8BO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C7 | C1 | doub | 1.31Å | 1.32Å | |
| O8 | C6 | sing | 1.43Å | 1.42Å | |
| C1 | C6 | sing | 1.51Å | 1.50Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C2 | O9 | sing | 1.43Å | 1.44Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.51Å | 1.51Å | |
| C3 | C4 | sing | 1.51Å | 1.52Å | |
| C4 | C10 | doub | 1.33Å | 1.36Å | |
| C10 | C11 | sing | 1.47Å | 1.46Å | |
| C11 | C12 | doub | 1.33Å | 1.35Å | |
| C12 | C17 | sing | 1.50Å | 1.50Å | |
| C12 | C13 | sing | 1.52Å | 1.52Å | |
| C18 | C17 | sing | 1.53Å | 1.53Å | |
| C18 | C19 | sing | 1.56Å | 1.53Å | |
| C29 | O28 | sing | 1.43Å | 1.43Å | |
| C23 | C16 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.55Å | 1.51Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C19 | C20 | sing | 1.55Å | 1.54Å | |
| C16 | C20 | sing | 1.52Å | 1.52Å | |
| C16 | C15 | sing | 1.51Å | 1.53Å | |
| O28 | C27 | sing | 1.43Å | 1.42Å | |
| C14 | C15 | sing | 1.54Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C24 | C21 | sing | 1.53Å | 1.53Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C27 | C26 | sing | 1.53Å | 1.54Å | |
| C27 | C30 | sing | 1.51Å | 1.48Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C30 | C31 | doub | 1.38Å | 1.39Å | Aromatic |
| C30 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C31 | C32 | sing | 1.38Å | 1.40Å | Aromatic |
| C35 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C32 | C33 | doub | 1.39Å | 1.40Å | Aromatic |
| C34 | C33 | sing | 1.39Å | 1.39Å | Aromatic |
| C33 | O36 | sing | 1.36Å | 1.37Å | |
| O36 | H1 | sing | 0.97Å | 0.95Å | |
| C32 | H2 | sing | 1.08Å | 1.08Å | |
| C31 | H3 | sing | 1.08Å | 1.08Å | |
| C34 | H4 | sing | 1.08Å | 1.08Å | |
| C35 | H5 | sing | 1.08Å | 1.08Å | |
| C27 | H6 | sing | 1.09Å | 1.10Å | |
| C29 | H7 | sing | 1.09Å | 1.10Å | |
| C29 | H8 | sing | 1.09Å | 1.10Å | |
| C29 | H9 | sing | 1.09Å | 1.10Å | |
| C26 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.09Å | 1.10Å | |
| C25 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C24 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C21 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C15 | H24 | sing | 1.09Å | 1.10Å | |
| C15 | H25 | sing | 1.09Å | 1.10Å | |
| C14 | H26 | sing | 1.09Å | 1.10Å | |
| C14 | H27 | sing | 1.09Å | 1.10Å | |
| C13 | H28 | sing | 1.09Å | 1.10Å | |
| C13 | H29 | sing | 1.09Å | 1.10Å | |
| C19 | H30 | sing | 1.09Å | 1.10Å | |
| C19 | H31 | sing | 1.09Å | 1.10Å | |
| C18 | H32 | sing | 1.09Å | 1.10Å | |
| C18 | H33 | sing | 1.09Å | 1.10Å | |
| C17 | H34 | sing | 1.09Å | 1.10Å | |
| C11 | H35 | sing | 1.08Å | 1.08Å | |
| C10 | H36 | sing | 1.08Å | 1.08Å | |
| C3 | H37 | sing | 1.09Å | 1.10Å | |
| C3 | H38 | sing | 1.09Å | 1.10Å | |
| C2 | H39 | sing | 1.09Å | 1.10Å | |
| O9 | H40 | sing | 0.97Å | 0.95Å | |
| C5 | H41 | sing | 1.09Å | 1.10Å | |
| C5 | H42 | sing | 1.09Å | 1.10Å | |
| C6 | H43 | sing | 1.09Å | 1.10Å | |
