A1JN7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | C6 | doub | 1.22Å | 1.19Å | |
| O3 | C6 | sing | 1.35Å | 1.38Å | |
| O3 | C7 | sing | 1.45Å | 1.41Å | |
| O5 | C12 | sing | 1.36Å | 1.40Å | |
| C6 | C5 | sing | 1.47Å | 1.48Å | |
| C7 | C8 | sing | 1.53Å | 1.51Å | |
| C7 | C3 | sing | 1.53Å | 1.54Å | |
| C12 | C5 | doub | 1.40Å | 1.54Å | Aromatic |
| C12 | C11 | sing | 1.39Å | 1.31Å | Aromatic |
| C5 | C4 | sing | 1.40Å | 1.30Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.51Å | Aromatic |
| C4 | C3 | sing | 1.51Å | 1.53Å | |
| C4 | C9 | doub | 1.37Å | 1.53Å | Aromatic |
| C3 | O2 | sing | 1.45Å | 1.39Å | |
| O2 | C2 | sing | 1.34Å | 1.40Å | |
| C10 | C9 | sing | 1.39Å | 1.31Å | Aromatic |
| C10 | O6 | sing | 1.36Å | 1.40Å | |
| C9 | C13 | sing | 1.51Å | 1.53Å | |
| C2 | C1 | sing | 1.51Å | 1.53Å | |
| C2 | O1 | doub | 1.21Å | 1.18Å | |
| O6 | C15 | sing | 1.45Å | 1.39Å | |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C15 | C14 | sing | 1.52Å | 1.54Å | |
| C15 | C20 | sing | 1.52Å | 1.53Å | |
| C14 | C17 | sing | 1.52Å | 1.57Å | |
| O7 | C20 | sing | 1.44Å | 1.41Å | |
| C20 | C19 | sing | 1.53Å | 1.50Å | |
| C22 | C17 | sing | 1.50Å | 1.51Å | |
| C22 | C23 | doub | 1.33Å | 1.31Å | |
| C17 | C18 | sing | 1.52Å | 1.54Å | |
| C17 | C21 | sing | 1.54Å | 1.53Å | |
| C23 | C24 | sing | 1.46Å | 1.52Å | |
| C18 | C19 | sing | 1.52Å | 1.51Å | |
| C18 | C25 | sing | 1.52Å | 1.56Å | |
| C24 | C25 | sing | 1.51Å | 1.53Å | |
| C24 | O8 | doub | 1.22Å | 1.18Å | |
| C25 | C27 | sing | 1.55Å | 1.52Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.08Å | 1.08Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.11Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.11Å | 1.10Å | |
| C19 | H13 | sing | 1.09Å | 1.10Å | |
| C19 | H14 | sing | 1.10Å | 1.10Å | |
| C20 | H15 | sing | 1.10Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C21 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.07Å | 1.08Å | |
| C23 | H20 | sing | 1.08Å | 1.08Å | |
| C26 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C27 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H25 | sing | 1.09Å | 1.10Å | |
| C27 | H26 | sing | 1.09Å | 1.10Å | |
| C7 | H27 | sing | 1.09Å | 1.10Å | |
| C8 | H28 | sing | 1.09Å | 1.10Å | |
| C8 | H29 | sing | 1.09Å | 1.10Å | |
| C8 | H30 | sing | 1.09Å | 1.10Å | |
| O5 | H31 | sing | 0.97Å | 0.95Å | |
