LO3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | sing | 1.35Å | 1.38Å | |
| C1 | C2 | sing | 1.42Å | 1.38Å | |
| C1 | O2 | doub | 1.22Å | 1.23Å | |
| O1 | C21 | sing | 1.44Å | 1.42Å | |
| C2 | C3 | doub | 1.34Å | 1.26Å | |
| C2 | H2 | sing | 1.09Å | 1.08Å | |
| C3 | C4 | sing | 1.46Å | 1.41Å | |
| C3 | H3 | sing | 1.09Å | 1.08Å | |
| O3 | C6 | sing | 1.43Å | 1.35Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C4 | C5 | doub | 1.33Å | 1.35Å | |
| C4 | C32 | sing | 1.51Å | 1.47Å | |
| O4 | C7 | sing | 1.43Å | 1.39Å | |
| O4 | C33 | sing | 1.43Å | 1.34Å | |
| C5 | C6 | sing | 1.51Å | 1.45Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| O5 | C9 | sing | 1.42Å | 1.48Å | |
| O5 | C13 | sing | 1.41Å | 1.52Å | |
| C6 | C7 | sing | 1.54Å | 1.42Å | |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| O6 | C15 | sing | 1.43Å | 1.42Å | |
| O6 | C34 | sing | 1.43Å | 1.50Å | |
| C7 | C8 | sing | 1.52Å | 1.44Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| O7 | C17 | sing | 1.42Å | 1.47Å | |
| O7 | C36 | sing | 1.43Å | 1.44Å | |
| C8 | C9 | sing | 1.53Å | 1.40Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| O8 | C19 | sing | 1.43Å | 1.45Å | |
| O8 | C37 | sing | 1.43Å | 1.46Å | |
| C9 | C10 | sing | 1.52Å | 1.48Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| O9 | C23 | sing | 1.43Å | 1.41Å | |
| O9 | HO9 | sing | 0.97Å | 0.95Å | |
| C10 | C11 | doub | 1.33Å | 1.36Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| O10 | C27 | sing | 1.43Å | 1.39Å | |
| O10 | C31 | sing | 1.43Å | 1.43Å | |
| C11 | C12 | sing | 1.51Å | 1.50Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| O11 | C29 | sing | 1.43Å | 1.49Å | |
| O11 | C41 | sing | 1.43Å | 1.46Å | |
| C12 | C13 | sing | 1.52Å | 1.53Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.54Å | 1.43Å | |
| C13 | H13 | sing | 1.10Å | 1.10Å | |
| O13 | C16 | sing | 1.43Å | 1.48Å | |
| O13 | C35 | sing | 1.43Å | 1.81Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C15 | C16 | sing | 1.53Å | 1.61Å | |
| C15 | H15 | sing | 1.10Å | 1.10Å | |
| C16 | C17 | sing | 1.53Å | 1.46Å | |
| C16 | C35 | sing | 1.53Å | 1.61Å | |
| C17 | C18 | sing | 1.53Å | 1.44Å | |
| C17 | H17 | sing | 1.10Å | 1.10Å | |
| C18 | C19 | sing | 1.52Å | 1.49Å | |
| C18 | H18 | sing | 1.08Å | 1.10Å | |
| C18 | H18A | sing | 1.10Å | 1.10Å | |
| C19 | C20 | sing | 1.52Å | 1.48Å | |
| C19 | H19 | sing | 1.11Å | 1.10Å | |
| C20 | C21 | sing | 1.53Å | 1.55Å | |
| C20 | C38 | sing | 1.53Å | 1.58Å | |
| C20 | H20 | sing | 1.11Å | 1.10Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | C23 | sing | 1.53Å | 1.49Å | |