| O8 | H44 | sing | 0.97Å | 0.95Å | |
| C7 | H45 | sing | 1.08Å | 1.08Å | |
| C7 | H46 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C7 | C1 | C6 | 122.1° | 120.5° |
| C7 | C1 | C2 | 122.4° | 120.7° |
| C1 | C7 | H45 | 120.0° | 120.0° |
| C1 | C7 | H46 | 120.0° | 120.0° |
| O8 | C6 | C1 | 110.2° | 109.6° |
| O8 | C6 | C5 | 107.9° | 109.6° |
| O8 | C6 | H43 | 109.5° | 109.6° |
| C6 | O8 | H44 | 109.5° | 114.0° |
| C6 | C1 | C2 | 115.5° | 118.7° |
| C1 | C6 | C5 | 112.4° | 108.6° |
| C1 | C6 | H43 | 108.5° | 109.6° |
| C1 | C2 | O9 | 108.3° | 109.6° |
| C1 | C2 | C3 | 108.4° | 108.7° |
| C1 | C2 | H39 | 108.9° | 109.8° |
| C6 | C5 | C4 | 115.6° | 108.6° |
| C6 | C5 | H41 | 107.9° | 109.6° |
| C6 | C5 | H42 | 107.9° | 109.8° |
| C5 | C6 | H43 | 108.1° | 109.7° |
| O9 | C2 | C3 | 112.6° | 109.6° |
| O9 | C2 | H39 | 109.8° | 109.6° |
| C2 | O9 | H40 | 109.5° | 114.0° |
| C2 | C3 | C4 | 112.2° | 108.6° |
| C2 | C3 | H37 | 108.8° | 109.6° |
| C2 | C3 | H38 | 108.8° | 109.8° |
| C3 | C2 | H39 | 108.6° | 109.6° |
| C5 | C4 | C3 | 120.4° | 118.9° |
| C5 | C4 | C10 | 122.7° | 120.6° |
| C4 | C5 | H41 | 107.9° | 109.6° |
| C4 | C5 | H42 | 107.9° | 109.6° |
| C3 | C4 | C10 | 116.8° | 120.6° |
| C4 | C3 | H37 | 108.8° | 109.6° |
| C4 | C3 | H38 | 108.8° | 109.6° |
| C4 | C10 | C11 | 125.5° | 120.0° |
| C4 | C10 | H36 | 117.3° | 120.0° |
| C10 | C11 | C12 | 122.6° | 120.0° |
| C10 | C11 | H35 | 118.7° | 120.0° |
| C11 | C10 | H36 | 117.3° | 120.0° |
| C11 | C12 | C17 | 123.4° | 122.4° |
| C11 | C12 | C13 | 126.2° | 122.4° |
| C12 | C11 | H35 | 118.7° | 120.0° |
| C17 | C12 | C13 | 110.4° | 115.2° |
| C12 | C17 | C18 | 120.1° | 116.8° |
| C12 | C17 | C16 | 107.8° | 105.5° |
| C12 | C17 | H34 | 107.1° | 111.0° |
| C12 | C13 | C14 | 106.0° | 110.7° |
| C12 | C13 | H28 | 110.3° | 109.3° |
| C12 | C13 | H29 | 110.3° | 109.2° |
| C17 | C18 | C19 | 103.4° | 102.7° |
| C18 | C17 | C16 | 107.5° | 101.3° |
| C17 | C18 | H32 | 111.0° | 110.8° |
| C17 | C18 | H33 | 111.0° | 110.7° |
| C18 | C17 | H34 | 106.7° | 110.7° |
| C18 | C19 | C20 | 103.4° | 106.3° |
| C18 | C19 | H30 | 111.0° | 110.1° |
| C18 | C19 | H31 | 111.0° | 110.2° |
| C19 | C18 | H32 | 111.0° | 110.8° |
| C19 | C18 | H33 | 111.0° | 110.7° |
| C29 | O28 | C27 | 112.1° | 114.0° |
| O28 | C29 | H7 | 109.5° | 109.5° |
| O28 | C29 | H8 | 109.5° | 109.5° |
| O28 | C29 | H9 | 109.5° | 109.4° |
| C23 | C16 | C17 | 112.9° | 108.6° |
| C23 | C16 | C20 | 112.0° | 109.3° |
| C23 | C16 | C15 | 109.2° | 109.3° |
| C16 | C23 | H21 | 109.5° | 109.4° |
| C16 | C23 | H22 | 109.5° | 109.5° |
| C16 | C23 | H23 | 109.5° | 109.5° |
| C17 | C16 | C20 | 95.8° | 103.2° |
| C17 | C16 | C15 | 108.6° | 107.6° |
| C16 | C17 | H34 | 106.9° | 110.8° |
| C13 | C14 | C15 | 113.0° | 111.8° |
| C13 | C14 | H26 | 108.6° | 109.0° |
| C13 | C14 | H27 | 108.6° | 109.0° |
| C14 | C13 | H28 | 110.3° | 109.2° |
| C14 | C13 | H29 | 110.3° | 109.2° |
| C19 | C20 | C16 | 104.3° | 105.1° |