| O7 | H32 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | C6 | O3 | 120.5° | 119.8° |
| O4 | C6 | C5 | 120.2° | 120.5° |
| C6 | O3 | C7 | 118.3° | 119.0° |
| O3 | C6 | C5 | 119.3° | 119.8° |
| O3 | C7 | C8 | 109.7° | 109.7° |
| O3 | C7 | C3 | 109.3° | 110.7° |
| O3 | C7 | H27 | 110.4° | 109.6° |
| O5 | C12 | C5 | 120.0° | 120.9° |
| O5 | C12 | C11 | 120.1° | 119.7° |
| C12 | O5 | H31 | 109.5° | 114.0° |
| C6 | C5 | C12 | 119.3° | 121.4° |
| C6 | C5 | C4 | 119.9° | 119.0° |
| C8 | C7 | C3 | 109.5° | 109.2° |
| C8 | C7 | H27 | 109.1° | 108.7° |
| C7 | C8 | H28 | 109.5° | 109.4° |
| C7 | C8 | H29 | 109.5° | 109.5° |
| C7 | C8 | H30 | 109.5° | 109.4° |
| C7 | C3 | C4 | 108.8° | 109.2° |
| C7 | C3 | O2 | 109.0° | 109.4° |
| C7 | C3 | H4 | 109.5° | 109.4° |
| C3 | C7 | H27 | 108.7° | 108.9° |
| C5 | C12 | C11 | 119.9° | 119.4° |
| C12 | C5 | C4 | 120.8° | 119.6° |
| C12 | C11 | C10 | 118.5° | 120.3° |
| C12 | C11 | H5 | 120.8° | 119.7° |
| C5 | C4 | C3 | 119.6° | 119.0° |
| C5 | C4 | C9 | 119.5° | 120.5° |
| C11 | C10 | C9 | 122.4° | 120.1° |
| C11 | C10 | O6 | 113.4° | 118.2° |
| C10 | C11 | H5 | 120.8° | 120.0° |
| C3 | C4 | C9 | 120.9° | 120.5° |
| C4 | C3 | O2 | 108.1° | 109.4° |
| C4 | C3 | H4 | 109.7° | 109.7° |
| C4 | C9 | C10 | 118.8° | 120.1° |
| C4 | C9 | C13 | 121.2° | 118.7° |
| C3 | O2 | C2 | 117.9° | 117.0° |
| O2 | C3 | H4 | 111.7° | 109.7° |
| O2 | C2 | C1 | 118.7° | 120.0° |
| O2 | C2 | O1 | 121.8° | 120.0° |
| C9 | C10 | O6 | 124.2° | 121.8° |
| C10 | C9 | C13 | 120.0° | 121.2° |
| C10 | O6 | C15 | 119.0° | 115.3° |
| C9 | C13 | C14 | 109.9° | 109.4° |
| C9 | C13 | H6 | 109.4° | 109.9° |
| C9 | C13 | H7 | 109.3° | 108.4° |
| C1 | C2 | O1 | 119.6° | 120.0° |
| C2 | C1 | H1 | 109.5° | 109.4° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C2 | C1 | H3 | 109.5° | 109.5° |
| O6 | C15 | C16 | 106.2° | 106.3° |
| O6 | C15 | C14 | 107.8° | 105.1° |
| O6 | C15 | C20 | 105.6° | 107.7° |
| C16 | C15 | C14 | 114.8° | 113.4° |
| C16 | C15 | C20 | 109.8° | 111.1° |
| C15 | C16 | H9 | 109.5° | 109.4° |
| C15 | C16 | H10 | 109.5° | 109.5° |
| C15 | C16 | H11 | 109.5° | 109.5° |
| C13 | C14 | C15 | 110.5° | 109.4° |
| C13 | C14 | C17 | 112.5° | 111.6° |
| C14 | C13 | H6 | 109.3° | 111.0° |
| C14 | C13 | H7 | 109.4° | 109.0° |
| C13 | C14 | H8 | 106.5° | 106.8° |
| C14 | C15 | C20 | 111.9° | 112.7° |
| C15 | C14 | C17 | 114.3° | 114.4° |
| C15 | C14 | H8 | 106.4° | 107.5° |
| C15 | C20 | O7 | 108.3° | 109.2° |