| C22 | C39 | sing | 1.53Å | 1.48Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | C25 | sing | 1.53Å | 1.56Å | |
| C24 | C40 | sing | 1.53Å | 1.63Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | C26 | sing | 1.53Å | 1.37Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | C27 | sing | 1.53Å | 1.59Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | C28 | sing | 1.53Å | 1.55Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | C29 | sing | 1.53Å | 1.42Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C29 | C30 | sing | 1.53Å | 1.42Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C30 | C31 | sing | 1.53Å | 1.52Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C31 | C42 | sing | 1.53Å | 1.53Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C32 | H32B | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.09Å | 1.10Å | |
| C33 | H33A | sing | 1.09Å | 1.10Å | |
| C33 | H33B | sing | 1.09Å | 1.10Å | |
| C34 | H34 | sing | 1.09Å | 1.10Å | |
| C34 | H34A | sing | 1.09Å | 1.10Å | |
| C34 | H34B | sing | 1.09Å | 1.10Å | |
| C35 | H35 | sing | 1.09Å | 1.10Å | |
| C35 | H35A | sing | 1.09Å | 1.10Å | |
| C36 | H36 | sing | 1.09Å | 1.10Å | |
| C36 | H36A | sing | 1.09Å | 1.10Å | |
| C36 | H36B | sing | 1.09Å | 1.10Å | |
| C37 | H37 | sing | 1.09Å | 1.10Å | |
| C37 | H37A | sing | 1.09Å | 1.10Å | |
| C37 | H37B | sing | 1.09Å | 1.10Å | |
| C38 | H38 | sing | 1.09Å | 1.10Å | |
| C38 | H38A | sing | 1.09Å | 1.10Å | |
| C38 | H38B | sing | 1.09Å | 1.10Å | |
| C39 | H39 | sing | 1.09Å | 1.10Å | |
| C39 | H39A | sing | 1.09Å | 1.10Å | |
| C39 | H39B | sing | 1.09Å | 1.10Å | |
| C40 | H40 | sing | 1.09Å | 1.10Å | |
| C40 | H40A | sing | 1.09Å | 1.10Å | |
| C40 | H40B | sing | 1.09Å | 1.10Å | |
| C41 | H41 | sing | 1.09Å | 1.10Å | |
| C41 | H41A | sing | 1.09Å | 1.10Å | |
| C41 | H41B | sing | 1.09Å | 1.10Å | |
| C42 | H42 | sing | 1.09Å | 1.10Å | |
| C42 | H42A | sing | 1.09Å | 1.10Å | |
| C42 | H42B | sing | 1.09Å | 1.10Å | |
| C25 | H69 | sing | 1.09Å | 1.10Å | |
| C26 | H70 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 116.1° | 118.6° |
| O1 | C1 | O2 | 127.0° | 121.0° |
| C1 | O1 | C21 | 119.5° | 116.9° |
| C2 | C1 | O2 | 116.9° | 120.4° |
| C1 | C2 | C3 | 128.1° | 124.6° |
| C1 | C2 | H2 | 116.0° | 116.0° |
| O1 | C21 | C20 | 108.0° | 110.0° |
| O1 | C21 | C22 | 109.8° | 109.1° |
| O1 | C21 | H21 | 112.5° | 108.5° |
| C3 | C2 | H2 | 116.0° | 119.4° |
| C2 | C3 | C4 | 150.7° | 120.5° |
| C2 | C3 | H3 | 104.7° | 120.4° |
| C4 | C3 | H3 | 104.6° | 119.2° |
| C3 | C4 | C5 | 138.7° | 120.4° |
| C3 | C4 | C32 | 109.8° | 119.5° |
| C6 | O3 | HO3 | 109.5° | 114.0° |
| O3 | C6 | C5 | 101.2° | 108.9° |
