81E
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C23 | C24 | sing | 1.50Å | 1.50Å | |
| C23 | C22 | doub | 1.34Å | 1.32Å | |
| C24 | C25 | sing | 1.53Å | 1.52Å | |
| C26 | C25 | sing | 1.53Å | 1.51Å | |
| C25 | O1 | sing | 1.45Å | 1.42Å | |
| C22 | C21 | sing | 1.47Å | 1.45Å | |
| C21 | C20 | doub | 1.35Å | 1.32Å | |
| O | C | doub | 1.21Å | 1.20Å | |
| O1 | C | sing | 1.34Å | 1.45Å | |
| C | C1 | sing | 1.51Å | 1.51Å | |
| C20 | C19 | sing | 1.42Å | 1.45Å | |
| C19 | C18 | doub | 1.35Å | 1.32Å | |
| C1 | C2 | sing | 1.53Å | 1.52Å | |
| C18 | C17 | sing | 1.46Å | 1.45Å | |
| C17 | C16 | doub | 1.33Å | 1.32Å | |
| C2 | O2 | sing | 1.43Å | 1.42Å | |
| C2 | C3 | sing | 1.51Å | 1.50Å | |
| C16 | C15 | sing | 1.51Å | 1.50Å | |
| C15 | C14 | sing | 1.52Å | 1.52Å | |
| C15 | O6 | sing | 1.43Å | 1.42Å | |
| C3 | C4 | doub | 1.31Å | 1.33Å | |
| C4 | C5 | sing | 1.51Å | 1.51Å | |
| C14 | C13 | sing | 1.52Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C6 | O3 | sing | 1.43Å | 1.42Å | |
| C6 | C7 | sing | 1.53Å | 1.51Å | |
| O5 | C13 | sing | 1.43Å | 1.42Å | |
| O5 | C8 | sing | 1.43Å | 1.42Å | |
| C13 | C11 | sing | 1.53Å | 1.52Å | |
| C7 | C8 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.52Å | |
| C11 | C10 | sing | 1.53Å | 1.52Å | |
| C8 | O4 | sing | 1.43Å | 1.43Å | |
| C8 | C9 | sing | 1.53Å | 1.51Å | |
| C9 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | O7 | sing | 1.43Å | 1.43Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| O2 | H4 | sing | 0.97Å | 0.95Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | H6 | sing | 1.08Å | 1.08Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C6 | H9 | sing | 1.09Å | 1.10Å | |
| O3 | H10 | sing | 0.97Å | 0.95Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å | |
| C7 | H12 | sing | 1.09Å | 1.10Å | |
| O4 | H13 | sing | 0.97Å | 0.95Å | |
| C13 | H14 | sing | 1.10Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C10 | H19 | sing | 1.09Å | 1.10Å | |
| O7 | H20 | sing | 0.97Å | 0.95Å | |
| C9 | H21 | sing | 1.09Å | 1.10Å | |
| C9 | H22 | sing | 1.09Å | 1.10Å | |
| C14 | H23 | sing | 1.09Å | 1.10Å | |
| C14 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| O6 | H26 | sing | 0.97Å | 0.95Å | |
| C16 | H27 | sing | 1.09Å | 1.08Å | |
| C17 | H28 | sing | 1.07Å | 1.08Å | |
| C18 | H29 | sing | 1.08Å | 1.08Å | |
| C19 | H30 | sing | 1.07Å | 1.08Å | |
| C20 | H31 | sing | 1.06Å | 1.08Å | |