| C19 | C20 | C21 | 119.7° | 110.3° |
| C19 | C20 | H20 | 105.5° | 110.3° |
| C20 | C19 | H30 | 111.0° | 110.1° |
| C20 | C19 | H31 | 111.0° | 110.1° |
| C20 | C16 | C15 | 117.8° | 118.4° |
| C16 | C20 | C21 | 114.9° | 110.3° |
| C16 | C20 | H20 | 105.7° | 110.3° |
| C16 | C15 | C14 | 110.9° | 107.6° |
| C16 | C15 | H24 | 109.1° | 109.8° |
| C16 | C15 | H25 | 109.1° | 109.8° |
| O28 | C27 | C26 | 107.9° | 109.5° |
| O28 | C27 | C30 | 105.8° | 109.4° |
| O28 | C27 | H6 | 111.4° | 109.4° |
| C14 | C15 | H24 | 109.1° | 109.9° |
| C14 | C15 | H25 | 109.1° | 109.9° |
| C15 | C14 | H26 | 108.6° | 109.0° |
| C15 | C14 | H27 | 108.6° | 109.0° |
| C20 | C21 | C24 | 117.8° | 109.5° |
| C20 | C21 | C22 | 106.9° | 109.5° |
| C20 | C21 | H16 | 106.0° | 109.5° |
| C21 | C20 | H20 | 105.5° | 110.3° |
| C21 | C24 | C25 | 108.5° | 109.5° |
| C24 | C21 | C22 | 113.2° | 109.5° |
| C21 | C24 | H14 | 109.7° | 109.5° |
| C21 | C24 | H15 | 109.7° | 109.5° |
| C24 | C21 | H16 | 105.9° | 109.5° |
| C24 | C25 | C26 | 114.6° | 109.5° |
| C24 | C25 | H12 | 108.2° | 109.5° |
| C24 | C25 | H13 | 108.2° | 109.5° |
| C25 | C24 | H14 | 109.7° | 109.5° |
| C25 | C24 | H15 | 109.7° | 109.5° |
| C26 | C27 | C30 | 111.5° | 109.5° |
| C27 | C26 | C25 | 115.2° | 109.5° |
| C26 | C27 | H6 | 109.7° | 109.5° |
| C27 | C26 | H10 | 108.0° | 109.5° |
| C27 | C26 | H11 | 108.0° | 109.5° |
| C27 | C30 | C31 | 121.8° | 119.9° |
| C27 | C30 | C35 | 117.9° | 120.0° |
| C30 | C27 | H6 | 110.5° | 109.5° |
| C25 | C26 | H10 | 108.0° | 109.5° |
| C25 | C26 | H11 | 108.0° | 109.4° |
| C26 | C25 | H12 | 108.2° | 109.4° |
| C26 | C25 | H13 | 108.2° | 109.5° |
| C22 | C21 | H16 | 106.1° | 109.4° |
| C21 | C22 | H17 | 109.5° | 109.4° |
| C21 | C22 | H18 | 109.5° | 109.5° |
| C21 | C22 | H19 | 109.5° | 109.5° |
| C31 | C30 | C35 | 120.3° | 120.1° |
| C30 | C31 | C32 | 120.2° | 120.0° |
| C30 | C31 | H3 | 119.9° | 119.9° |
| C30 | C35 | C34 | 119.4° | 120.1° |
| C30 | C35 | H5 | 120.3° | 119.9° |
| C31 | C32 | C33 | 119.6° | 119.9° |
| C31 | C32 | H2 | 120.2° | 120.0° |
| C32 | C31 | H3 | 119.9° | 120.0° |
| C35 | C34 | C33 | 121.0° | 119.9° |
| C35 | C34 | H4 | 119.5° | 120.0° |
| C34 | C35 | H5 | 120.3° | 120.0° |
| C32 | C33 | C34 | 119.5° | 119.9° |
| C32 | C33 | O36 | 121.5° | 120.1° |
| C33 | C32 | H2 | 120.2° | 120.0° |
| C34 | C33 | O36 | 119.0° | 120.0° |
| C33 | C34 | H4 | 119.5° | 120.1° |
| C33 | O36 | H1 | 109.5° | 114.0° |
| H7 | C29 | H8 | 109.4° | 109.5° |
| H7 | C29 | H9 | 109.5° | 109.4° |
| H8 | C29 | H9 | 109.5° | 109.4° |
| H10 | C26 | H11 | 109.5° | 109.5° |
| H12 | C25 | H13 | 109.5° | 109.5° |
| H14 | C24 | H15 | 109.5° | 109.4° |
| H17 | C22 | H18 | 109.5° | 109.5° |
| H17 | C22 | H19 | 109.4° | 109.4° |
| H18 | C22 | H19 | 109.5° | 109.5° |
| H21 | C23 | H22 | 109.4° | 109.5° |
| H21 | C23 | H23 | 109.5° | 109.5° |
| H22 | C23 | H23 | 109.5° | 109.5° |
| H24 | C15 | H25 | 109.4° | 109.8° |