| O3 | C6 | C7 | 121.2° | 109.8° |
| O3 | C6 | H6 | 113.2° | 109.2° |
| C5 | C4 | C32 | 111.5° | 120.0° |
| C4 | C5 | C6 | 144.6° | 122.1° |
| C4 | C5 | H5 | 107.7° | 119.0° |
| C4 | C32 | H32 | 109.5° | 109.4° |
| C4 | C32 | H32A | 109.5° | 109.4° |
| C4 | C32 | H32B | 109.5° | 109.5° |
| C7 | O4 | C33 | 126.3° | 114.0° |
| O4 | C7 | C6 | 99.9° | 108.6° |
| O4 | C7 | C8 | 111.2° | 109.2° |
| O4 | C7 | H7 | 118.0° | 108.7° |
| O4 | C33 | H33 | 109.5° | 109.5° |
| O4 | C33 | H33A | 109.5° | 109.5° |
| O4 | C33 | H33B | 109.4° | 109.4° |
| C6 | C5 | H5 | 107.7° | 118.9° |
| C5 | C6 | C7 | 121.3° | 107.0° |
| C5 | C6 | H6 | 113.0° | 111.4° |
| C9 | O5 | C13 | 115.1° | 116.2° |
| O5 | C9 | C8 | 121.1° | 110.6° |
| O5 | C9 | C10 | 111.4° | 109.9° |
| O5 | C9 | H9 | 100.6° | 110.1° |
| O5 | C13 | C12 | 106.5° | 110.7° |
| O5 | C13 | C14 | 105.4° | 110.3° |
| O5 | C13 | H13 | 118.3° | 109.9° |
| C7 | C6 | H6 | 87.1° | 110.5° |
| C6 | C7 | C8 | 118.1° | 112.3° |
| C6 | C7 | H7 | 111.0° | 109.2° |
| C15 | O6 | C34 | 113.5° | 114.0° |
| O6 | C15 | C14 | 119.5° | 110.0° |
| O6 | C15 | C16 | 108.0° | 110.2° |
| O6 | C15 | H15 | 106.3° | 108.4° |
| O6 | C34 | H34 | 109.5° | 109.4° |
| O6 | C34 | H34A | 109.5° | 109.5° |
| O6 | C34 | H34B | 109.5° | 109.5° |
| C8 | C7 | H7 | 99.7° | 108.8° |
| C7 | C8 | C9 | 111.8° | 109.8° |
| C7 | C8 | H8 | 108.7° | 109.5° |
| C7 | C8 | H8A | 108.7° | 110.4° |
| C17 | O7 | C36 | 120.0° | 114.0° |
| O7 | C17 | C16 | 115.7° | 110.1° |
| O7 | C17 | C18 | 110.3° | 111.6° |
| O7 | C17 | H17 | 109.1° | 108.5° |
| O7 | C36 | H36 | 109.5° | 109.5° |
| O7 | C36 | H36A | 109.5° | 109.5° |
| O7 | C36 | H36B | 109.4° | 109.5° |
| C9 | C8 | H8 | 108.7° | 109.1° |
| C9 | C8 | H8A | 108.7° | 108.7° |
| C8 | C9 | C10 | 114.1° | 108.6° |
| C8 | C9 | H9 | 96.6° | 109.2° |
| H8 | C8 | H8A | 110.2° | 109.2° |
| C19 | O8 | C37 | 129.6° | 114.0° |
| O8 | C19 | C18 | 110.2° | 110.0° |
| O8 | C19 | C20 | 110.9° | 112.2° |
| O8 | C19 | H19 | 115.5° | 107.0° |
| O8 | C37 | H37 | 109.5° | 109.5° |
| O8 | C37 | H37A | 109.5° | 109.5° |
| O8 | C37 | H37B | 109.5° | 109.5° |
| C10 | C9 | H9 | 110.5° | 108.3° |
| C9 | C10 | C11 | 121.8° | 113.8° |
| C9 | C10 | H10 | 119.1° | 123.0° |
| C23 | O9 | HO9 | 109.5° | 114.1° |
| O9 | C23 | C22 | 113.4° | 109.5° |
| O9 | C23 | C24 | 110.8° | 109.5° |
| O9 | C23 | H23 | 111.5° | 109.5° |
| C11 | C10 | H10 | 119.1° | 123.2° |
| C10 | C11 | C12 | 123.3° | 115.1° |
| C10 | C11 | H11 | 118.4° | 122.4° |
| C27 | O10 | C31 | 122.3° | 114.1° |
| O10 | C27 | C26 | 102.3° | 109.5° |
| O10 | C27 | C28 | 108.8° | 109.4° |
| O10 | C27 | H27 | 117.3° | 109.5° |
| O10 | C31 | C30 | 110.0° | 109.4° |
