69.0° | 85.0° |
| C18 | C13 | C12 | H12 | 171.5° | 169.9° |
| C18 | C13 | C12 | H12A | 48.6° | 69.1° |
| C18 | C13 | C14 | H14 | 170.4° | 172.2° |
| C18 | C13 | C17 | H17 | 168.2° | 155.3° |
| C13 | C18 | H18 | H18A | 120.0° | 120.1° |
| C13 | C18 | H18 | H18B | 120.0° | 120.0° |
| C13 | C18 | H18A | H18B | 120.0° | 120.0° |
| C14 | C15 | C16 | H15 | 120.0° | 118.3° |
| C14 | C15 | C16 | H15A | 122.1° | 118.4° |
| C14 | C15 | C16 | C17 | 0.6° | 23.7° |
| C14 | C15 | H15 | H15A | 122.3° | 123.3° |
| C14 | C15 | C16 | H16 | 119.4° | 143.4° |
| C14 | C15 | C16 | H16A | 122.2° | 95.0° |
| C15 | C16 | C17 | H16 | 120.0° | 119.5° |
| C15 | C16 | C17 | H16A | 121.6° | 119.0° |
| C16 | C15 | C14 | H14 | 94.0° | 75.6° |
| C16 | C15 | H15 | H15A | 122.3° | 123.3° |
| C15 | C16 | H16 | H16A | 121.7° | 121.5° |
| C15 | C16 | C17 | H17 | 86.2° | 114.7° |
| C17 | C16 | C15 | H15 | 120.6° | 94.6° |
| C17 | C16 | C15 | H15A | 121.5° | 142.1° |
| C17 | C16 | H16 | H16A | 121.7° | 121.3° |
| C22 | C23 | C24 | C28 | 114.9° | 111.6° |
| C22 | C23 | C24 | H23 | 123.3° | 124.2° |
| C22 | C23 | C28 | H23 | 123.3° | 118.0° |
| C22 | C23 | C28 | O21 | 37.6° | 36.5° |
| C23 | C22 | H22 | H22A | 123.1° | 123.6° |
| C22 | C23 | C24 | H24 | 27.3° | 54.9° |
| C22 | C23 | C24 | H24A | 96.9° | 65.0° |
| C22 | C23 | C28 | H28 | 82.4° | 82.5° |
| C22 | C23 | C28 | H28A | 159.0° | 155.3° |
| C24 | C23 | C28 | H23 | 114.9° | 124.1° |
| C24 | C23 | C28 | O21 | 159.4° | 154.4° |
| C24 | C23 | C22 | H22 | 38.8° | 33.9° |
| C24 | C23 | C22 | H22A | 78.4° | 89.7° |
| C23 | C24 | H24 | H24A | 116.4° | 119.9° |
| C24 | C23 | C28 | H28 | 39.4° | 35.4° |
| C24 | C23 | C28 | H28A | 79.2° | 86.7° |
| C23 | C28 | O21 | H28 | 120.0° | 118.9° |
| C23 | C28 | O21 | H28A | 121.3° | 118.9° |
| C28 | C23 | C22 | H22 | 84.4° | 84.1° |
| C28 | C23 | C22 | H22A | 158.3° | 152.3° |
| C28 | C23 | C24 | H24 | 142.3° | 166.5° |
| C28 | C23 | C24 | H24A | 18.0° | 46.6° |
| C23 | C28 | H28 | H28A | 121.4° | 122.2° |
| O21 | C28 | C23 | H23 | 85.7° | 81.4° |
| O21 | C28 | H28 | H28A | 121.5° | 122.1° |
| H1 | C1 | C2 | H2 | 55.9° | 57.4° |
| H1 | C1 | C2 | H2A | 177.0° | 62.5° |
| H1 | C1 | O1 | HO1 | 18.2° | 59.4° |
| H2 | C2 | C3 | H3 | 68.0° | 174.0° |
| H2A | C2 | C3 | H3 | 53.2° | 66.2° |
| H26 | C26 | H26A | H26B | 120.0° | 120.0° |
| H27 | C27 | H27A | H27B | 120.0° | 120.0° |
| H3 | C3 | C4 | H4 | 73.5° | 177.9° |
| H3 | C3 | C4 | H4A | 48.0° | 57.3° |
| H3 | C3 | O3 | HO3 | 42.5° | 60.1° |
| H6 | C6 | C7 | H7 | 146.0° | 180.0° |
| H9 | C9 | C11 | H11 | 45.5° | 48.8° |
| H9 | C9 | C11 | H11A | 167.0° | 167.7° |
| H9A | C9 | C11 | H11 | 75.5° | 70.4° |
| H9A | C9 | C11 | H11A | 46.0° | 48.4° |
| H11 | C11 | C12 | H12 | 47.1° | 60.1° |
| H11 | C11 | C12 | H12A | 75.8° | 60.8° |
| H11A | C11 | C12 | H12 | 168.6° | 178.9° |
| H11A | C11 | C12 | H12A | 45.7° | 58.0° |
| H14 | C14 | C15 | H15 | 146.0° | 166.1° |
| H14 | C14 | C15 | H15A | 28.1° | 42.8° |
| H15 | C15 | C16 | H16 | 0.6° | 25.1° |
| H15 | C15 | C16 | H16A | 117.9° | 146.6° |
| H15A | C15 | C16 | H16 | 118.6° | 98.2° |
| H15A | C15 | C16 | H16A | 0.1° | 23.3° |
| H16 | C16 | C17 | H17 | 153.8° | 125.8° |
| H16A | C16 | C17 | H17 | 35.4° | 4.3° |
| H18 | C18 | H18A | H18B | 120.0° | 120.0° |
| H21 | C21 | H21A | H21B | 120.0° | 120.0° |
| H22 | C22 | C23 | H23 | 153.8° | 157.9° |
| H22A | C22 | C23 | H23 | 36.5° | 34.3° |
| H23 | C23 | C24 | H24 | 95.9° | 69.2° |
| H23 | C23 | C24 | H24A | 139.8° | 170.8° |
| H23 | C23 | C28 | H28 | 154.4° | 159.6° |
| H23 | C23 | C28 | H28A | 35.7° | 37.4° |