| C15 | C20 | C19 | 112.4° | 113.7° |
| C15 | C20 | H15 | 108.6° | 108.9° |
| C14 | C17 | C22 | 115.5° | 111.4° |
| C14 | C17 | C18 | 109.6° | 111.4° |
| C14 | C17 | C21 | 105.1° | 106.0° |
| C17 | C14 | H8 | 106.1° | 106.8° |
| O7 | C20 | C19 | 108.3° | 108.9° |
| O7 | C20 | H15 | 110.3° | 107.6° |
| C20 | O7 | H32 | 109.5° | 113.9° |
| C20 | C19 | C18 | 111.6° | 111.5° |
| C20 | C19 | H13 | 109.0° | 108.9° |
| C20 | C19 | H14 | 108.9° | 108.2° |
| C19 | C20 | H15 | 109.0° | 108.5° |
| C17 | C22 | C23 | 118.7° | 121.1° |
| C22 | C17 | C18 | 106.3° | 110.8° |
| C22 | C17 | C21 | 106.8° | 106.5° |
| C17 | C22 | H19 | 120.7° | 119.8° |
| C22 | C23 | C24 | 121.1° | 121.7° |
| C23 | C22 | H19 | 120.7° | 119.1° |
| C22 | C23 | H20 | 119.5° | 118.9° |
| C18 | C17 | C21 | 113.7° | 110.5° |
| C17 | C18 | C19 | 109.6° | 110.5° |
| C17 | C18 | C25 | 113.2° | 114.8° |
| C17 | C18 | H12 | 106.9° | 107.5° |
| C17 | C21 | H16 | 109.5° | 109.4° |
| C17 | C21 | H17 | 109.5° | 109.5° |
| C17 | C21 | H18 | 109.5° | 109.5° |
| C23 | C24 | C25 | 120.1° | 121.2° |
| C23 | C24 | O8 | 119.9° | 119.5° |
| C24 | C23 | H20 | 119.4° | 119.4° |
| C19 | C18 | C25 | 112.9° | 112.6° |
| C19 | C18 | H12 | 107.2° | 107.3° |
| C18 | C19 | H13 | 108.9° | 111.1° |
| C18 | C19 | H14 | 108.9° | 109.7° |
| C18 | C25 | C24 | 106.4° | 110.5° |
| C18 | C25 | C27 | 108.8° | 108.0° |
| C18 | C25 | C26 | 116.2° | 113.3° |
| C25 | C18 | H12 | 106.7° | 103.6° |
| C25 | C24 | O8 | 120.0° | 119.3° |
| C24 | C25 | C27 | 107.5° | 107.0° |
| C24 | C25 | C26 | 109.6° | 110.5° |
| C27 | C25 | C26 | 108.1° | 107.3° |
| C25 | C27 | H24 | 109.5° | 109.5° |
| C25 | C27 | H25 | 109.4° | 109.4° |
| C25 | C27 | H26 | 109.5° | 109.4° |
| C25 | C26 | H21 | 109.5° | 109.4° |
| C25 | C26 | H22 | 109.5° | 109.4° |
| C25 | C26 | H23 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.4° |
| H6 | C13 | H7 | 109.5° | 109.1° |
| H9 | C16 | H10 | 109.5° | 109.5° |
| H9 | C16 | H11 | 109.5° | 109.5° |
| H10 | C16 | H11 | 109.5° | 109.5° |
| H13 | C19 | H14 | 109.5° | 107.4° |
| H16 | C21 | H17 | 109.4° | 109.5° |
| H16 | C21 | H18 | 109.5° | 109.5° |
| H17 | C21 | H18 | 109.5° | 109.5° |
| H21 | C26 | H22 | 109.4° | 109.5° |
| H21 | C26 | H23 | 109.5° | 109.5° |
| H22 | C26 | H23 | 109.5° | 109.5° |
| H24 | C27 | H25 | 109.4° | 109.5° |
| H24 | C27 | H26 | 109.5° | 109.5° |
| H25 | C27 | H26 | 109.5° | 109.5° |
