9RO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C7 | C1 | doub | 1.31Å | 1.33Å | |
| 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 | 1.42Å | |
| C23 | C16 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.56Å | 1.51Å | |
| C19 | C20 | sing | 1.55Å | 1.54Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C16 | C20 | sing | 1.52Å | 1.52Å | |
| C16 | C15 | sing | 1.51Å | 1.54Å | |
| O28 | C27 | sing | 1.43Å | 1.42Å | |
| C26 | C25 | sing | 1.53Å | 1.54Å | |
| C26 | C27 | sing | 1.53Å | 1.52Å | |
| C14 | C15 | sing | 1.54Å | 1.54Å | |
| C24 | C25 | sing | 1.53Å | 1.53Å | |
| C24 | C21 | sing | 1.53Å | 1.54Å | |
| C20 | C21 | sing | 1.53Å | 1.53Å | |
| C27 | C30 | sing | 1.51Å | 1.48Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C30 | C31 | doub | 1.38Å | 1.40Å | 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° | 120.6° |
| C7 | C1 | C2 | 122.6° | 120.7° |
| C1 | C7 | H45 | 120.0° | 120.0° |
| C1 | C7 | H46 | 120.0° | 120.0° |
| O8 | C6 | C1 | 110.2° | 109.7° |
| O8 | C6 | C5 | 108.0° | 109.6° |
| O8 | C6 | H43 | 109.5° | 109.6° |
| C6 | O8 | H44 | 109.5° | 114.0° |
| C6 | C1 | C2 | 115.3° | 118.7° |
| C1 | C6 | C5 | 112.5° | 108.7° |
| C1 | C6 | H43 | 108.5° | 109.6° |
| C1 | C2 | O9 | 108.2° | 109.6° |
| C1 | C2 | C3 | 108.6° | 108.6° |
| C1 | C2 | H39 | 108.8° | 109.7° |
| C6 | C5 | C4 | 115.6° | 108.6° |
| C6 | C5 | H41 | 107.9° | 109.6° |
| C6 | C5 | H42 | 107.9° | 109.8° |
| C5 | C6 | H43 | 108.0° | 109.7° |
| O9 | C2 | C3 | 112.7° | 109.6° |
| O9 | C2 | H39 | 109.8° | 109.6° |
| C2 | O9 | H40 | 109.5° | 114.0° |
| C2 | C3 | C4 | 112.4° | 108.6° |
| C2 | C3 | H37 | 108.7° | 109.6° |
| C2 | C3 | H38 | 108.7° | 109.8° |
| C3 | C2 | H39 | 108.6° | 109.6° |
| C5 | C4 | C3 | 120.3° | 118.9° |
| C5 | C4 | C10 | 122.9° | 120.6° |
| C4 | C5 | H41 | 107.9° | 109.6° |
| C4 | C5 | H42 | 107.9° | 109.6° |
| C3 | C4 | C10 | 116.7° | 120.5° |
| C4 | C3 | H37 | 108.7° | 109.6° |
| C4 | C3 | H38 | 108.7° | 109.7° |
| C4 | C10 | C11 | 125.8° | 120.0° |
| C4 | C10 | H36 | 117.1° | 120.0° |
| C10 | C11 | C12 | 123.2° | 120.0° |
| C10 | C11 | H35 | 118.4° | 120.0° |
| C11 | C10 | H36 | 117.1° | 120.0° |
| C11 | C12 | C17 | 123.6° | 122.4° |
| C11 | C12 | C13 | 126.4° | 122.4° |
| C12 | C11 | H35 | 118.4° | 120.0° |
| C17 | C12 | C13 | 109.9° | 115.2° |
| C12 | C17 | C18 | 120.2° | 116.7° |
| C12 | C17 | C16 | 107.6° | 105.5° |
| C12 | C17 | H34 | 107.0° | 111.1° |
| C12 | C13 | C14 | 105.7° | 110.7° |
| C12 | C13 | H28 | 110.4° | 109.2° |
| C12 | C13 | H29 | 110.4° | 109.2° |
| C17 | C18 | C19 | 103.7° | 102.7° |
| C18 | C17 | C16 | 108.1° | 101.2° |