| H26 | C14 | H27 | 109.5° | 109.0° |
| H28 | C13 | H29 | 109.5° | 109.2° |
| H30 | C19 | H31 | 109.5° | 110.1° |
| H32 | C18 | H33 | 109.5° | 110.8° |
| H37 | C3 | H38 | 109.5° | 109.6° |
| H41 | C5 | H42 | 109.4° | 109.6° |
| H45 | C7 | H46 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C7 | C1 | C6 | O8 | 8.0° | 4.9° |
| C7 | C1 | C6 | C2 | 179.9° | 179.8° |
| C7 | C1 | C6 | C5 | 128.5° | 124.7° |
| C7 | C1 | C2 | O9 | 119.6° | 115.6° |
| C7 | C1 | C2 | C3 | 117.9° | 124.7° |
| C7 | C1 | C2 | H39 | 0.1° | 4.8° |
| C7 | C1 | C6 | H43 | 112.0° | 115.5° |
| C1 | C7 | H45 | H46 | 180.0° | 179.9° |
| O8 | C6 | C1 | C5 | 120.5° | 119.8° |
| O8 | C6 | C1 | H43 | 120.0° | 120.4° |
| O8 | C6 | C1 | C2 | 172.1° | 175.3° |
| O8 | C6 | C5 | H43 | 118.4° | 120.4° |
| O8 | C6 | C5 | C4 | 153.2° | 169.3° |
| O8 | C6 | C5 | H41 | 32.3° | 71.0° |
| O8 | C6 | C5 | H42 | 85.9° | 49.5° |
| C1 | C6 | C5 | H43 | 119.8° | 119.8° |
| C6 | C1 | C2 | O9 | 60.4° | 64.2° |
| C6 | C1 | C2 | C3 | 62.1° | 55.5° |
| C1 | C6 | C5 | C4 | 31.4° | 49.5° |
| C6 | C1 | C2 | H39 | 179.8° | 175.4° |
| C1 | C6 | C5 | H41 | 89.5° | 169.2° |
| C1 | C6 | C5 | H42 | 152.3° | 70.3° |
| C1 | C6 | O8 | H44 | 180.0° | 60.8° |
| C6 | C1 | C7 | H45 | 179.9° | 0.1° |
| C6 | C1 | C7 | H46 | 0.1° | 180.0° |
| C2 | C1 | C6 | C5 | 51.6° | 55.5° |
| C1 | C2 | O9 | C3 | 119.9° | 119.2° |
| C1 | C2 | O9 | H39 | 118.9° | 120.5° |
| C1 | C2 | C3 | H39 | 118.3° | 120.0° |
| C1 | C2 | C3 | C4 | 51.6° | 49.4° |
| C1 | C2 | C3 | H37 | 172.0° | 70.3° |
| C1 | C2 | C3 | H38 | 68.8° | 169.2° |
| C1 | C2 | O9 | H40 | 180.0° | 60.8° |
| C2 | C1 | C6 | H43 | 67.9° | 64.3° |
| C2 | C1 | C7 | H45 | 0.0° | 179.7° |
| C2 | C1 | C7 | H46 | 180.0° | 0.2° |
| C6 | C5 | C4 | H41 | 120.9° | 119.7° |
| C6 | C5 | C4 | H42 | 120.9° | 119.9° |
| C6 | C5 | C4 | C3 | 26.3° | 55.0° |
| C6 | C5 | C4 | C10 | 156.4° | 124.7° |
| C6 | C5 | H41 | H42 | 117.2° | 120.5° |
| C5 | C6 | O8 | H44 | 56.9° | 180.0° |
| O9 | C2 | C3 | H39 | 121.9° | 120.3° |
| O9 | C2 | C3 | C4 | 68.3° | 70.3° |
| O9 | C2 | C3 | H37 | 52.2° | 170.0° |
| O9 | C2 | C3 | H38 | 171.3° | 49.5° |
| C2 | C3 | C4 | C5 | 36.9° | 55.0° |
| C2 | C3 | C4 | H37 | 120.4° | 119.7° |
| C2 | C3 | C4 | H38 | 120.4° | 120.0° |
| C2 | C3 | C4 | C10 | 145.6° | 124.7° |
| C2 | C3 | H37 | H38 | 118.8° | 120.6° |
| C3 | C2 | O9 | H40 | 60.1° | 180.0° |
| C5 | C4 | C3 | C10 | 177.5° | 179.7° |
| C5 | C4 | C10 | C11 | 0.3° | 5.6° |
| C5 | C4 | C10 | H36 | 179.7° | 174.3° |
| C5 | C4 | C3 | H37 | 157.3° | 64.7° |
| C5 | C4 | C3 | H38 | 83.5° | 174.9° |
| C4 | C5 | H41 | H42 | 117.2° | 120.4° |
| C4 | C5 | C6 | H43 | 88.4° | 70.3° |
| C3 | C4 | C10 | C11 | 177.1° | 174.1° |
| C3 | C4 | C10 | H36 | 2.9° | 6.0° |
| C4 | C3 | H37 | H38 | 118.7° | 120.3° |
| C4 | C3 | C2 | H39 | 169.9° | 169.4° |
| C3 | C4 | C5 | H41 | 94.6° | 174.8° |
| C3 | C4 | C5 | H42 | 147.2° | 64.9° |
| C4 | C10 | C11 | H36 | 180.0° | 179.9° |