| C21 | H32 | sing | 1.07Å | 1.08Å | |
| C22 | H33 | sing | 1.07Å | 1.08Å | |
| C23 | H34 | sing | 1.08Å | 1.08Å | |
| C24 | H35 | sing | 1.09Å | 1.10Å | |
| C24 | H36 | sing | 1.09Å | 1.10Å | |
| C25 | H37 | sing | 1.09Å | 1.10Å | |
| C26 | H38 | sing | 1.09Å | 1.10Å | |
| C26 | H39 | sing | 1.09Å | 1.10Å | |
| C26 | H40 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C23 | C22 | 119.1° | 121.0° |
| C23 | C24 | C25 | 109.4° | 109.1° |
| C24 | C23 | H34 | 120.4° | 120.1° |
| C23 | C24 | H35 | 109.5° | 109.6° |
| C23 | C24 | H36 | 109.5° | 109.5° |
| C23 | C22 | C21 | 119.9° | 118.0° |
| C23 | C22 | H33 | 120.1° | 120.9° |
| C22 | C23 | H34 | 120.4° | 118.9° |
| C24 | C25 | C26 | 107.8° | 109.4° |
| C24 | C25 | O1 | 109.8° | 109.8° |
| C25 | C24 | H35 | 109.5° | 109.5° |
| C25 | C24 | H36 | 109.5° | 109.5° |
| C24 | C25 | H37 | 109.7° | 109.4° |
| C26 | C25 | O1 | 108.7° | 109.3° |
| C26 | C25 | H37 | 109.7° | 109.4° |
| C25 | C26 | H38 | 109.5° | 109.5° |
| C25 | C26 | H39 | 109.4° | 109.5° |
| C25 | C26 | H40 | 109.5° | 109.5° |
| C25 | O1 | C | 116.4° | 117.1° |
| O1 | C25 | H37 | 111.1° | 109.6° |
| C22 | C21 | C20 | 118.0° | 119.2° |
| C22 | C21 | H32 | 121.0° | 118.5° |
| C21 | C22 | H33 | 120.0° | 121.0° |
| C21 | C20 | C19 | 119.4° | 116.8° |
| C21 | C20 | H31 | 120.3° | 121.0° |
| C20 | C21 | H32 | 121.0° | 121.5° |
| O | C | O1 | 119.5° | 120.0° |
| O | C | C1 | 120.0° | 120.1° |
| O1 | C | C1 | 120.5° | 119.9° |
| C | C1 | C2 | 109.5° | 110.0° |
| C | C1 | H1 | 109.4° | 109.4° |
| C | C1 | H2 | 109.5° | 109.4° |
| C20 | C19 | C18 | 119.2° | 116.8° |
| C20 | C19 | H30 | 120.4° | 118.7° |
| C19 | C20 | H31 | 120.3° | 122.1° |
| C19 | C18 | C17 | 119.3° | 120.6° |
| C19 | C18 | H29 | 120.3° | 119.1° |
| C18 | C19 | H30 | 120.4° | 123.7° |
| C1 | C2 | O2 | 106.1° | 109.5° |
| C1 | C2 | C3 | 112.1° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.4° |
| C2 | C1 | H2 | 109.4° | 109.4° |
| C1 | C2 | H3 | 109.8° | 109.4° |
| C18 | C17 | C16 | 116.7° | 119.6° |
| C18 | C17 | H28 | 121.7° | 120.2° |
| C17 | C18 | H29 | 120.3° | 120.3° |
| C17 | C16 | C15 | 121.7° | 120.2° |
| C17 | C16 | H27 | 119.2° | 120.3° |
| C16 | C17 | H28 | 121.7° | 120.0° |
| O2 | C2 | C3 | 107.5° | 109.5° |
| O2 | C2 | H3 | 111.2° | 109.5° |
| C2 | O2 | H4 | 109.5° | 114.0° |
| C2 | C3 | C4 | 121.3° | 120.2° |
| C3 | C2 | H3 | 110.0° | 109.5° |
| C2 | C3 | H5 | 119.4° | 119.9° |
| C16 | C15 | C14 | 107.0° | 110.3° |