| C17 | C18 | H32 | 110.9° | 110.7° |
| C17 | C18 | H33 | 110.9° | 110.8° |
| C18 | C17 | H34 | 106.6° | 110.7° |
| C18 | C19 | C20 | 103.9° | 106.3° |
| C18 | C19 | H30 | 110.9° | 110.1° |
| C18 | C19 | H31 | 110.9° | 110.1° |
| C19 | C18 | H32 | 110.9° | 110.8° |
| C19 | C18 | H33 | 110.9° | 110.8° |
| C29 | O28 | C27 | 112.6° | 113.9° |
| O28 | C29 | H7 | 109.5° | 109.4° |
| O28 | C29 | H8 | 109.5° | 109.5° |
| O28 | C29 | H9 | 109.4° | 109.5° |
| C23 | C16 | C17 | 113.7° | 108.6° |
| C23 | C16 | C20 | 111.1° | 109.3° |
| C23 | C16 | C15 | 108.7° | 109.3° |
| C16 | C23 | H21 | 109.5° | 109.4° |
| C16 | C23 | H22 | 109.5° | 109.5° |
| C16 | C23 | H23 | 109.4° | 109.5° |
| C17 | C16 | C20 | 96.8° | 103.2° |
| C17 | C16 | C15 | 107.7° | 107.6° |
| C16 | C17 | H34 | 106.8° | 110.9° |
| C19 | C20 | C16 | 104.9° | 105.2° |
| C19 | C20 | C21 | 119.1° | 110.3° |
| C19 | C20 | H20 | 105.8° | 110.3° |
| C20 | C19 | H30 | 110.8° | 110.1° |
| C20 | C19 | H31 | 110.9° | 110.1° |
| C13 | C14 | C15 | 113.4° | 111.8° |
| C13 | C14 | H26 | 108.5° | 109.0° |
| C13 | C14 | H27 | 108.5° | 109.0° |
| C14 | C13 | H28 | 110.4° | 109.2° |
| C14 | C13 | H29 | 110.4° | 109.2° |
| C20 | C16 | C15 | 118.4° | 118.4° |
| C16 | C20 | C21 | 114.3° | 110.3° |
| C16 | C20 | H20 | 106.0° | 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 | 114.3° | 109.4° |
| O28 | C27 | C30 | 105.1° | 109.5° |
| O28 | C27 | H6 | 109.8° | 109.5° |
| C25 | C26 | C27 | 112.0° | 109.5° |
| C26 | C25 | C24 | 116.1° | 109.5° |
| C25 | C26 | H10 | 108.8° | 109.4° |
| C25 | C26 | H11 | 108.8° | 109.4° |
| C26 | C25 | H12 | 107.8° | 109.5° |
| C26 | C25 | H13 | 107.8° | 109.4° |
| C26 | C27 | C30 | 110.0° | 109.5° |
| C26 | C27 | H6 | 108.4° | 109.5° |
| C27 | C26 | H10 | 108.9° | 109.5° |
| C27 | C26 | H11 | 108.8° | 109.5° |
| C14 | C15 | H24 | 109.1° | 109.9° |
| C14 | C15 | H25 | 109.1° | 109.9° |
| C15 | C14 | H26 | 108.5° | 109.0° |
| C15 | C14 | H27 | 108.5° | 109.0° |
| C25 | C24 | C21 | 114.8° | 109.5° |
| C24 | C25 | H12 | 107.8° | 109.5° |
| C24 | C25 | H13 | 107.8° | 109.4° |
| C25 | C24 | H14 | 108.1° | 109.5° |
| C25 | C24 | H15 | 108.1° | 109.5° |
| C24 | C21 | C20 | 116.6° | 109.5° |
| C24 | C21 | C22 | 116.0° | 109.5° |
| C21 | C24 | H14 | 108.1° | 109.5° |
| C21 | C24 | H15 | 108.1° | 109.5° |
| C24 | C21 | H16 | 106.2° | 109.5° |
| C20 | C21 | C22 | 104.7° | 109.5° |
| C20 | C21 | H16 | 106.3° | 109.5° |
| C21 | C20 | H20 | 105.9° | 110.3° |
| C27 | C30 | C31 | 121.5° | 120.0° |
| C27 | C30 | C35 | 117.6° | 120.0° |
| C30 | C27 | H6 | 109.0° | 109.5° |
| C22 | C21 | H16 | 106.4° | 109.5° |