| O10 | C31 | C42 | 107.6° | 109.5° |
| O10 | C31 | H31 | 110.7° | 109.5° |
| C12 | C11 | H11 | 118.4° | 122.5° |
| C11 | C12 | C13 | 111.9° | 111.0° |
| C11 | C12 | H12 | 108.7° | 109.2° |
| C11 | C12 | H12A | 108.6° | 109.3° |
| C29 | O11 | C41 | 128.8° | 114.0° |
| O11 | C29 | C28 | 116.4° | 109.5° |
| O11 | C29 | C30 | 111.0° | 109.6° |
| O11 | C29 | H29 | 111.0° | 109.5° |
| O11 | C41 | H41 | 109.5° | 109.5° |
| O11 | C41 | H41A | 109.5° | 109.5° |
| O11 | C41 | H41B | 109.5° | 109.5° |
| C13 | C12 | H12 | 108.7° | 109.3° |
| C13 | C12 | H12A | 108.6° | 109.1° |
| C12 | C13 | C14 | 119.9° | 109.1° |
| C12 | C13 | H13 | 103.2° | 108.7° |
| H12 | C12 | H12A | 110.3° | 108.9° |
| C14 | C13 | H13 | 104.4° | 108.1° |
| C13 | C14 | C15 | 123.9° | 109.9° |
| C13 | C14 | H14 | 104.9° | 109.0° |
| C13 | C14 | H14A | 105.0° | 109.0° |
| C16 | O13 | C35 | 57.6° | 64.7° |
| O13 | C16 | C15 | 112.9° | 117.2° |
| O13 | C16 | C17 | 113.7° | 116.7° |
| O13 | C16 | C35 | 71.4° | 57.5° |
| O13 | C35 | C16 | 51.0° | 57.8° |
| O13 | C35 | H35 | 136.4° | 118.1° |
| O13 | C35 | H35A | 136.3° | 117.3° |
| C15 | C14 | H14 | 105.0° | 109.5° |
| C15 | C14 | H14A | 104.9° | 110.2° |
| C14 | C15 | C16 | 116.7° | 111.1° |
| C14 | C15 | H15 | 94.7° | 108.7° |
| H14 | C14 | H14A | 113.6° | 109.2° |
| C16 | C15 | H15 | 110.0° | 108.4° |
| C15 | C16 | C17 | 114.7° | 117.1° |
| C15 | C16 | C35 | 117.2° | 117.8° |
| C17 | C16 | C35 | 119.4° | 117.2° |
| C16 | C17 | C18 | 119.7° | 109.9° |
| C16 | C17 | H17 | 96.2° | 107.9° |
| C16 | C35 | H35 | 136.4° | 117.9° |
| C16 | C35 | H35A | 136.3° | 117.6° |
| C18 | C17 | H17 | 103.6° | 108.7° |
| C17 | C18 | C19 | 121.0° | 112.0° |
| C17 | C18 | H18 | 105.8° | 111.1° |
| C17 | C18 | H18A | 105.8° | 107.6° |
| C19 | C18 | H18 | 105.8° | 112.3° |
| C19 | C18 | H18A | 105.8° | 108.1° |
| C18 | C19 | C20 | 123.9° | 112.4° |
| C18 | C19 | H19 | 98.1° | 107.7° |
| H18 | C18 | H18A | 112.8° | 105.4° |
| C20 | C19 | H19 | 97.1° | 107.3° |
| C19 | C20 | C21 | 109.1° | 111.7° |
| C19 | C20 | C38 | 108.0° | 112.1° |
| C19 | C20 | H20 | 113.1° | 107.5° |
| C21 | C20 | C38 | 115.6° | 109.6° |
| C21 | C20 | H20 | 105.0° | 107.7° |
| C20 | C21 | C22 | 115.3° | 110.7° |
| C20 | C21 | H21 | 106.6° | 109.5° |
| C38 | C20 | H20 | 106.2° | 108.1° |
| C20 | C38 | H38 | 109.5° | 109.5° |
| C20 | C38 | H38A | 109.5° | 109.5° |
| C20 | C38 | H38B | 109.5° | 109.5° |
| C22 | C21 | H21 | 104.7° | 109.0° |
| C21 | C22 | C23 | 115.4° | 109.5° |
| C21 | C22 | C39 | 107.4° | 109.5° |
| C21 | C22 | H22 | 107.9° | 109.5° |
| C23 | C22 | C39 | 112.2° | 109.5° |
| C23 | C22 | H22 | 102.5° | 109.5° |