| C16 | C15 | O6 | 109.9° | 109.3° |
| C16 | C15 | H25 | 110.5° | 109.2° |
| C15 | C16 | H27 | 119.2° | 119.5° |
| C14 | C15 | O6 | 107.3° | 109.4° |
| C15 | C14 | C13 | 112.6° | 111.5° |
| C15 | C14 | H23 | 108.7° | 109.1° |
| C15 | C14 | H24 | 108.7° | 109.0° |
| C14 | C15 | H25 | 110.3° | 109.3° |
| O6 | C15 | H25 | 111.7° | 109.4° |
| C15 | O6 | H26 | 109.5° | 114.1° |
| C3 | C4 | C5 | 119.4° | 120.1° |
| C4 | C3 | H5 | 119.3° | 119.9° |
| C3 | C4 | H6 | 120.3° | 119.8° |
| C4 | C5 | C6 | 110.4° | 109.4° |
| C5 | C4 | H6 | 120.3° | 120.1° |
| C4 | C5 | H7 | 109.2° | 109.5° |
| C4 | C5 | H8 | 109.2° | 109.5° |
| C14 | C13 | O5 | 108.8° | 111.1° |
| C14 | C13 | C11 | 110.7° | 109.1° |
| C14 | C13 | H14 | 109.1° | 109.2° |
| C13 | C14 | H23 | 108.7° | 109.1° |
| C13 | C14 | H24 | 108.7° | 109.1° |
| C5 | C6 | O3 | 109.3° | 109.4° |
| C5 | C6 | C7 | 108.8° | 110.0° |
| C6 | C5 | H7 | 109.2° | 109.5° |
| C6 | C5 | H8 | 109.2° | 109.5° |
| C5 | C6 | H9 | 109.8° | 109.4° |
| O3 | C6 | C7 | 107.8° | 109.4° |
| O3 | C6 | H9 | 111.3° | 109.3° |
| C6 | O3 | H10 | 109.5° | 114.0° |
| C6 | C7 | C8 | 113.4° | 109.5° |
| C7 | C6 | H9 | 109.8° | 109.3° |
| C6 | C7 | H11 | 108.5° | 109.4° |
| C6 | C7 | H12 | 108.5° | 109.4° |
| C13 | O5 | C8 | 113.5° | 114.3° |
| O5 | C13 | C11 | 108.7° | 109.3° |
| O5 | C13 | H14 | 110.5° | 109.0° |
| O5 | C8 | C7 | 109.6° | 110.1° |
| O5 | C8 | O4 | 109.9° | 109.4° |
| O5 | C8 | C9 | 108.9° | 109.1° |
| C13 | C11 | C12 | 112.6° | 109.5° |
| C13 | C11 | C10 | 111.7° | 109.4° |
| C11 | C13 | H14 | 109.1° | 109.1° |
| C13 | C11 | H15 | 107.4° | 109.5° |
| C7 | C8 | O4 | 110.8° | 109.5° |
| C7 | C8 | C9 | 107.6° | 109.7° |
| C8 | C7 | H11 | 108.5° | 109.4° |
| C8 | C7 | H12 | 108.5° | 109.5° |
| C12 | C11 | C10 | 109.9° | 109.5° |
| C12 | C11 | H15 | 107.4° | 109.4° |
| C11 | C12 | H16 | 109.5° | 109.5° |
| C11 | C12 | H17 | 109.5° | 109.5° |
| C11 | C12 | H18 | 109.5° | 109.5° |
| C11 | C10 | C9 | 112.6° | 109.1° |
| C11 | C10 | O7 | 108.4° | 109.6° |
| C10 | C11 | H15 | 107.5° | 109.5° |
| C11 | C10 | H19 | 109.0° | 109.5° |
| O4 | C8 | C9 | 110.0° | 109.0° |
| C8 | O4 | H13 | 109.5° | 114.0° |
| C8 | C9 | C10 | 114.1° | 109.1° |
| C8 | C9 | H21 | 108.3° | 109.6° |
| C8 | C9 | H22 | 108.3° | 109.5° |
| C9 | C10 | O7 | 107.5° | 109.5° |
| C9 | C10 | H19 | 109.0° | 109.6° |
| C10 | C9 | H21 | 108.3° | 109.5° |
| C10 | C9 | H22 | 108.3° | 109.5° |