| C21 | C22 | H17 | 109.5° | 109.5° |
| C21 | C22 | H18 | 109.4° | 109.5° |
| C21 | C22 | H19 | 109.5° | 109.4° |
| C31 | C30 | C35 | 120.9° | 120.1° |
| C30 | C31 | C32 | 119.7° | 120.0° |
| C30 | C31 | H3 | 120.1° | 119.9° |
| C30 | C35 | C34 | 119.2° | 120.1° |
| C30 | C35 | H5 | 120.4° | 119.9° |
| C31 | C32 | C33 | 119.6° | 120.0° |
| C31 | C32 | H2 | 120.2° | 120.0° |
| C32 | C31 | H3 | 120.1° | 120.0° |
| C35 | C34 | C33 | 120.9° | 119.9° |
| C35 | C34 | H4 | 119.5° | 120.0° |
| C34 | C35 | H5 | 120.4° | 120.0° |
| C32 | C33 | C34 | 119.7° | 119.9° |
| C32 | C33 | O36 | 121.9° | 120.1° |
| C33 | C32 | H2 | 120.2° | 120.0° |
| C34 | C33 | O36 | 118.5° | 120.0° |
| C33 | C34 | H4 | 119.6° | 120.1° |
| C33 | O36 | H1 | 109.5° | 114.1° |
| H7 | C29 | H8 | 109.5° | 109.5° |
| H7 | C29 | H9 | 109.5° | 109.4° |
| H8 | C29 | H9 | 109.5° | 109.5° |
| H10 | C26 | H11 | 109.4° | 109.5° |
| H12 | C25 | H13 | 109.5° | 109.4° |
| H14 | C24 | H15 | 109.5° | 109.4° |
| H17 | C22 | H18 | 109.5° | 109.5° |
| H17 | C22 | H19 | 109.5° | 109.5° |
| H18 | C22 | H19 | 109.5° | 109.5° |
| H21 | C23 | H22 | 109.5° | 109.4° |
| H21 | C23 | H23 | 109.5° | 109.5° |
| H22 | C23 | H23 | 109.5° | 109.4° |
| H24 | C15 | H25 | 109.5° | 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 | 109.5° | 109.7° |
| 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 | 7.6° | 4.9° |
| C7 | C1 | C6 | C2 | 179.8° | 179.8° |
| C7 | C1 | C6 | C5 | 128.2° | 124.7° |
| C7 | C1 | C2 | O9 | 118.8° | 115.6° |
| C7 | C1 | C2 | C3 | 118.5° | 124.7° |
| C7 | C1 | C2 | H39 | 0.5° | 4.9° |
| C7 | C1 | C6 | H43 | 112.3° | 115.5° |
| C1 | C7 | H45 | H46 | 180.0° | 179.9° |
| O8 | C6 | C1 | C5 | 120.6° | 119.8° |
| O8 | C6 | C1 | H43 | 119.9° | 120.4° |
| O8 | C6 | C1 | C2 | 172.6° | 175.3° |
| O8 | C6 | C5 | H43 | 118.4° | 120.4° |
| O8 | C6 | C5 | C4 | 154.0° | 169.4° |
| O8 | C6 | C5 | H41 | 33.1° | 70.9° |
| O8 | C6 | C5 | H42 | 85.1° | 49.6° |
| C1 | C6 | C5 | H43 | 119.7° | 119.8° |
| C6 | C1 | C2 | O9 | 61.0° | 64.2° |
| C6 | C1 | C2 | C3 | 61.7° | 55.5° |
| C1 | C6 | C5 | C4 | 32.2° | 49.5° |
| C6 | C1 | C2 | H39 | 179.8° | 175.4° |
| C1 | C6 | C5 | H41 | 88.7° | 169.2° |
| C1 | C6 | C5 | H42 | 153.1° | 70.3° |
| C1 | C6 | O8 | H44 | 180.0° | 60.8° |
| C6 | C1 | C7 | H45 | 179.8° | 0.1° |
| C6 | C1 | C7 | H46 | 0.2° | 180.0° |
| C2 | C1 | C6 | C5 | 52.0° | 55.6° |
| C1 | C2 | O9 | C3 | 120.2° | 119.1° |
| C1 | C2 | O9 | H39 | 118.7° | 120.5° |
| C1 | C2 | C3 | H39 | 118.2° | 119.9° |
| C1 | C2 | C3 | C4 | 51.0° | 49.4° |
| C1 | C2 | C3 | H37 | 171.5° | 70.3° |