| C22 | C23 | C24 | 121.3° | 109.5° |
| C22 | C23 | H23 | 97.1° | 109.5° |
| C39 | C22 | H22 | 111.4° | 109.5° |
| C22 | C39 | H39 | 109.5° | 109.5° |
| C22 | C39 | H39A | 109.5° | 109.4° |
| C22 | C39 | H39B | 109.4° | 109.5° |
| C24 | C23 | H23 | 100.7° | 109.5° |
| C23 | C24 | C25 | 110.7° | 109.5° |
| C23 | C24 | C40 | 115.9° | 109.5° |
| C23 | C24 | H24 | 105.1° | 109.5° |
| C25 | C24 | C40 | 112.7° | 109.4° |
| C25 | C24 | H24 | 108.9° | 109.4° |
| C24 | C25 | C26 | 121.0° | 109.5° |
| C24 | C25 | H25 | 105.8° | 109.5° |
| C24 | C25 | H69 | 105.8° | 109.5° |
| C40 | C24 | H24 | 102.8° | 109.5° |
| C24 | C40 | H40 | 109.5° | 109.5° |
| C24 | C40 | H40A | 109.4° | 109.5° |
| C24 | C40 | H40B | 109.5° | 109.5° |
| C26 | C25 | H25 | 105.8° | 109.5° |
| C25 | C26 | C27 | 119.3° | 109.5° |
| C25 | C26 | H26 | 106.3° | 109.5° |
| C26 | C25 | H69 | 105.8° | 109.4° |
| C25 | C26 | H70 | 106.3° | 109.4° |
| H25 | C25 | H69 | 112.9° | 109.5° |
| C27 | C26 | H26 | 106.3° | 109.5° |
| C26 | C27 | C28 | 116.8° | 109.5° |
| C26 | C27 | H27 | 109.3° | 109.5° |
| C27 | C26 | H70 | 106.3° | 109.5° |
| H26 | C26 | H70 | 112.5° | 109.5° |
| C28 | C27 | H27 | 102.9° | 109.5° |
| C27 | C28 | C29 | 109.4° | 109.2° |
| C27 | C28 | H28 | 109.5° | 109.5° |
| C27 | C28 | H28A | 109.5° | 109.6° |
| C29 | C28 | H28 | 109.5° | 109.5° |
| C29 | C28 | H28A | 109.5° | 109.5° |
| C28 | C29 | C30 | 123.2° | 109.0° |
| C28 | C29 | H29 | 90.8° | 109.5° |
| H28 | C28 | H28A | 109.4° | 109.6° |
| C30 | C29 | H29 | 100.0° | 109.6° |
| C29 | C30 | C31 | 105.6° | 109.2° |
| C29 | C30 | H30 | 110.8° | 109.5° |
| C29 | C30 | H30A | 110.8° | 109.5° |
| C31 | C30 | H30 | 110.8° | 109.5° |
| C31 | C30 | H30A | 110.8° | 109.5° |
| C30 | C31 | C42 | 110.4° | 109.5° |
| C30 | C31 | H31 | 108.0° | 109.5° |
| H30 | C30 | H30A | 108.1° | 109.6° |
| C42 | C31 | H31 | 110.2° | 109.5° |
| C31 | C42 | H42 | 109.5° | 109.4° |
| C31 | C42 | H42A | 109.5° | 109.5° |
| C31 | C42 | H42B | 109.5° | 109.5° |
| H32 | C32 | H32A | 109.5° | 109.5° |
| H32 | C32 | H32B | 109.4° | 109.5° |
| H32A | C32 | H32B | 109.5° | 109.5° |
| H33 | C33 | H33A | 109.5° | 109.5° |
| H33 | C33 | H33B | 109.5° | 109.4° |
| H33A | C33 | H33B | 109.5° | 109.5° |
| H34 | C34 | H34A | 109.4° | 109.4° |
| H34 | C34 | H34B | 109.5° | 109.4° |
| H34A | C34 | H34B | 109.5° | 109.5° |
| H35 | C35 | H35A | 73.4° | 115.8° |
| H36 | C36 | H36A | 109.5° | 109.5° |
| H36 | C36 | H36B | 109.5° | 109.4° |
| H36A | C36 | H36B | 109.5° | 109.5° |
| H37 | C37 | H37A | 109.4° | 109.5° |
| H37 | C37 | H37B | 109.5° | 109.5° |
| H37A | C37 | H37B | 109.5° | 109.5° |
| H38 | C38 | H38A | 109.5° | 109.4° |