| C4 | C10 | C11 | C12 | 168.5° | 174.5° |
| C4 | C10 | C11 | H35 | 11.5° | 5.5° |
| C10 | C4 | C3 | H37 | 25.2° | 115.5° |
| C10 | C4 | C3 | H38 | 94.0° | 4.8° |
| C10 | C4 | C5 | H41 | 82.7° | 5.0° |
| C10 | C4 | C5 | H42 | 35.4° | 115.4° |
| C10 | C11 | C12 | H35 | 180.0° | 180.0° |
| C10 | C11 | C12 | C17 | 177.8° | 180.0° |
| C10 | C11 | C12 | C13 | 1.0° | 0.0° |
| C11 | C12 | C17 | C13 | 179.0° | 180.0° |
| C11 | C12 | C17 | C18 | 13.7° | 10.3° |
| C11 | C12 | C17 | C16 | 109.8° | 121.8° |
| C11 | C12 | C13 | C14 | 115.8° | 129.8° |
| C11 | C12 | C13 | H28 | 124.8° | 9.4° |
| C11 | C12 | C13 | H29 | 3.7° | 109.9° |
| C11 | C12 | C17 | H34 | 135.5° | 118.0° |
| C12 | C11 | C10 | H36 | 11.5° | 5.4° |
| C12 | C17 | C18 | C16 | 123.7° | 114.0° |
| C12 | C17 | C18 | H34 | 121.9° | 128.4° |
| C12 | C17 | C18 | C19 | 147.0° | 156.2° |
| C12 | C17 | C16 | C23 | 58.5° | 51.7° |
| C12 | C17 | C16 | H34 | 114.9° | 120.3° |
| C17 | C12 | C13 | C14 | 63.1° | 50.2° |
| C12 | C17 | C16 | C20 | 175.4° | 167.6° |
| C12 | C17 | C16 | C15 | 62.8° | 66.5° |
| C17 | C12 | C13 | H28 | 56.3° | 170.5° |
| C17 | C12 | C13 | H29 | 177.4° | 70.1° |
| C12 | C17 | C18 | H32 | 28.0° | 85.4° |
| C12 | C17 | C18 | H33 | 93.9° | 38.0° |
| C17 | C12 | C11 | H35 | 2.2° | 0.1° |
| C13 | C12 | C17 | C18 | 167.3° | 169.7° |
| C13 | C12 | C17 | C16 | 69.2° | 58.1° |
| C12 | C13 | C14 | H28 | 119.4° | 120.3° |
| C12 | C13 | C14 | H29 | 119.5° | 120.3° |
| C12 | C13 | C14 | C15 | 54.7° | 48.6° |
| C12 | C13 | C14 | H26 | 175.2° | 72.0° |
| C12 | C13 | C14 | H27 | 65.8° | 169.1° |
| C12 | C13 | H28 | H29 | 121.6° | 119.4° |
| C13 | C12 | C17 | H34 | 45.5° | 62.1° |
| C13 | C12 | C11 | H35 | 179.0° | 180.0° |
| C17 | C18 | C19 | H32 | 119.0° | 118.4° |
| C17 | C18 | C19 | H33 | 119.0° | 118.2° |
| C18 | C17 | C16 | C23 | 72.3° | 70.5° |
| C18 | C17 | C16 | H34 | 114.3° | 117.5° |
| C17 | C18 | C19 | C20 | 8.3° | 24.1° |
| C18 | C17 | C16 | C20 | 44.5° | 45.5° |
| C18 | C17 | C16 | C15 | 166.4° | 171.4° |
| C17 | C18 | C19 | H30 | 110.8° | 95.1° |
| C17 | C18 | C19 | H31 | 127.3° | 143.4° |
| C17 | C18 | H32 | H33 | 122.8° | 123.3° |
| C19 | C18 | C17 | C16 | 23.4° | 42.2° |
| C18 | C19 | C20 | H30 | 119.0° | 119.2° |
| C18 | C19 | C20 | H31 | 119.0° | 119.3° |
| C18 | C19 | C20 | C16 | 37.0° | 3.9° |
| C18 | C19 | C20 | C21 | 167.4° | 122.9° |
| C18 | C19 | C20 | H20 | 74.1° | 115.0° |
| C18 | C19 | H30 | H31 | 122.8° | 121.6° |
| C19 | C18 | H32 | H33 | 122.8° | 123.3° |
| C19 | C18 | C17 | H34 | 91.0° | 75.4° |
| C29 | O28 | C27 | C26 | 130.3° | 150.0° |
| C29 | O28 | C27 | C30 | 110.3° | 90.0° |
| C29 | O28 | C27 | H6 | 9.7° | 29.9° |
| O28 | C29 | H7 | H8 | 120.0° | 120.1° |
| O28 | C29 | H7 | H9 | 120.0° | 120.0° |
| O28 | C29 | H8 | H9 | 120.0° | 120.0° |
| C23 | C16 | C17 | C20 | 116.8° | 115.9° |
| C23 | C16 | C17 | C15 | 121.3° | 118.2° |
| C23 | C16 | C20 | C19 | 68.3° | 85.3° |
| C23 | C16 | C20 | C15 | 127.9° | 125.9° |