| C1 | C2 | C3 | H38 | 69.4° | 169.3° |
| C1 | C2 | O9 | H40 | 180.0° | 60.9° |
| C2 | C1 | C6 | H43 | 67.5° | 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 | 26.6° | 55.0° |
| C6 | C5 | C4 | C10 | 156.2° | 124.7° |
| C6 | C5 | H41 | H42 | 117.2° | 120.6° |
| C5 | C6 | O8 | H44 | 56.8° | 180.0° |
| O9 | C2 | C3 | H39 | 121.8° | 120.4° |
| O9 | C2 | C3 | C4 | 69.0° | 70.3° |
| O9 | C2 | C3 | H37 | 51.5° | 170.0° |
| O9 | C2 | C3 | H38 | 170.6° | 49.6° |
| C2 | C3 | C4 | C5 | 36.5° | 55.0° |
| C2 | C3 | C4 | H37 | 120.4° | 119.7° |
| C2 | C3 | C4 | H38 | 120.4° | 120.0° |
| C2 | C3 | C4 | C10 | 146.1° | 124.8° |
| C2 | C3 | H37 | H38 | 118.6° | 120.5° |
| C3 | C2 | O9 | H40 | 59.8° | 180.0° |
| C5 | C4 | C3 | C10 | 177.4° | 179.8° |
| C5 | C4 | C10 | C11 | 0.4° | 5.9° |
| C5 | C4 | C10 | H36 | 179.7° | 174.1° |
| C5 | C4 | C3 | H37 | 157.0° | 64.7° |
| C5 | C4 | C3 | H38 | 83.9° | 175.0° |
| C4 | C5 | H41 | H42 | 117.2° | 120.4° |
| C4 | C5 | C6 | H43 | 87.6° | 70.3° |
| C3 | C4 | C10 | C11 | 177.0° | 173.9° |
| C3 | C4 | C10 | H36 | 3.0° | 6.1° |
| C4 | C3 | H37 | H38 | 118.7° | 120.4° |
| C4 | C3 | C2 | H39 | 169.2° | 169.3° |
| C3 | C4 | C5 | H41 | 94.3° | 174.7° |
| C3 | C4 | C5 | H42 | 147.5° | 64.9° |
| C4 | C10 | C11 | H36 | 180.0° | 180.0° |
| C4 | C10 | C11 | C12 | 167.7° | 174.6° |
| C4 | C10 | C11 | H35 | 12.4° | 5.3° |
| C10 | C4 | C3 | H37 | 25.7° | 115.6° |
| C10 | C4 | C3 | H38 | 93.5° | 4.8° |
| C10 | C4 | C5 | H41 | 82.9° | 5.0° |
| C10 | C4 | C5 | H42 | 35.3° | 115.4° |
| C10 | C11 | C12 | H35 | 180.0° | 180.0° |
| C10 | C11 | C12 | C17 | 177.4° | 180.0° |
| C10 | C11 | C12 | C13 | 1.2° | 0.1° |
| C11 | C12 | C17 | C13 | 178.8° | 179.9° |
| C11 | C12 | C17 | C18 | 16.4° | 10.4° |
| C11 | C12 | C17 | C16 | 107.7° | 121.9° |
| C11 | C12 | C13 | C14 | 115.4° | 129.8° |
| C11 | C12 | C13 | H28 | 125.2° | 9.5° |
| C11 | C12 | C13 | H29 | 4.0° | 109.9° |
| C11 | C12 | C17 | H34 | 137.9° | 117.9° |
| C12 | C11 | C10 | H36 | 12.3° | 5.4° |
| C12 | C17 | C18 | C16 | 123.8° | 114.0° |
| C12 | C17 | C18 | H34 | 121.7° | 128.4° |
| C12 | C17 | C18 | C19 | 145.4° | 156.2° |
| C12 | C17 | C16 | C23 | 56.3° | 51.7° |
| C12 | C17 | C16 | H34 | 114.6° | 120.4° |
| C17 | C12 | C13 | C14 | 63.4° | 50.2° |
| C12 | C17 | C16 | C20 | 172.9° | 167.6° |
| C12 | C17 | C16 | C15 | 64.4° | 66.5° |
| C17 | C12 | C13 | H28 | 56.0° | 170.5° |
| C17 | C12 | C13 | H29 | 177.2° | 70.1° |
| C12 | C17 | C18 | H32 | 26.3° | 85.4° |
| C12 | C17 | C18 | H33 | 95.5° | 37.9° |
| C17 | C12 | C11 | H35 | 2.6° | 0.0° |
| C13 | C12 | C17 | C18 | 164.8° | 169.7° |
| C13 | C12 | C17 | C16 | 71.1° | 58.2° |