| H28 | C8 | H29 | 109.4° | 109.5° |
| H28 | C8 | H30 | 109.4° | 109.5° |
| H29 | C8 | H30 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | C6 | O3 | C5 | 179.4° | 179.8° |
| O4 | C6 | O3 | C7 | 168.3° | 167.7° |
| O4 | C6 | C5 | C12 | 13.7° | 11.7° |
| O4 | C6 | C5 | C4 | 166.7° | 167.3° |
| C6 | O3 | C7 | C8 | 165.7° | 167.0° |
| C6 | O3 | C7 | C3 | 45.6° | 46.4° |
| O3 | C6 | C5 | C12 | 165.7° | 168.5° |
| O3 | C6 | C5 | C4 | 13.9° | 12.5° |
| C6 | O3 | C7 | H27 | 74.0° | 73.7° |
| C7 | O3 | C6 | C5 | 11.1° | 12.5° |
| O3 | C7 | C8 | C3 | 120.0° | 121.5° |
| O3 | C7 | C8 | H27 | 121.1° | 119.8° |
| O3 | C7 | C3 | H27 | 120.6° | 120.5° |
| O3 | C7 | C3 | C4 | 55.7° | 54.1° |
| O3 | C7 | C3 | O2 | 62.0° | 65.7° |
| O3 | C7 | C3 | H4 | 175.6° | 174.1° |
| O3 | C7 | C8 | H28 | 180.0° | 59.9° |
| O3 | C7 | C8 | H29 | 60.0° | 179.9° |
| O3 | C7 | C8 | H30 | 60.0° | 60.0° |
| O5 | C12 | C5 | C6 | 0.4° | 1.4° |
| O5 | C12 | C5 | C11 | 179.8° | 179.8° |
| O5 | C12 | C5 | C4 | 179.9° | 179.7° |
| O5 | C12 | C11 | C10 | 179.9° | 179.1° |
| O5 | C12 | C11 | H5 | 0.1° | 0.8° |
| C6 | C5 | C12 | C4 | 179.6° | 179.0° |
| C6 | C5 | C12 | C11 | 179.9° | 178.8° |
| C6 | C5 | C4 | C3 | 0.6° | 0.5° |
| C6 | C5 | C4 | C9 | 179.9° | 179.9° |
| C8 | C7 | C3 | H27 | 119.1° | 118.6° |
| C8 | C7 | C3 | C4 | 176.0° | 175.0° |
| C8 | C7 | C3 | O2 | 58.3° | 55.2° |
| C8 | C7 | C3 | H4 | 64.1° | 65.0° |
| C7 | C8 | H28 | H29 | 120.0° | 120.0° |
| C7 | C8 | H28 | H30 | 120.0° | 120.0° |
| C7 | C8 | H29 | H30 | 120.0° | 120.0° |
| C7 | C3 | C4 | C5 | 34.7° | 32.1° |
| C7 | C3 | C4 | O2 | 118.2° | 119.7° |
| C7 | C3 | C4 | H4 | 119.7° | 119.9° |
| C7 | C3 | C4 | C9 | 145.8° | 147.5° |
| C7 | C3 | O2 | H4 | 121.1° | 120.0° |
| C7 | C3 | O2 | C2 | 112.2° | 90.0° |
| C3 | C7 | C8 | H28 | 60.0° | 178.6° |
| C3 | C7 | C8 | H29 | 60.0° | 58.6° |
| C3 | C7 | C8 | H30 | 180.0° | 61.4° |
| C5 | C12 | C11 | C10 | 0.1° | 0.7° |
| C12 | C5 | C4 | C3 | 179.9° | 179.4° |
| C12 | C5 | C4 | C9 | 0.4° | 0.9° |
| C5 | C12 | C11 | H5 | 179.9° | 179.4° |
| C5 | C12 | O5 | H31 | 5.0° | 90.0° |
| C11 | C12 | C5 | C4 | 0.3° | 0.1° |
| C12 | C11 | C10 | H5 | 180.0° | 179.9° |
| C12 | C11 | C10 | C9 | 0.0° | 0.2° |
| C12 | C11 | C10 | O6 | 179.9° | 179.3° |
| C11 | C12 | O5 | H31 | 174.8° | 90.3° |
| C5 | C4 | C3 | C9 | 179.5° | 179.6° |
| C5 | C4 | C3 | O2 | 83.5° | 87.6° |
| C5 | C4 | C9 | C10 | 0.3° | 1.4° |