| O7 | C10 | H19 | 110.3° | 109.6° |
| C10 | O7 | H20 | 109.5° | 114.0° |
| H1 | C1 | H2 | 109.5° | 109.3° |
| H7 | C5 | H8 | 109.5° | 109.5° |
| H11 | C7 | H12 | 109.5° | 109.5° |
| H16 | C12 | H17 | 109.5° | 109.5° |
| H16 | C12 | H18 | 109.4° | 109.5° |
| H17 | C12 | H18 | 109.5° | 109.4° |
| H21 | C9 | H22 | 109.5° | 109.6° |
| H23 | C14 | H24 | 109.5° | 109.1° |
| H35 | C24 | H36 | 109.4° | 109.6° |
| H38 | C26 | H39 | 109.5° | 109.5° |
| H38 | C26 | H40 | 109.4° | 109.4° |
| H39 | C26 | H40 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C23 | C22 | H34 | 180.0° | 179.5° |
| C23 | C24 | C25 | H35 | 120.0° | 119.9° |
| C23 | C24 | C25 | H36 | 120.0° | 119.9° |
| C23 | C24 | C25 | C26 | 168.5° | 145.4° |
| C23 | C24 | C25 | O1 | 73.2° | 94.6° |
| C24 | C23 | C22 | C21 | 179.2° | 177.2° |
| C24 | C23 | C22 | H33 | 0.8° | 0.7° |
| C23 | C24 | H35 | H36 | 120.0° | 120.2° |
| C23 | C24 | C25 | H37 | 49.1° | 25.6° |
| C22 | C23 | C24 | C25 | 107.7° | 142.0° |
| C23 | C22 | C21 | H33 | 180.0° | 176.5° |
| C23 | C22 | C21 | C20 | 162.3° | 148.6° |
| C23 | C22 | C21 | H32 | 17.7° | 21.5° |
| C22 | C23 | C24 | H35 | 132.3° | 98.1° |
| C22 | C23 | C24 | H36 | 12.3° | 22.1° |
| C24 | C25 | C26 | O1 | 119.0° | 120.3° |
| C24 | C25 | C26 | H37 | 119.4° | 119.8° |
| C24 | C25 | O1 | H37 | 121.5° | 120.2° |
| C24 | C25 | O1 | C | 138.2° | 168.2° |
| C25 | C24 | C23 | H34 | 72.3° | 37.5° |
| C25 | C24 | H35 | H36 | 120.0° | 120.2° |
| C24 | C25 | C26 | H38 | 180.0° | 60.0° |
| C24 | C25 | C26 | H39 | 60.0° | 180.0° |
| C24 | C25 | C26 | H40 | 60.0° | 60.0° |
| C26 | C25 | O1 | H37 | 120.8° | 119.8° |
| C26 | C25 | O1 | C | 104.1° | 71.8° |
| C26 | C25 | C24 | H35 | 48.5° | 25.5° |
| C26 | C25 | C24 | H36 | 71.5° | 94.7° |
| C25 | C26 | H38 | H39 | 120.0° | 120.0° |
| C25 | C26 | H38 | H40 | 120.0° | 120.0° |
| C25 | C26 | H39 | H40 | 120.0° | 120.1° |
| C25 | O1 | C | O | 14.3° | 1.1° |
| C25 | O1 | C | C1 | 164.4° | 178.6° |
| O1 | C25 | C24 | H35 | 166.8° | 145.4° |
| O1 | C25 | C24 | H36 | 46.8° | 25.2° |
| O1 | C25 | C26 | H38 | 61.0° | 60.3° |
| O1 | C25 | C26 | H39 | 179.0° | 59.7° |
| O1 | C25 | C26 | H40 | 59.0° | 179.8° |
| C22 | C21 | C20 | H32 | 180.0° | 169.7° |
| C22 | C21 | C20 | C19 | 179.0° | 146.5° |
| C22 | C21 | C20 | H31 | 1.0° | 29.7° |
| C21 | C22 | C23 | H34 | 0.8° | 2.3° |
| C21 | C20 | C19 | H31 | 180.0° | 176.1° |
| C21 | C20 | C19 | C18 | 175.3° | 133.2° |