| C12 | C13 | C14 | H28 | 119.4° | 120.3° |
| C12 | C13 | C14 | H29 | 119.4° | 120.3° |
| C12 | C13 | C14 | C15 | 54.0° | 48.6° |
| C12 | C13 | C14 | H26 | 174.6° | 72.0° |
| C12 | C13 | C14 | H27 | 66.6° | 169.1° |
| C12 | C13 | H28 | H29 | 121.8° | 119.4° |
| C13 | C12 | C17 | H34 | 43.2° | 62.1° |
| C13 | C12 | C11 | H35 | 178.8° | 180.0° |
| C17 | C18 | C19 | H32 | 119.1° | 118.3° |
| C17 | C18 | C19 | H33 | 119.0° | 118.3° |
| C18 | C17 | C16 | C23 | 74.9° | 70.4° |
| C18 | C17 | C16 | H34 | 114.3° | 117.5° |
| C17 | C18 | C19 | C20 | 8.3° | 24.2° |
| C18 | C17 | C16 | C20 | 41.8° | 45.5° |
| C18 | C17 | C16 | C15 | 164.5° | 171.4° |
| C17 | C18 | C19 | H30 | 110.8° | 95.0° |
| C17 | C18 | C19 | H31 | 127.5° | 143.4° |
| C17 | C18 | H32 | H33 | 122.7° | 123.3° |
| C19 | C18 | C17 | C16 | 21.6° | 42.2° |
| C18 | C19 | C20 | H30 | 119.1° | 119.2° |
| C18 | C19 | C20 | H31 | 119.1° | 119.3° |
| C18 | C19 | C20 | C16 | 35.4° | 3.9° |
| C18 | C19 | C20 | C21 | 164.7° | 122.9° |
| C18 | C19 | C20 | H20 | 76.4° | 115.0° |
| C18 | C19 | H30 | H31 | 122.6° | 121.6° |
| C19 | C18 | H32 | H33 | 122.7° | 123.4° |
| C19 | C18 | C17 | H34 | 92.8° | 75.4° |
| C29 | O28 | C27 | C26 | 11.2° | 154.6° |
| C29 | O28 | C27 | C30 | 132.0° | 85.4° |
| C29 | O28 | C27 | H6 | 110.9° | 34.6° |
| O28 | C29 | H7 | H8 | 120.0° | 120.0° |
| O28 | C29 | H7 | H9 | 120.0° | 120.0° |
| O28 | C29 | H8 | H9 | 120.0° | 120.1° |
| C23 | C16 | C17 | C20 | 116.7° | 115.9° |
| C23 | C16 | C17 | C15 | 120.6° | 118.2° |
| C23 | C16 | C20 | C19 | 72.2° | 85.2° |
| C23 | C16 | C20 | C15 | 126.8° | 126.0° |
| C23 | C16 | C15 | C14 | 68.5° | 49.7° |
| C23 | C16 | C20 | C21 | 60.0° | 33.7° |
| C23 | C16 | C20 | H20 | 176.2° | 155.8° |
| C16 | C23 | H21 | H22 | 120.0° | 120.0° |
| C16 | C23 | H21 | H23 | 120.0° | 120.1° |
| C16 | C23 | H22 | H23 | 120.0° | 120.1° |
| C23 | C16 | C15 | H24 | 51.7° | 69.9° |
| C23 | C16 | C15 | H25 | 171.3° | 169.3° |
| C23 | C16 | C17 | H34 | 170.8° | 172.1° |
| C17 | C16 | C20 | C19 | 46.6° | 30.2° |
| C17 | C16 | C20 | C15 | 114.4° | 118.6° |
| C17 | C16 | C15 | C14 | 55.2° | 68.0° |
| C17 | C16 | C20 | C21 | 178.7° | 149.1° |
| C17 | C16 | C20 | H20 | 65.1° | 88.8° |
| C17 | C16 | C23 | H21 | 180.0° | 179.9° |
| C17 | C16 | C23 | H22 | 60.0° | 60.0° |
| C17 | C16 | C23 | H23 | 60.0° | 60.0° |
| C17 | C16 | C15 | H24 | 175.4° | 172.4° |
| C17 | C16 | C15 | H25 | 65.0° | 51.6° |
| C16 | C17 | C18 | H32 | 97.5° | 160.6° |
| C16 | C17 | C18 | H33 | 140.6° | 76.1° |
| C19 | C20 | C16 | C21 | 132.2° | 119.0° |
| C19 | C20 | C16 | H20 | 111.6° | 118.9° |