| H38 | C38 | H38B | 109.5° | 109.4° |
| H38A | C38 | H38B | 109.5° | 109.5° |
| H39 | C39 | H39A | 109.4° | 109.4° |
| H39 | C39 | H39B | 109.5° | 109.5° |
| H39A | C39 | H39B | 109.5° | 109.5° |
| H40 | C40 | H40A | 109.5° | 109.4° |
| H40 | C40 | H40B | 109.4° | 109.5° |
| H40A | C40 | H40B | 109.5° | 109.5° |
| H41 | C41 | H41A | 109.4° | 109.4° |
| H41 | C41 | H41B | 109.4° | 109.5° |
| H41A | C41 | H41B | 109.5° | 109.4° |
| H42 | C42 | H42A | 109.4° | 109.4° |
| H42 | C42 | H42B | 109.5° | 109.5° |
| H42A | C42 | H42B | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | O2 | 178.1° | 179.3° |
| O1 | C1 | C2 | C3 | 20.9° | 144.8° |
| O1 | C1 | C2 | H2 | 159.0° | 37.1° |
| C1 | O1 | C21 | C20 | 138.1° | 112.0° |
| C1 | O1 | C21 | C22 | 95.4° | 9.5° |
| C1 | O1 | C21 | H21 | 20.7° | 128.2° |
| C2 | C1 | O1 | C21 | 170.1° | 76.7° |
| C1 | C2 | C3 | H2 | 180.0° | 178.1° |
| C1 | C2 | C3 | C4 | 178.3° | 169.0° |
| C1 | C2 | C3 | H3 | 1.7° | 10.7° |
| O2 | C1 | O1 | C21 | 12.0° | 104.1° |
| O2 | C1 | C2 | C3 | 160.9° | 36.0° |
| O2 | C1 | C2 | H2 | 19.1° | 142.2° |
| O1 | C21 | C20 | C19 | 69.8° | 160.3° |
| O1 | C21 | C20 | C22 | 123.2° | 120.7° |
| O1 | C21 | C20 | H21 | 121.1° | 119.2° |
| O1 | C21 | C20 | C38 | 168.2° | 74.9° |
| O1 | C21 | C20 | H20 | 51.6° | 42.5° |
| O1 | C21 | C22 | H21 | 121.0° | 118.4° |
| O1 | C21 | C22 | C23 | 61.4° | 54.5° |
| O1 | C21 | C22 | C39 | 64.6° | 65.5° |
| O1 | C21 | C22 | H22 | 175.3° | 174.5° |
| C2 | C3 | C4 | H3 | 180.0° | 179.6° |
| C2 | C3 | C4 | C5 | 175.8° | 153.1° |
| C2 | C3 | C4 | C32 | 1.7° | 28.1° |
| H2 | C2 | C3 | C4 | 1.7° | 12.9° |
| H2 | C2 | C3 | H3 | 178.3° | 167.4° |
| C3 | C4 | C5 | C32 | 177.5° | 178.8° |
| C3 | C4 | C5 | C6 | 176.1° | 174.6° |
| C3 | C4 | C5 | H5 | 3.9° | 5.4° |
| C3 | C4 | C32 | H32 | 180.0° | 0.0° |
| C3 | C4 | C32 | H32A | 60.0° | 120.0° |
| C3 | C4 | C32 | H32B | 60.0° | 120.0° |
| H3 | C3 | C4 | C5 | 4.2° | 26.6° |
| H3 | C3 | C4 | C32 | 178.3° | 152.2° |
| O3 | C6 | C5 | C4 | 67.6° | 162.9° |
| O3 | C6 | C7 | O4 | 28.8° | 90.8° |
| O3 | C6 | C5 | C7 | 137.5° | 118.6° |
| O3 | C6 | C5 | H6 | 121.3° | 120.5° |
| O3 | C6 | C5 | H5 | 112.4° | 17.1° |
| O3 | C6 | C7 | H6 | 115.5° | 120.6° |
| O3 | C6 | C7 | C8 | 149.4° | 30.0° |
| O3 | C6 | C7 | H7 | 96.4° | 150.8° |
| HO3 | O3 | C6 | C5 | 180.0° | 60.0° |
| HO3 | O3 | C6 | C7 | 42.5° | 176.9° |
| HO3 | O3 | C6 | H6 | 58.8° | 61.8° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 154.9° | 78.5° |
| C4 | C5 | C6 | H6 | 53.7° | 42.3° |
| C5 | C4 | C32 | H32 | 1.7° | 178.8° |
| C5 | C4 | C32 | H32A | 121.7° | 58.8° |
| C5 | C4 | C32 | H32B | 118.3° | 61.2° |