| C21 | C20 | C19 | H30 | 4.6° | 37.6° |
| C20 | C21 | C22 | H33 | 17.7° | 27.9° |
| O | C | O1 | C1 | 178.8° | 179.7° |
| O | C | C1 | C2 | 153.8° | 13.6° |
| O | C | C1 | H1 | 33.7° | 106.6° |
| O | C | C1 | H2 | 86.3° | 133.7° |
| O1 | C | C1 | C2 | 25.0° | 166.6° |
| O1 | C | C1 | H1 | 145.0° | 73.1° |
| O1 | C | C1 | H2 | 95.0° | 46.5° |
| C | O1 | C25 | H37 | 16.7° | 48.0° |
| C | C1 | C2 | H1 | 120.0° | 120.2° |
| C | C1 | C2 | H2 | 120.0° | 120.1° |
| C | C1 | C2 | O2 | 73.7° | 20.8° |
| C | C1 | C2 | C3 | 169.2° | 140.8° |
| C | C1 | H1 | H2 | 120.0° | 119.7° |
| C | C1 | C2 | H3 | 46.6° | 99.2° |
| C20 | C19 | C18 | H30 | 180.0° | 170.2° |
| C20 | C19 | C18 | C17 | 178.4° | 144.8° |
| C20 | C19 | C18 | H29 | 1.6° | 33.6° |
| C19 | C20 | C21 | H32 | 1.1° | 23.3° |
| C19 | C18 | C17 | H29 | 180.0° | 178.4° |
| C19 | C18 | C17 | C16 | 171.5° | 160.0° |
| C19 | C18 | C17 | H28 | 8.5° | 15.2° |
| C18 | C19 | C20 | H31 | 4.7° | 43.0° |
| C1 | C2 | O2 | C3 | 120.2° | 120.1° |
| C1 | C2 | O2 | H3 | 119.4° | 119.9° |
| C1 | C2 | C3 | H3 | 122.5° | 119.9° |
| C1 | C2 | C3 | C4 | 118.7° | 129.3° |
| C2 | C1 | H1 | H2 | 120.0° | 119.7° |
| C1 | C2 | O2 | H4 | 180.0° | 180.0° |
| C1 | C2 | C3 | H5 | 61.4° | 50.5° |
| C18 | C17 | C16 | H28 | 180.0° | 175.2° |
| C18 | C17 | C16 | C15 | 178.5° | 170.8° |
| C18 | C17 | C16 | H27 | 1.5° | 9.1° |
| C17 | C18 | C19 | H30 | 1.6° | 25.4° |
| C17 | C16 | C15 | H27 | 180.0° | 179.9° |
| C17 | C16 | C15 | C14 | 107.7° | 146.9° |
| C17 | C16 | C15 | O6 | 136.1° | 26.6° |
| C17 | C16 | C15 | H25 | 12.3° | 93.0° |
| C16 | C17 | C18 | H29 | 8.5° | 18.4° |
| O2 | C2 | C3 | H3 | 121.2° | 120.0° |
| O2 | C2 | C3 | C4 | 125.0° | 9.3° |
| O2 | C2 | C1 | H1 | 166.3° | 141.0° |
| O2 | C2 | C1 | H2 | 46.3° | 99.3° |
| O2 | C2 | C3 | H5 | 54.9° | 170.6° |
| C2 | C3 | C4 | H5 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 179.9° | 179.4° |
| C3 | C2 | C1 | H1 | 49.2° | 98.9° |
| C3 | C2 | C1 | H2 | 70.9° | 20.7° |
| C3 | C2 | O2 | H4 | 59.8° | 60.0° |
| C2 | C3 | C4 | H6 | 0.1° | 0.9° |
| C16 | C15 | C14 | O6 | 117.9° | 120.2° |
| C16 | C15 | C14 | H25 | 120.2° | 120.1° |
| C16 | C15 | O6 | H25 | 123.0° | 119.4° |
| C16 | C15 | C14 | C13 | 63.1° | 110.4° |
| C16 | C15 | C14 | H23 | 176.5° | 129.0° |
| C16 | C15 | C14 | H24 | 57.4° | 10.0° |
| C16 | C15 | O6 | H26 | 180.0° | 59.1° |
| C15 | C16 | C17 | H28 | 1.5° | 4.4° |
| C14 | C15 | O6 | H25 | 121.0° | 119.7° |