| C19 | C20 | C16 | C15 | 161.0° | 148.8° |
| C19 | C20 | C21 | C24 | 42.5° | 62.8° |
| C19 | C20 | C21 | H20 | 118.8° | 122.2° |
| C19 | C20 | C21 | C22 | 87.1° | 177.2° |
| C19 | C20 | C21 | H16 | 160.5° | 57.2° |
| C20 | C19 | H30 | H31 | 122.6° | 121.5° |
| C20 | C19 | C18 | H32 | 127.4° | 142.4° |
| C20 | C19 | C18 | H33 | 110.7° | 94.2° |
| C13 | C14 | C15 | C16 | 52.1° | 59.1° |
| C13 | C14 | C15 | H26 | 120.6° | 120.5° |
| C13 | C14 | C15 | H27 | 120.6° | 120.6° |
| C13 | C14 | C15 | H24 | 172.3° | 178.5° |
| C13 | C14 | C15 | H25 | 68.1° | 60.5° |
| C13 | C14 | H26 | H27 | 118.2° | 118.9° |
| C14 | C13 | H28 | H29 | 121.8° | 119.4° |
| C20 | C16 | C15 | C14 | 163.5° | 175.6° |
| C16 | C20 | C21 | C24 | 82.5° | 178.6° |
| C16 | C20 | C21 | H20 | 116.2° | 122.1° |
| C16 | C20 | C21 | C22 | 147.9° | 61.4° |
| C16 | C20 | C21 | H16 | 35.6° | 58.6° |
| C20 | C16 | C23 | H21 | 72.0° | 68.2° |
| C20 | C16 | C23 | H22 | 168.0° | 171.9° |
| C20 | C16 | C23 | H23 | 48.0° | 51.9° |
| C20 | C16 | C15 | H24 | 76.3° | 56.1° |
| C20 | C16 | C15 | H25 | 43.3° | 64.7° |
| C16 | C20 | C19 | H30 | 83.8° | 123.1° |
| C16 | C20 | C19 | H31 | 154.5° | 115.3° |
| C20 | C16 | C17 | H34 | 72.5° | 72.0° |
| C16 | C15 | C14 | H24 | 120.2° | 119.5° |
| C16 | C15 | C14 | H25 | 120.2° | 119.6° |
| C15 | C16 | C20 | C21 | 66.9° | 92.2° |
| C15 | C16 | C20 | H20 | 49.3° | 29.9° |
| C15 | C16 | C23 | H21 | 60.0° | 62.8° |
| C15 | C16 | C23 | H22 | 60.1° | 57.1° |
| C15 | C16 | C23 | H23 | 180.0° | 177.1° |
| C16 | C15 | H24 | H25 | 119.4° | 120.8° |
| C16 | C15 | C14 | H26 | 172.7° | 61.5° |
| C16 | C15 | C14 | H27 | 68.5° | 179.6° |
| C15 | C16 | C17 | H34 | 50.2° | 53.9° |
| O28 | C27 | C26 | C25 | 165.7° | 65.1° |
| O28 | C27 | C26 | C30 | 118.0° | 120.0° |
| O28 | C27 | C26 | H6 | 122.9° | 120.0° |
| O28 | C27 | C30 | H6 | 117.7° | 120.0° |
| O28 | C27 | C30 | C31 | 94.8° | 140.1° |
| O28 | C27 | C30 | C35 | 84.6° | 40.2° |
| C27 | O28 | C29 | H7 | 180.0° | 175.0° |
| C27 | O28 | C29 | H8 | 60.0° | 55.1° |
| C27 | O28 | C29 | H9 | 60.0° | 65.0° |
| O28 | C27 | C26 | H10 | 45.3° | 174.9° |
| O28 | C27 | C26 | H11 | 73.9° | 54.8° |
| C25 | C26 | C27 | H10 | 120.4° | 120.0° |
| C25 | C26 | C27 | H11 | 120.4° | 120.0° |
| C26 | C25 | C24 | H12 | 121.0° | 120.1° |
| C26 | C25 | C24 | H13 | 121.0° | 120.0° |
| C26 | C25 | C24 | C21 | 158.4° | 180.0° |
| C25 | C26 | C27 | C30 | 76.3° | 174.9° |
| C25 | C26 | C27 | H6 | 42.8° | 54.9° |
| C25 | C26 | H10 | H11 | 118.8° | 119.9° |
| C26 | C25 | H12 | H13 | 117.0° | 119.9° |
| C26 | C25 | C24 | H14 | 80.8° | 60.0° |