| C23 | C16 | C15 | C14 | 68.5° | 49.7° |
| C23 | C16 | C20 | C21 | 64.8° | 33.7° |
| C23 | C16 | C20 | H20 | 179.3° | 155.8° |
| C16 | C23 | H21 | H22 | 120.0° | 120.0° |
| C16 | C23 | H21 | H23 | 120.0° | 120.0° |
| C16 | C23 | H22 | H23 | 120.0° | 120.0° |
| C23 | C16 | C15 | H24 | 51.7° | 69.8° |
| C23 | C16 | C15 | H25 | 171.2° | 169.3° |
| C23 | C16 | C17 | H34 | 173.4° | 172.0° |
| C17 | C16 | C20 | C19 | 49.2° | 30.2° |
| C17 | C16 | C20 | C15 | 114.6° | 118.7° |
| C17 | C16 | C15 | C14 | 54.9° | 68.1° |
| C17 | C16 | C20 | C21 | 177.7° | 149.1° |
| C17 | C16 | C20 | H20 | 61.8° | 88.7° |
| C17 | C16 | C23 | H21 | 180.0° | 179.9° |
| C17 | C16 | C23 | H22 | 60.0° | 60.1° |
| C17 | C16 | C23 | H23 | 60.0° | 59.9° |
| C17 | C16 | C15 | H24 | 175.2° | 172.4° |
| C17 | C16 | C15 | H25 | 65.3° | 51.6° |
| C16 | C17 | C18 | H32 | 95.6° | 160.6° |
| C16 | C17 | C18 | H33 | 142.4° | 76.0° |
| C13 | C14 | C15 | C16 | 52.7° | 59.1° |
| C13 | C14 | C15 | H26 | 120.5° | 120.6° |
| C13 | C14 | C15 | H27 | 120.5° | 120.5° |
| C13 | C14 | C15 | H24 | 172.9° | 178.6° |
| C13 | C14 | C15 | H25 | 67.5° | 60.5° |
| C13 | C14 | H26 | H27 | 118.4° | 118.9° |
| C14 | C13 | H28 | H29 | 121.6° | 119.4° |
| C19 | C20 | C16 | C21 | 133.1° | 118.9° |
| C19 | C20 | C16 | H20 | 111.0° | 118.9° |
| C19 | C20 | C16 | C15 | 163.8° | 148.8° |
| C19 | C20 | C21 | H20 | 118.6° | 122.1° |
| C19 | C20 | C21 | C24 | 56.9° | 62.8° |
| C19 | C20 | C21 | C22 | 71.9° | 177.2° |
| C19 | C20 | C21 | H16 | 175.2° | 57.2° |
| C20 | C19 | H30 | H31 | 122.8° | 121.5° |
| C20 | C19 | C18 | H32 | 127.3° | 142.5° |
| C20 | C19 | C18 | H33 | 110.8° | 94.1° |
| C20 | C16 | C15 | C14 | 162.2° | 175.6° |
| C16 | C20 | C21 | H20 | 116.0° | 122.2° |
| C16 | C20 | C21 | C24 | 68.5° | 178.6° |
| C16 | C20 | C21 | C22 | 162.7° | 61.4° |
| C16 | C20 | C21 | H16 | 49.8° | 58.6° |
| C20 | C16 | C23 | H21 | 73.3° | 67.9° |
| C20 | C16 | C23 | H22 | 166.8° | 172.0° |
| C20 | C16 | C23 | H23 | 46.7° | 52.0° |
| C20 | C16 | C15 | H24 | 77.5° | 56.1° |
| C20 | C16 | C15 | H25 | 42.0° | 64.8° |
| C16 | C20 | C19 | H30 | 82.0° | 123.1° |
| C16 | C20 | C19 | H31 | 156.1° | 115.4° |
| C20 | C16 | C17 | H34 | 69.8° | 72.1° |
| C16 | C15 | C14 | H24 | 120.2° | 119.5° |
| C16 | C15 | C14 | H25 | 120.2° | 119.5° |
| C15 | C16 | C20 | C21 | 63.1° | 92.2° |
| C15 | C16 | C20 | H20 | 52.8° | 29.9° |
| C15 | C16 | C23 | H21 | 59.1° | 63.0° |
| C15 | C16 | C23 | H22 | 60.9° | 57.0° |
| C15 | C16 | C23 | H23 | 179.1° | 177.0° |
| C16 | C15 | H24 | H25 | 119.3° | 120.9° |
| C16 | C15 | C14 | H26 | 173.2° | 61.5° |
| C16 | C15 | C14 | H27 | 67.8° | 179.6° |
| C15 | C16 | C17 | H34 | 52.1° | 53.8° |
| O28 | C27 | C26 | C30 | 115.8° | 120.0° |
| O28 | C27 | C26 | H6 | 121.5° | 120.0° |
| O28 | C27 | C30 | H6 | 120.7° | 119.9° |
| O28 | C27 | C26 | C25 | 179.8° | 65.0° |
| O28 | C27 | C30 | C31 | 101.2° | 145.0° |
| O28 | C27 | C30 | C35 | 78.0° | 34.8° |