| C5 | C4 | C9 | C13 | 179.8° | 177.8° |
| C5 | C4 | C3 | H4 | 154.5° | 152.0° |
| C11 | C10 | C9 | C4 | 0.1° | 0.8° |
| C11 | C10 | C9 | O6 | 179.9° | 179.5° |
| C11 | C10 | C9 | C13 | 180.0° | 178.4° |
| C11 | C10 | O6 | C15 | 164.2° | 154.2° |
| C4 | C3 | O2 | H4 | 120.8° | 120.4° |
| C4 | C3 | O2 | C2 | 129.7° | 150.3° |
| C3 | C4 | C9 | C10 | 179.8° | 179.0° |
| C3 | C4 | C9 | C13 | 0.3° | 1.8° |
| C4 | C3 | C7 | H27 | 64.9° | 66.5° |
| C9 | C4 | C3 | O2 | 96.0° | 92.7° |
| C4 | C9 | C10 | C13 | 179.9° | 179.2° |
| C4 | C9 | C10 | O6 | 179.8° | 179.7° |
| C4 | C9 | C13 | C14 | 163.0° | 168.2° |
| C9 | C4 | C3 | H4 | 26.0° | 27.6° |
| C4 | C9 | C13 | H6 | 43.0° | 69.7° |
| C4 | C9 | C13 | H7 | 76.9° | 49.5° |
| C3 | O2 | C2 | C1 | 168.8° | 180.0° |
| C3 | O2 | C2 | O1 | 11.6° | 0.0° |
| O2 | C3 | C7 | H27 | 177.4° | 173.8° |
| O2 | C2 | C1 | O1 | 179.7° | 179.9° |
| O2 | C2 | C1 | H1 | 179.7° | 180.0° |
| O2 | C2 | C1 | H2 | 59.7° | 60.0° |
| O2 | C2 | C1 | H3 | 60.3° | 60.0° |
| C2 | O2 | C3 | H4 | 8.9° | 30.0° |
| C9 | C10 | O6 | C15 | 15.7° | 25.3° |
| C10 | C9 | C13 | C14 | 17.0° | 12.6° |
| C9 | C10 | C11 | H5 | 180.0° | 179.8° |
| C10 | C9 | C13 | H6 | 137.1° | 109.5° |
| C10 | C9 | C13 | H7 | 103.0° | 131.3° |
| O6 | C10 | C9 | C13 | 0.1° | 1.1° |
| C10 | O6 | C15 | C16 | 78.5° | 62.6° |
| C10 | O6 | C15 | C14 | 45.0° | 57.9° |
| C10 | O6 | C15 | C20 | 164.8° | 178.3° |
| O6 | C10 | C11 | H5 | 0.1° | 0.6° |
| C9 | C13 | C14 | H6 | 120.1° | 121.5° |
| C9 | C13 | C14 | H7 | 120.1° | 118.4° |
| C9 | C13 | C14 | C15 | 46.5° | 45.9° |
| C9 | C13 | C14 | C17 | 175.5° | 173.5° |
| C9 | C13 | H6 | H7 | 119.8° | 118.7° |
| C9 | C13 | C14 | H8 | 68.7° | 70.1° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 120.0° | 120.0° |
| O1 | C2 | C1 | H1 | 0.0° | 0.0° |
| O1 | C2 | C1 | H2 | 120.0° | 120.0° |
| O1 | C2 | C1 | H3 | 120.0° | 120.0° |
| O6 | C15 | C16 | C14 | 119.1° | 115.0° |
| O6 | C15 | C16 | C20 | 113.8° | 116.9° |
| O6 | C15 | C14 | C13 | 60.9° | 68.7° |
| O6 | C15 | C14 | C20 | 115.8° | 117.1° |
| O6 | C15 | C14 | C17 | 171.0° | 165.3° |
| O6 | C15 | C20 | O7 | 24.7° | 37.4° |
| O6 | C15 | C20 | C19 | 144.3° | 159.2° |
| O6 | C15 | C14 | H8 | 54.4° | 46.9° |
| O6 | C15 | C16 | H9 | 180.0° | 61.6° |
| O6 | C15 | C16 | H10 | 60.0° | 58.4° |
| O6 | C15 | C16 | H11 | 60.0° | 178.4° |
| O6 | C15 | C20 | H15 | 95.0° | 79.8° |
| C16 | C15 | C14 | C13 | 57.3° | 47.0° |