| C26 | C25 | C24 | H15 | 37.7° | 60.0° |
| C27 | C26 | C25 | C24 | 85.2° | 175.0° |
| C26 | C27 | C30 | H6 | 118.8° | 120.0° |
| C26 | C27 | C30 | C31 | 28.7° | 100.0° |
| C26 | C27 | C30 | C35 | 151.9° | 79.7° |
| C27 | C26 | H10 | H11 | 118.9° | 120.1° |
| C27 | C26 | C25 | H12 | 35.8° | 64.9° |
| C27 | C26 | C25 | H13 | 153.8° | 55.0° |
| C14 | C15 | H24 | H25 | 119.3° | 121.0° |
| C15 | C14 | H26 | H27 | 118.2° | 118.9° |
| C15 | C14 | C13 | H28 | 65.4° | 168.9° |
| C15 | C14 | C13 | H29 | 173.4° | 71.7° |
| C25 | C24 | C21 | H14 | 120.8° | 120.0° |
| C25 | C24 | C21 | H15 | 120.8° | 120.0° |
| C25 | C24 | C21 | C20 | 138.8° | 175.0° |
| C25 | C24 | C21 | C22 | 14.8° | 65.0° |
| C24 | C25 | C26 | H10 | 35.2° | 55.0° |
| C24 | C25 | C26 | H11 | 154.4° | 65.0° |
| C24 | C25 | H12 | H13 | 117.0° | 120.0° |
| C25 | C24 | H14 | H15 | 117.6° | 120.0° |
| C25 | C24 | C21 | H16 | 103.1° | 55.0° |
| C24 | C21 | C20 | C22 | 129.6° | 120.0° |
| C24 | C21 | C20 | H16 | 118.1° | 120.0° |
| C24 | C21 | C22 | H16 | 117.8° | 120.0° |
| C21 | C24 | C25 | H12 | 37.5° | 60.0° |
| C21 | C24 | C25 | H13 | 80.6° | 60.0° |
| C21 | C24 | H14 | H15 | 117.5° | 120.0° |
| C24 | C21 | C22 | H17 | 180.0° | 60.0° |
| C24 | C21 | C22 | H18 | 60.0° | 180.0° |
| C24 | C21 | C22 | H19 | 60.0° | 60.0° |
| C24 | C21 | C20 | H20 | 161.3° | 59.3° |
| C20 | C21 | C22 | H16 | 112.3° | 120.0° |
| C20 | C21 | C24 | H14 | 18.0° | 65.0° |
| C20 | C21 | C24 | H15 | 100.4° | 55.0° |
| C20 | C21 | C22 | H17 | 50.0° | 60.0° |
| C20 | C21 | C22 | H18 | 170.0° | 60.0° |
| C20 | C21 | C22 | H19 | 70.0° | 180.0° |
| C21 | C20 | C19 | H30 | 45.6° | 117.9° |
| C21 | C20 | C19 | H31 | 76.2° | 3.6° |
| C27 | C30 | C31 | C35 | 179.4° | 179.7° |
| C27 | C30 | C31 | C32 | 179.8° | 180.0° |
| C27 | C30 | C35 | C34 | 179.7° | 180.0° |
| C27 | C30 | C31 | H3 | 0.2° | 0.1° |
| C27 | C30 | C35 | H5 | 0.3° | 0.0° |
| C30 | C27 | C26 | H10 | 163.3° | 54.9° |
| C30 | C27 | C26 | H11 | 44.0° | 65.1° |
| C22 | C21 | C24 | H14 | 106.0° | 55.0° |
| C22 | C21 | C24 | H15 | 135.6° | 175.0° |
| C21 | C22 | H17 | H18 | 120.0° | 120.0° |
| C21 | C22 | H17 | H19 | 120.0° | 120.0° |
| C21 | C22 | H18 | H19 | 120.0° | 120.0° |
| C22 | C21 | C20 | H20 | 31.7° | 60.7° |
| C30 | C31 | C32 | H3 | 180.0° | 179.9° |
| C31 | C30 | C35 | C34 | 0.9° | 0.3° |
| C30 | C31 | C32 | C33 | 0.3° | 0.1° |
| C30 | C31 | C32 | H2 | 179.7° | 179.9° |
| C31 | C30 | C35 | H5 | 179.1° | 179.7° |
| C31 | C30 | C27 | H6 | 147.5° | 20.0° |
| C35 | C30 | C31 | C32 | 0.9° | 0.3° |
| C30 | C35 | C34 | H5 | 180.0° | 180.0° |
| C30 | C35 | C34 | C33 | 0.4° | 0.1° |