| C15 | C14 | C13 | H23 | 120.5° | 120.5° |
| C15 | C14 | C13 | H24 | 120.5° | 120.5° |
| C15 | C14 | C13 | O5 | 100.5° | 17.6° |
| C15 | C14 | C13 | C11 | 140.2° | 138.2° |
| C15 | C14 | C13 | H14 | 20.1° | 102.6° |
| C15 | C14 | H23 | H24 | 118.6° | 119.0° |
| C14 | C15 | O6 | H26 | 64.1° | 180.0° |
| C14 | C15 | C16 | H27 | 72.3° | 33.2° |
| O6 | C15 | C14 | C13 | 54.8° | 129.3° |
| O6 | C15 | C14 | H23 | 65.7° | 8.8° |
| O6 | C15 | C14 | H24 | 175.2° | 110.2° |
| O6 | C15 | C16 | H27 | 43.9° | 153.5° |
| C3 | C4 | C5 | H6 | 180.0° | 179.7° |
| C3 | C4 | C5 | C6 | 153.1° | 88.4° |
| C4 | C3 | C2 | H3 | 3.8° | 110.8° |
| C3 | C4 | C5 | H7 | 86.8° | 151.6° |
| C3 | C4 | C5 | H8 | 32.9° | 31.5° |
| C4 | C5 | C6 | H7 | 120.1° | 120.0° |
| C4 | C5 | C6 | H8 | 120.2° | 120.0° |
| C4 | C5 | C6 | O3 | 65.0° | 115.6° |
| C4 | C5 | C6 | C7 | 177.6° | 124.3° |
| C5 | C4 | C3 | H5 | 0.1° | 0.5° |
| C4 | C5 | H7 | H8 | 119.6° | 120.1° |
| C4 | C5 | C6 | H9 | 57.3° | 4.2° |
| C14 | C13 | O5 | C11 | 120.6° | 120.4° |
| C14 | C13 | O5 | H14 | 119.7° | 120.4° |
| C14 | C13 | O5 | C8 | 173.0° | 178.5° |
| C14 | C13 | C11 | H14 | 120.1° | 119.2° |
| C14 | C13 | C11 | C12 | 61.9° | 61.1° |
| C14 | C13 | C11 | C10 | 173.8° | 178.9° |
| C14 | C13 | C11 | H15 | 56.2° | 58.8° |
| C13 | C14 | H23 | H24 | 118.6° | 119.0° |
| C13 | C14 | C15 | H25 | 176.7° | 9.6° |
| C5 | C6 | O3 | C7 | 118.1° | 120.5° |
| C5 | C6 | O3 | H9 | 121.4° | 119.8° |
| C5 | C6 | C7 | H9 | 120.2° | 120.2° |
| C5 | C6 | C7 | C8 | 174.1° | 150.2° |
| C6 | C5 | C4 | H6 | 26.9° | 91.9° |
| C6 | C5 | H7 | H8 | 119.6° | 120.0° |
| C5 | C6 | O3 | H10 | 180.0° | 60.0° |
| C5 | C6 | C7 | H11 | 53.5° | 89.8° |
| C5 | C6 | C7 | H12 | 65.3° | 30.2° |
| O3 | C6 | C7 | H9 | 121.4° | 119.7° |
| O3 | C6 | C7 | C8 | 67.4° | 30.1° |
| O3 | C6 | C5 | H7 | 174.9° | 124.5° |
| O3 | C6 | C5 | H8 | 55.2° | 4.4° |
| O3 | C6 | C7 | H11 | 172.0° | 150.0° |
| O3 | C6 | C7 | H12 | 53.1° | 90.0° |
| C6 | C7 | C8 | O5 | 52.0° | 98.2° |
| C6 | C7 | C8 | H11 | 120.6° | 120.0° |
| C6 | C7 | C8 | H12 | 120.6° | 120.0° |
| C6 | C7 | C8 | O4 | 69.5° | 22.1° |
| C6 | C7 | C8 | C9 | 170.3° | 141.7° |
| C7 | C6 | C5 | H7 | 57.4° | 4.3° |
| C7 | C6 | C5 | H8 | 62.3° | 115.8° |
| C7 | C6 | O3 | H10 | 61.9° | 179.5° |
| C6 | C7 | H11 | H12 | 118.2° | 120.0° |
| O5 | C13 | C11 | H14 | 120.5° | 119.1° |
| C13 | O5 | C8 | C7 | 179.1° | 178.1° |