| C16 | C15 | C14 | C20 | 126.0° | 127.3° |
| C16 | C15 | C14 | C17 | 70.8° | 79.0° |
| C16 | C15 | C20 | O7 | 138.9° | 153.5° |
| C16 | C15 | C20 | C19 | 101.5° | 84.7° |
| C16 | C15 | C14 | H8 | 172.6° | 162.6° |
| C15 | C16 | H9 | H10 | 120.0° | 120.0° |
| C15 | C16 | H9 | H11 | 120.0° | 120.0° |
| C15 | C16 | H10 | H11 | 120.0° | 120.0° |
| C16 | C15 | C20 | H15 | 19.1° | 36.3° |
| C13 | C14 | C15 | C17 | 128.1° | 126.0° |
| C13 | C14 | C15 | H8 | 115.3° | 115.6° |
| C13 | C14 | C15 | C20 | 176.7° | 174.3° |
| C13 | C14 | C17 | H8 | 116.1° | 116.4° |
| C13 | C14 | C17 | C22 | 26.1° | 0.7° |
| C13 | C14 | C17 | C18 | 146.2° | 123.6° |
| C13 | C14 | C17 | C21 | 91.3° | 116.1° |
| C14 | C13 | H6 | H7 | 119.8° | 120.1° |
| C15 | C14 | C17 | H8 | 116.9° | 118.7° |
| C14 | C15 | C20 | O7 | 92.3° | 78.1° |
| C14 | C15 | C20 | C19 | 27.2° | 43.7° |
| C15 | C14 | C17 | C22 | 100.9° | 125.5° |
| C15 | C14 | C17 | C18 | 19.1° | 1.2° |
| C15 | C14 | C17 | C21 | 141.7° | 119.0° |
| C15 | C14 | C13 | H6 | 166.5° | 75.6° |
| C15 | C14 | C13 | H7 | 73.6° | 164.3° |
| C14 | C15 | C16 | H9 | 60.9° | 53.4° |
| C14 | C15 | C16 | H10 | 59.1° | 173.3° |
| C14 | C15 | C16 | H11 | 179.1° | 66.6° |
| C14 | C15 | C20 | H15 | 147.9° | 164.7° |
| C20 | C15 | C14 | C17 | 55.3° | 48.2° |
| C15 | C20 | O7 | C19 | 122.2° | 124.7° |
| C15 | C20 | O7 | H15 | 118.7° | 118.0° |
| C15 | C20 | C19 | H15 | 120.4° | 121.3° |
| C15 | C20 | C19 | C18 | 33.2° | 8.9° |
| C20 | C15 | C14 | H8 | 61.4° | 70.1° |
| C20 | C15 | C16 | H9 | 66.2° | 178.5° |
| C20 | C15 | C16 | H10 | 173.8° | 58.6° |
| C20 | C15 | C16 | H11 | 53.8° | 61.5° |
| C15 | C20 | C19 | H13 | 153.5° | 114.1° |
| C15 | C20 | C19 | H14 | 87.1° | 129.6° |
| C15 | C20 | O7 | H32 | 180.0° | 180.0° |
| C14 | C17 | C22 | C18 | 121.8° | 124.6° |
| C14 | C17 | C22 | C21 | 116.5° | 115.2° |
| C14 | C17 | C22 | C23 | 161.0° | 155.1° |
| C14 | C17 | C18 | C21 | 117.3° | 117.5° |
| C14 | C17 | C18 | C19 | 40.7° | 54.7° |
| C14 | C17 | C18 | C25 | 167.7° | 176.6° |
| C17 | C14 | C13 | H6 | 64.4° | 52.1° |
| C17 | C14 | C13 | H7 | 55.4° | 68.1° |
| C14 | C17 | C18 | H12 | 75.2° | 62.0° |
| C14 | C17 | C21 | H16 | 180.0° | 51.2° |
| C14 | C17 | C21 | H17 | 60.0° | 171.2° |
| C14 | C17 | C21 | H18 | 60.0° | 68.8° |
| C14 | C17 | C22 | H19 | 19.0° | 26.1° |
| O7 | C20 | C19 | H15 | 120.0° | 116.8° |
| O7 | C20 | C19 | C18 | 152.8° | 130.8° |
| O7 | C20 | C19 | H13 | 86.8° | 7.9° |