| C27 | O28 | C29 | H7 | 180.0° | 180.0° |
| C27 | O28 | C29 | H8 | 60.0° | 59.9° |
| C27 | O28 | C29 | H9 | 60.0° | 60.0° |
| O28 | C27 | C26 | H10 | 59.0° | 55.0° |
| O28 | C27 | C26 | H11 | 59.4° | 175.1° |
| C14 | C15 | H24 | H25 | 119.4° | 121.0° |
| C15 | C14 | H26 | H27 | 118.4° | 118.9° |
| C15 | C14 | C13 | H28 | 64.7° | 168.9° |
| C15 | C14 | C13 | H29 | 174.2° | 71.7° |
| C20 | C21 | C24 | C22 | 125.8° | 120.0° |
| C20 | C21 | C24 | H16 | 118.3° | 120.0° |
| C20 | C21 | C24 | C25 | 148.3° | 175.0° |
| C20 | C21 | C22 | H16 | 112.8° | 120.0° |
| C20 | C21 | C24 | H14 | 28.5° | 64.9° |
| C20 | C21 | C24 | H15 | 91.8° | 55.0° |
| C20 | C21 | C22 | H17 | 180.0° | 60.1° |
| C20 | C21 | C22 | H18 | 60.0° | 59.9° |
| C20 | C21 | C22 | H19 | 60.0° | 180.0° |
| C21 | C20 | C19 | H30 | 48.3° | 117.9° |
| C21 | C20 | C19 | H31 | 73.6° | 3.6° |
| C21 | C24 | C25 | H14 | 119.9° | 120.0° |
| C21 | C24 | C25 | H15 | 119.9° | 120.0° |
| C21 | C24 | C25 | C26 | 169.4° | 180.0° |
| C24 | C21 | C22 | H16 | 115.8° | 120.0° |
| C21 | C24 | C25 | H12 | 69.8° | 60.0° |
| C21 | C24 | C25 | H13 | 48.7° | 60.0° |
| C21 | C24 | H14 | H15 | 120.4° | 120.0° |
| C24 | C21 | C22 | H17 | 48.6° | 60.0° |
| C24 | C21 | C22 | H18 | 71.4° | 180.0° |
| C24 | C21 | C22 | H19 | 168.6° | 59.9° |
| C24 | C21 | C20 | H20 | 175.5° | 59.3° |
| C24 | C25 | C26 | C27 | 81.1° | 180.0° |
| C24 | C25 | C26 | H12 | 120.8° | 120.0° |
| C24 | C25 | C26 | H13 | 120.8° | 120.0° |
| C25 | C24 | C21 | C22 | 85.9° | 65.0° |
| C24 | C25 | C26 | H10 | 39.8° | 60.0° |
| C24 | C25 | C26 | H11 | 158.1° | 60.0° |
| C24 | C25 | H12 | H13 | 117.7° | 120.0° |
| C25 | C24 | H14 | H15 | 120.4° | 120.0° |
| C25 | C24 | C21 | H16 | 30.0° | 55.0° |
| C26 | C27 | C30 | H6 | 122.3° | 120.0° |
| C27 | C26 | C25 | H10 | 120.8° | 120.0° |
| C27 | C26 | C25 | H11 | 120.8° | 120.0° |
| C26 | C27 | C30 | C31 | 141.7° | 95.0° |
| C26 | C27 | C30 | C35 | 39.0° | 85.3° |
| C27 | C26 | H10 | H11 | 117.4° | 120.0° |
| C27 | C26 | C25 | H12 | 39.7° | 60.0° |
| C27 | C26 | C25 | H13 | 158.2° | 60.0° |
| C30 | C27 | C26 | C25 | 64.4° | 175.0° |
| C27 | C30 | C31 | C35 | 179.2° | 179.8° |
| C27 | C30 | C31 | C32 | 179.9° | 180.0° |
| C27 | C30 | C35 | C34 | 179.9° | 180.0° |
| C27 | C30 | C31 | H3 | 0.1° | 0.1° |
| C27 | C30 | C35 | H5 | 0.2° | 0.0° |
| C30 | C27 | C26 | H10 | 174.7° | 65.0° |
| C30 | C27 | C26 | H11 | 56.4° | 55.1° |
| C25 | C26 | C27 | H6 | 58.3° | 55.0° |
| C25 | C26 | H10 | H11 | 117.4° | 120.0° |
| C26 | C25 | H12 | H13 | 117.7° | 120.0° |
| C26 | C25 | C24 | H14 | 49.5° | 60.0° |
| C26 | C25 | C24 | H15 | 70.7° | 60.0° |
| C22 | C21 | C24 | H14 | 154.2° | 55.1° |
| C22 | C21 | C24 | H15 | 34.0° | 175.0° |
| C21 | C22 | H17 | H18 | 120.0° | 120.0° |
| C21 | C22 | H17 | H19 | 120.0° | 120.0° |
| C21 | C22 | H18 | H19 | 120.0° | 120.1° |
| C22 | C21 | C20 | H20 | 46.7° | 60.7° |
| C30 | C31 | C32 | H3 | 180.0° | 179.9° |