| O5 | C13 | C11 | C12 | 178.7° | 177.2° |
| O5 | C13 | C11 | C10 | 54.4° | 57.2° |
| C13 | O5 | C8 | O4 | 57.1° | 57.7° |
| C13 | O5 | C8 | C9 | 63.4° | 61.5° |
| O5 | C13 | C11 | H15 | 63.2° | 62.8° |
| O5 | C13 | C14 | H23 | 139.1° | 102.9° |
| O5 | C13 | C14 | H24 | 20.0° | 138.1° |
| C8 | O5 | C13 | C11 | 66.4° | 61.1° |
| O5 | C8 | C7 | O4 | 121.5° | 120.3° |
| O5 | C8 | C7 | C9 | 118.3° | 120.1° |
| O5 | C8 | O4 | C9 | 119.9° | 119.3° |
| O5 | C8 | C9 | C10 | 49.8° | 57.8° |
| O5 | C8 | C7 | H11 | 68.6° | 21.7° |
| O5 | C8 | C7 | H12 | 172.6° | 141.7° |
| O5 | C8 | O4 | H13 | 180.0° | 64.3° |
| C8 | O5 | C13 | H14 | 53.3° | 58.1° |
| O5 | C8 | C9 | H21 | 70.9° | 62.0° |
| O5 | C8 | C9 | H22 | 170.5° | 177.7° |
| C13 | C11 | C12 | C10 | 125.2° | 119.9° |
| C13 | C11 | C12 | H15 | 118.1° | 120.0° |
| C13 | C11 | C10 | H15 | 117.6° | 120.0° |
| C13 | C11 | C10 | C9 | 43.9° | 56.8° |
| C13 | C11 | C10 | O7 | 162.7° | 176.6° |
| C13 | C11 | C12 | H16 | 180.0° | 60.0° |
| C13 | C11 | C12 | H17 | 60.0° | 180.0° |
| C13 | C11 | C12 | H18 | 60.0° | 60.0° |
| C13 | C11 | C10 | H19 | 77.2° | 63.2° |
| C11 | C13 | C14 | H23 | 19.7° | 17.7° |
| C11 | C13 | C14 | H24 | 99.3° | 101.4° |
| C7 | C8 | O4 | C9 | 118.8° | 120.0° |
| C7 | C8 | C9 | C10 | 168.6° | 178.5° |
| C8 | C7 | C6 | H9 | 53.9° | 89.6° |
| C8 | C7 | H11 | H12 | 118.2° | 120.0° |
| C7 | C8 | O4 | H13 | 58.7° | 175.0° |
| C7 | C8 | C9 | H21 | 47.9° | 58.7° |
| C7 | C8 | C9 | H22 | 70.7° | 61.6° |
| C12 | C11 | C10 | H15 | 116.6° | 120.0° |
| C12 | C11 | C10 | C9 | 169.7° | 176.7° |
| C12 | C11 | C10 | O7 | 71.5° | 63.4° |
| C12 | C11 | C13 | H14 | 58.1° | 58.1° |
| C11 | C12 | H16 | H17 | 120.0° | 120.1° |
| C11 | C12 | H16 | H18 | 120.0° | 120.0° |
| C11 | C12 | H17 | H18 | 120.0° | 120.0° |
| C12 | C11 | C10 | H19 | 48.6° | 56.8° |
| C11 | C10 | C9 | C8 | 42.2° | 57.1° |
| C11 | C10 | C9 | O7 | 119.3° | 119.9° |
| C11 | C10 | C9 | H19 | 121.1° | 119.9° |
| C11 | C10 | O7 | H19 | 119.3° | 120.2° |
| C10 | C11 | C13 | H14 | 66.1° | 61.9° |
| C10 | C11 | C12 | H16 | 54.8° | 179.9° |
| C10 | C11 | C12 | H17 | 65.3° | 60.0° |
| C10 | C11 | C12 | H18 | 174.8° | 59.9° |
| C11 | C10 | O7 | H20 | 180.0° | 180.0° |
| C11 | C10 | C9 | H21 | 78.5° | 62.8° |
| C11 | C10 | C9 | H22 | 162.9° | 177.0° |
| O4 | C8 | C9 | C10 | 70.7° | 61.6° |
| O4 | C8 | C7 | H11 | 169.9° | 142.1° |
| O4 | C8 | C7 | H12 | 51.1° | 97.9° |
| O4 | C8 | C9 | H21 | 168.6° | 178.5° |