| O7 | C20 | C19 | H14 | 32.5° | 108.5° |
| C20 | C19 | C18 | C17 | 71.0° | 59.1° |
| C20 | C19 | C18 | H13 | 120.3° | 121.6° |
| C20 | C19 | C18 | H14 | 120.3° | 119.9° |
| C20 | C19 | C18 | C25 | 161.9° | 171.0° |
| C20 | C19 | C18 | H12 | 44.7° | 57.7° |
| C20 | C19 | H13 | H14 | 119.0° | 116.9° |
| C19 | C20 | O7 | H32 | 57.8° | 55.3° |
| C17 | C22 | C23 | H19 | 180.0° | 178.8° |
| C22 | C17 | C18 | C21 | 117.2° | 117.9° |
| C17 | C22 | C23 | C24 | 5.1° | 0.6° |
| C22 | C17 | C18 | C19 | 166.3° | 179.3° |
| C22 | C17 | C18 | C25 | 66.8° | 52.0° |
| C22 | C17 | C14 | H8 | 142.2° | 115.7° |
| C22 | C17 | C18 | H12 | 50.3° | 62.6° |
| C22 | C17 | C21 | H16 | 56.8° | 67.5° |
| C22 | C17 | C21 | H17 | 176.8° | 52.4° |
| C22 | C17 | C21 | H18 | 63.2° | 172.5° |
| C17 | C22 | C23 | H20 | 174.9° | 179.1° |
| C23 | C22 | C17 | C18 | 39.2° | 30.4° |
| C23 | C22 | C17 | C21 | 82.5° | 89.8° |
| C22 | C23 | C24 | H20 | 180.0° | 179.8° |
| C22 | C23 | C24 | C25 | 27.7° | 9.2° |
| C22 | C23 | C24 | O8 | 152.9° | 170.9° |
| C17 | C18 | C19 | C25 | 127.1° | 129.8° |
| C17 | C18 | C19 | H12 | 115.7° | 116.8° |
| C17 | C18 | C25 | H12 | 117.3° | 116.8° |
| C17 | C18 | C25 | C24 | 45.2° | 42.5° |
| C17 | C18 | C25 | C27 | 160.8° | 159.2° |
| C17 | C18 | C25 | C26 | 77.0° | 82.1° |
| C18 | C17 | C14 | H8 | 97.8° | 120.0° |
| C17 | C18 | C19 | H13 | 168.7° | 62.5° |
| C17 | C18 | C19 | H14 | 49.3° | 179.0° |
| C18 | C17 | C21 | H16 | 60.1° | 172.0° |
| C18 | C17 | C21 | H17 | 59.8° | 68.0° |
| C18 | C17 | C21 | H18 | 179.9° | 52.0° |
| C18 | C17 | C22 | H19 | 140.8° | 150.7° |
| C21 | C17 | C18 | C19 | 76.5° | 62.8° |
| C21 | C17 | C18 | C25 | 50.4° | 65.9° |
| C21 | C17 | C14 | H8 | 24.8° | 0.2° |
| C21 | C17 | C18 | H12 | 167.6° | 179.5° |
| C17 | C21 | H16 | H17 | 120.0° | 119.9° |
| C17 | C21 | H16 | H18 | 120.0° | 120.0° |
| C17 | C21 | H17 | H18 | 120.0° | 120.0° |
| C21 | C17 | C22 | H19 | 97.5° | 89.0° |
| C23 | C24 | C25 | C18 | 0.4° | 12.2° |
| C23 | C24 | C25 | O8 | 179.4° | 179.9° |
| C23 | C24 | C25 | C27 | 116.0° | 129.5° |
| C23 | C24 | C25 | C26 | 126.7° | 114.0° |
| C24 | C23 | C22 | H19 | 174.9° | 179.5° |
| C19 | C18 | C25 | H12 | 117.5° | 115.6° |
| C19 | C18 | C25 | C24 | 170.4° | 170.1° |
| C19 | C18 | C25 | C27 | 74.0° | 73.2° |
| C19 | C18 | C25 | C26 | 48.2° | 45.5° |
| C18 | C19 | H13 | H14 | 119.0° | 119.9° |
| C18 | C19 | C20 | H15 | 87.2° | 112.4° |