| C31 | C30 | C35 | C34 | 0.9° | 0.3° |
| C30 | C31 | C32 | C33 | 0.4° | 0.0° |
| C30 | C31 | C32 | H2 | 179.6° | 180.0° |
| C31 | C30 | C35 | H5 | 179.1° | 179.7° |
| C31 | C30 | C27 | H6 | 19.4° | 25.1° |
| C35 | C30 | C31 | C32 | 0.9° | 0.3° |
| C30 | C35 | C34 | H5 | 180.0° | 180.0° |
| C30 | C35 | C34 | C33 | 0.4° | 0.0° |
| C35 | C30 | C31 | H3 | 179.1° | 179.7° |
| C30 | C35 | C34 | H4 | 179.6° | 180.0° |
| C35 | C30 | C27 | H6 | 161.3° | 154.7° |
| C31 | C32 | C33 | H2 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.2° | 0.3° |
| C31 | C32 | C33 | O36 | 179.5° | 180.0° |
| C35 | C34 | C33 | C32 | 0.2° | 0.3° |
| C35 | C34 | C33 | H4 | 180.0° | 180.0° |
| C35 | C34 | C33 | O36 | 179.5° | 180.0° |
| C32 | C33 | C34 | O36 | 179.3° | 179.7° |
| C32 | C33 | O36 | H1 | 180.0° | 90.0° |
| C33 | C32 | C31 | H3 | 179.6° | 180.0° |
| C32 | C33 | C34 | H4 | 179.8° | 179.7° |
| C34 | C33 | O36 | H1 | 0.6° | 90.2° |
| C34 | C33 | C32 | H2 | 179.8° | 179.7° |
| C33 | C34 | C35 | H5 | 179.6° | 180.0° |
| O36 | C33 | C32 | H2 | 0.5° | 0.0° |
| O36 | C33 | C34 | H4 | 0.5° | 0.0° |
| H2 | C32 | C31 | H3 | 0.4° | 0.0° |
| H4 | C34 | C35 | H5 | 0.4° | 0.0° |
| H6 | C27 | C26 | H10 | 62.6° | 175.0° |
| H6 | C27 | C26 | H11 | 179.1° | 64.9° |
| H7 | C29 | H8 | H9 | 120.0° | 120.0° |
| H10 | C26 | C25 | H12 | 160.5° | 180.0° |
| H10 | C26 | C25 | H13 | 81.0° | 60.0° |
| H11 | C26 | C25 | H12 | 81.1° | 59.9° |
| H11 | C26 | C25 | H13 | 37.3° | 179.9° |
| H12 | C25 | C24 | H14 | 170.3° | 179.9° |
| H12 | C25 | C24 | H15 | 50.0° | 60.0° |
| H13 | C25 | C24 | H14 | 71.2° | 60.0° |
| H13 | C25 | C24 | H15 | 168.5° | 180.0° |
| H14 | C24 | C21 | H16 | 89.9° | 175.0° |
| H15 | C24 | C21 | H16 | 149.9° | 65.0° |
| H16 | C21 | C22 | H17 | 67.2° | 179.9° |
| H16 | C21 | C22 | H18 | 172.8° | 60.1° |
| H16 | C21 | C22 | H19 | 52.8° | 60.0° |
| H16 | C21 | C20 | H20 | 66.2° | 179.3° |
| H17 | C22 | H18 | H19 | 120.0° | 119.9° |
| H20 | C20 | C19 | H30 | 166.9° | 4.2° |
| H20 | C20 | C19 | H31 | 45.0° | 125.7° |
| H21 | C23 | H22 | H23 | 120.0° | 120.0° |
| H24 | C15 | C14 | H26 | 66.6° | 58.0° |
| H24 | C15 | C14 | H27 | 52.4° | 60.9° |
| H25 | C15 | C14 | H26 | 53.0° | 178.9° |
| H25 | C15 | C14 | H27 | 172.0° | 60.0° |
| H26 | C14 | C13 | H28 | 55.8° | 48.3° |
| H26 | C14 | C13 | H29 | 65.3° | 167.7° |
| H27 | C14 | C13 | H28 | 174.8° | 70.5° |
| H27 | C14 | C13 | H29 | 53.7° | 48.8° |
| H30 | C19 | C18 | H32 | 8.3° | 23.3° |
| H30 | C19 | C18 | H33 | 130.2° | 146.7° |
| H31 | C19 | C18 | H32 | 113.7° | 98.2° |
| H31 | C19 | C18 | H33 | 8.2° | 25.1° |
| H32 | C18 | C17 | H34 | 150.0° | 43.0° |
| H33 | C18 | C17 | H34 | 28.0° | 166.4° |
| H35 | C11 | C10 | H36 | 168.5° | 174.5° |
| H37 | C3 | C2 | H39 | 69.7° | 49.7° |
| H38 | C3 | C2 | H39 | 49.5° | 70.8° |
| H39 | C2 | O9 | H40 | 61.1° | 59.7° |
| H41 | C5 | C6 | H43 | 150.7° | 49.5° |
| H42 | C5 | C6 | H43 | 32.5° | 169.9° |
| H43 | C6 | O8 | H44 | 60.6° | 59.5° |