| O4 | C8 | C9 | H22 | 50.0° | 58.3° |
| C8 | C9 | C10 | H21 | 120.7° | 119.9° |
| C8 | C9 | C10 | H22 | 120.7° | 119.9° |
| C8 | C9 | C10 | O7 | 161.5° | 177.0° |
| C9 | C8 | C7 | H11 | 49.7° | 98.3° |
| C9 | C8 | C7 | H12 | 69.2° | 21.7° |
| C9 | C8 | O4 | H13 | 60.1° | 55.0° |
| C8 | C9 | C10 | H19 | 78.9° | 62.8° |
| C8 | C9 | H21 | H22 | 117.9° | 120.2° |
| C9 | C10 | O7 | H19 | 118.7° | 120.2° |
| C9 | C10 | C11 | H15 | 73.7° | 63.3° |
| C9 | C10 | O7 | H20 | 58.0° | 60.4° |
| C10 | C9 | H21 | H22 | 117.9° | 120.1° |
| O7 | C10 | C11 | H15 | 45.1° | 56.6° |
| O7 | C10 | C9 | H21 | 40.9° | 57.1° |
| O7 | C10 | C9 | H22 | 77.7° | 63.1° |
| H1 | C1 | C2 | H3 | 73.4° | 21.0° |
| H2 | C1 | C2 | H3 | 166.6° | 140.7° |
| H3 | C2 | O2 | H4 | 60.7° | 60.0° |
| H3 | C2 | C3 | H5 | 176.1° | 69.4° |
| H5 | C3 | C4 | H6 | 179.9° | 179.2° |
| H6 | C4 | C5 | H7 | 93.2° | 28.0° |
| H6 | C4 | C5 | H8 | 147.1° | 148.1° |
| H7 | C5 | C6 | H9 | 62.8° | 115.8° |
| H8 | C5 | C6 | H9 | 177.5° | 124.1° |
| H9 | C6 | O3 | H10 | 58.6° | 59.8° |
| H9 | C6 | C7 | H11 | 66.7° | 30.4° |
| H9 | C6 | C7 | H12 | 174.5° | 150.4° |
| H14 | C13 | C11 | H15 | 176.2° | 178.1° |
| H14 | C13 | C14 | H23 | 100.3° | 136.8° |
| H14 | C13 | C14 | H24 | 140.6° | 17.8° |
| H15 | C11 | C12 | H16 | 61.9° | 60.1° |
| H15 | C11 | C12 | H17 | 178.1° | 60.0° |
| H15 | C11 | C12 | H18 | 58.1° | 180.0° |
| H15 | C11 | C10 | H19 | 165.2° | 176.8° |
| H16 | C12 | H17 | H18 | 119.9° | 120.0° |
| H19 | C10 | O7 | H20 | 60.7° | 59.8° |
| H19 | C10 | C9 | H21 | 160.4° | 177.3° |
| H19 | C10 | C9 | H22 | 41.8° | 57.1° |
| H23 | C14 | C15 | H25 | 56.2° | 110.9° |
| H24 | C14 | C15 | H25 | 62.9° | 130.1° |
| H25 | C15 | O6 | H26 | 57.0° | 60.3° |
| H25 | C15 | C16 | H27 | 167.6° | 86.9° |
| H27 | C16 | C17 | H28 | 178.5° | 175.7° |
| H28 | C17 | C18 | H29 | 171.5° | 166.4° |
| H29 | C18 | C19 | H30 | 178.4° | 156.2° |
| H30 | C19 | C20 | H31 | 175.4° | 146.3° |
| H31 | C20 | C21 | H32 | 179.0° | 160.6° |
| H32 | C21 | C22 | H33 | 162.3° | 162.0° |
| H33 | C22 | C23 | H34 | 179.2° | 178.8° |
| H34 | C23 | C24 | H35 | 47.7° | 82.4° |
| H34 | C23 | C24 | H36 | 167.7° | 157.4° |
| H35 | C24 | C25 | H37 | 70.9° | 94.3° |
| H36 | C24 | C25 | H37 | 169.1° | 145.5° |
| H37 | C25 | C26 | H38 | 60.6° | 179.8° |
| H37 | C25 | C26 | H39 | 59.4° | 60.2° |
| H37 | C25 | C26 | H40 | 179.4° | 59.9° |
| H38 | C26 | H39 | H40 | 120.0° | 119.9° |