| C35 | C30 | C31 | H3 | 179.2° | 179.8° |
| C30 | C35 | C34 | H4 | 179.6° | 180.0° |
| C35 | C30 | C27 | H6 | 33.1° | 160.3° |
| C31 | C32 | C33 | H2 | 180.0° | 180.0° |
| C31 | C32 | C33 | C34 | 0.3° | 0.2° |
| C31 | C32 | C33 | O36 | 179.4° | 180.0° |
| C35 | C34 | C33 | C32 | 0.2° | 0.2° |
| C35 | C34 | C33 | H4 | 180.0° | 180.0° |
| C35 | C34 | C33 | O36 | 179.4° | 179.9° |
| C32 | C33 | C34 | O36 | 179.2° | 179.8° |
| C32 | C33 | O36 | H1 | 180.0° | 90.0° |
| C33 | C32 | C31 | H3 | 179.8° | 180.0° |
| C32 | C33 | C34 | H4 | 179.8° | 179.7° |
| C34 | C33 | O36 | H1 | 0.9° | 90.2° |
| C34 | C33 | C32 | H2 | 179.7° | 179.8° |
| C33 | C34 | C35 | H5 | 179.6° | 179.9° |
| O36 | C33 | C32 | H2 | 0.6° | 0.0° |
| O36 | C33 | C34 | H4 | 0.6° | 0.1° |
| H2 | C32 | C31 | H3 | 0.2° | 0.0° |
| H4 | C34 | C35 | H5 | 0.3° | 0.0° |
| H6 | C27 | C26 | H10 | 77.6° | 65.1° |
| H6 | C27 | C26 | H11 | 163.2° | 174.9° |
| H7 | C29 | H8 | H9 | 120.0° | 120.0° |
| H10 | C26 | C25 | H12 | 156.2° | 175.0° |
| H10 | C26 | C25 | H13 | 85.8° | 65.0° |
| H11 | C26 | C25 | H12 | 84.6° | 55.1° |
| H11 | C26 | C25 | H13 | 33.4° | 175.0° |
| H12 | C25 | C24 | H14 | 158.3° | 180.0° |
| H12 | C25 | C24 | H15 | 83.3° | 60.0° |
| H13 | C25 | C24 | H14 | 40.2° | 60.0° |
| H13 | C25 | C24 | H15 | 158.6° | 180.0° |
| H14 | C24 | C21 | H16 | 136.1° | 175.0° |
| H15 | C24 | C21 | H16 | 17.7° | 65.0° |
| H16 | C21 | C22 | H17 | 62.2° | 180.0° |
| H16 | C21 | C22 | H18 | 57.8° | 60.0° |
| H16 | C21 | C22 | H19 | 177.7° | 60.0° |
| H16 | C21 | C20 | H20 | 80.7° | 179.4° |
| H17 | C22 | H18 | H19 | 120.0° | 120.0° |
| H20 | C20 | C19 | H30 | 164.5° | 4.2° |
| H20 | C20 | C19 | H31 | 42.7° | 125.7° |
| H21 | C23 | H22 | H23 | 120.0° | 120.0° |
| H24 | C15 | C14 | H26 | 67.1° | 58.0° |
| H24 | C15 | C14 | H27 | 51.7° | 60.9° |
| H25 | C15 | C14 | H26 | 52.5° | 178.9° |
| H25 | C15 | C14 | H27 | 171.3° | 60.1° |
| H26 | C14 | C13 | H28 | 55.2° | 48.3° |
| H26 | C14 | C13 | H29 | 66.0° | 167.7° |
| H27 | C14 | C13 | H28 | 174.0° | 70.6° |
| H27 | C14 | C13 | H29 | 52.8° | 48.8° |
| H30 | C19 | C18 | H32 | 8.3° | 23.3° |
| H30 | C19 | C18 | H33 | 130.2° | 146.6° |
| H31 | C19 | C18 | H32 | 113.4° | 98.3° |
| H31 | C19 | C18 | H33 | 8.4° | 25.1° |
| H32 | C18 | C17 | H34 | 148.1° | 43.0° |
| H33 | C18 | C17 | H34 | 26.2° | 166.3° |
| H35 | C11 | C10 | H36 | 167.7° | 174.7° |
| H37 | C3 | C2 | H39 | 70.4° | 49.6° |
| H38 | C3 | C2 | H39 | 48.8° | 70.8° |
| H39 | C2 | O9 | H40 | 61.3° | 59.6° |
| H41 | C5 | C6 | H43 | 151.5° | 49.4° |
| H42 | C5 | C6 | H43 | 33.3° | 169.9° |
| H43 | C6 | O8 | H44 | 60.7° | 59.6° |