| C18 | C25 | C24 | C27 | 116.4° | 117.3° |
| C18 | C25 | C24 | C26 | 126.3° | 126.2° |
| C18 | C25 | C24 | O8 | 179.8° | 167.7° |
| C18 | C25 | C27 | C26 | 127.0° | 122.4° |
| C25 | C18 | C19 | H13 | 41.6° | 67.3° |
| C25 | C18 | C19 | H14 | 77.8° | 51.2° |
| C18 | C25 | C26 | H21 | 180.0° | 67.9° |
| C18 | C25 | C26 | H22 | 60.0° | 172.2° |
| C18 | C25 | C26 | H23 | 60.0° | 52.1° |
| C18 | C25 | C27 | H24 | 180.0° | 60.0° |
| C18 | C25 | C27 | H25 | 60.0° | 180.0° |
| C18 | C25 | C27 | H26 | 60.0° | 60.1° |
| C24 | C25 | C27 | C26 | 118.2° | 118.6° |
| C24 | C25 | C18 | H12 | 72.0° | 74.3° |
| C25 | C24 | C23 | H20 | 152.3° | 171.0° |
| C24 | C25 | C26 | H21 | 59.5° | 56.7° |
| C24 | C25 | C26 | H22 | 179.4° | 63.2° |
| C24 | C25 | C26 | H23 | 60.6° | 176.7° |
| C24 | C25 | C27 | H24 | 65.2° | 178.9° |
| C24 | C25 | C27 | H25 | 54.8° | 61.1° |
| C24 | C25 | C27 | H26 | 174.8° | 58.9° |
| O8 | C24 | C25 | C27 | 63.4° | 50.4° |
| O8 | C24 | C25 | C26 | 53.8° | 66.2° |
| O8 | C24 | C23 | H20 | 27.1° | 8.8° |
| C27 | C25 | C18 | H12 | 43.5° | 42.4° |
| C27 | C25 | C26 | H21 | 57.4° | 173.1° |
| C27 | C25 | C26 | H22 | 62.6° | 53.1° |
| C27 | C25 | C26 | H23 | 177.4° | 66.9° |
| C25 | C27 | H24 | H25 | 120.0° | 120.0° |
| C25 | C27 | H24 | H26 | 120.0° | 120.0° |
| C25 | C27 | H25 | H26 | 120.0° | 119.9° |
| C26 | C25 | C18 | H12 | 165.7° | 161.1° |
| C25 | C26 | H21 | H22 | 120.0° | 120.0° |
| C25 | C26 | H21 | H23 | 120.0° | 120.0° |
| C25 | C26 | H22 | H23 | 120.0° | 120.0° |
| C26 | C25 | C27 | H24 | 53.0° | 62.4° |
| C26 | C25 | C27 | H25 | 173.0° | 57.6° |
| C26 | C25 | C27 | H26 | 67.0° | 177.5° |
| H1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H4 | C3 | C7 | H27 | 55.0° | 53.6° |
| H6 | C13 | C14 | H8 | 51.4° | 168.4° |
| H7 | C13 | C14 | H8 | 171.2° | 48.3° |
| H9 | C16 | H10 | H11 | 120.0° | 120.1° |
| H12 | C18 | C19 | H13 | 75.6° | 179.3° |
| H12 | C18 | C19 | H14 | 165.0° | 62.2° |
| H13 | C19 | C20 | H15 | 33.1° | 124.7° |
| H14 | C19 | C20 | H15 | 152.5° | 8.3° |
| H15 | C20 | O7 | H32 | 61.3° | 62.0° |
| H16 | C21 | H17 | H18 | 120.0° | 120.1° |
| H19 | C22 | C23 | H20 | 5.1° | 0.3° |
| H21 | C26 | H22 | H23 | 120.0° | 120.0° |
| H24 | C27 | H25 | H26 | 120.0° | 120.1° |
| H27 | C7 | C8 | H28 | 58.9° | 59.9° |
| H27 | C7 | C8 | H29 | 178.9° | 60.1° |
| H27 | C7 | C8 | H30 | 61.1° | 179.9° |
| H28 | C8 | H29 | H30 | 120.0° | 120.0° |