| C32 | C4 | C5 | C6 | 1.5° | 6.6° |
| C32 | C4 | C5 | H5 | 178.5° | 173.4° |
| C4 | C32 | H32 | H32A | 120.0° | 119.9° |
| C4 | C32 | H32 | H32B | 120.0° | 120.0° |
| C4 | C32 | H32A | H32B | 120.0° | 120.0° |
| O4 | C7 | C6 | C5 | 158.0° | 27.2° |
| O4 | C7 | C6 | C8 | 120.6° | 120.9° |
| O4 | C7 | C6 | H7 | 125.2° | 118.4° |
| O4 | C7 | C6 | H6 | 86.7° | 148.6° |
| O4 | C7 | C8 | H7 | 125.2° | 118.5° |
| O4 | C7 | C8 | C9 | 74.4° | 37.9° |
| O4 | C7 | C8 | H8 | 165.6° | 157.7° |
| O4 | C7 | C8 | H8A | 45.5° | 82.0° |
| C7 | O4 | C33 | H33 | 180.0° | 54.3° |
| C7 | O4 | C33 | H33A | 60.0° | 65.7° |
| C7 | O4 | C33 | H33B | 60.0° | 174.3° |
| C33 | O4 | C7 | C6 | 113.9° | 63.9° |
| C33 | O4 | C7 | C8 | 120.6° | 58.9° |
| C33 | O4 | C7 | H7 | 6.4° | 177.5° |
| O4 | C33 | H33 | H33A | 120.0° | 120.0° |
| O4 | C33 | H33 | H33B | 120.0° | 119.9° |
| O4 | C33 | H33A | H33B | 120.0° | 120.0° |
| C5 | C6 | C7 | H6 | 115.3° | 121.4° |
| C5 | C6 | C7 | C8 | 81.4° | 148.1° |
| C5 | C6 | C7 | H7 | 32.8° | 91.2° |
| H5 | C5 | C6 | C7 | 25.1° | 101.5° |
| H5 | C5 | C6 | H6 | 126.3° | 137.6° |
| O5 | C9 | C8 | C7 | 51.7° | 44.4° |
| O5 | C9 | C8 | C10 | 137.5° | 120.7° |
| O5 | C9 | C8 | H9 | 106.6° | 121.4° |
| O5 | C9 | C8 | H8 | 68.3° | 75.6° |
| O5 | C9 | C8 | H8A | 171.7° | 165.4° |
| O5 | C9 | C10 | H9 | 110.9° | 120.3° |
| O5 | C9 | C10 | C11 | 0.0° | 51.7° |
| O5 | C9 | C10 | H10 | 180.0° | 128.2° |
| C9 | O5 | C13 | C12 | 64.0° | 5.2° |
| C9 | O5 | C13 | C14 | 167.6° | 115.7° |
| C9 | O5 | C13 | H13 | 51.5° | 125.3° |
| C13 | O5 | C9 | C8 | 97.6° | 174.0° |
| C13 | O5 | C9 | C10 | 40.9° | 54.1° |
| C13 | O5 | C9 | H9 | 157.9° | 65.1° |
| O5 | C13 | C12 | C11 | 45.4° | 45.8° |
| O5 | C13 | C12 | C14 | 119.3° | 121.6° |
| O5 | C13 | C12 | H13 | 125.2° | 120.8° |
| O5 | C13 | C12 | H12 | 165.4° | 166.4° |
| O5 | C13 | C12 | H12A | 74.6° | 74.7° |
| O5 | C13 | C14 | H13 | 125.3° | 120.1° |
| O5 | C13 | C14 | C15 | 82.0° | 84.2° |
| O5 | C13 | C14 | H14 | 158.0° | 155.8° |
| O5 | C13 | C14 | H14A | 38.0° | 36.7° |
| C6 | C7 | C8 | H7 | 120.2° | 121.0° |
| C6 | C7 | C8 | C9 | 171.0° | 158.4° |
| C6 | C7 | C8 | H8 | 51.0° | 81.8° |
| C6 | C7 | C8 | H8A | 69.0° | 38.5° |
| H6 | C6 | C7 | C8 | 33.9° | 90.6° |
| H6 | C6 | C7 | H7 | 148.1° | 30.2° |
| O6 | C15 | C14 | C13 | 147.8° | 70.8° |
| O6 | C15 | C16 | O13 | 147.1° | 98.1° |
| O6 | C15 | C14 | C16 | 133.1° | 122.3° |
| O6 | C15 | C14 | H15 | 111.7° | 118.5° |
| O6 | C15 | C14 | H14 | 92.3° | 169.5° |
| O6 | C15 | C14 | H14A | 27.7° | 49.4° |
| O6 | C15 | C16 | H15 | 115.6° | 118.4° |
| O6 | C15 | C16 | C17 | 80.5° | 48.0° |
| O6 | C15 | C16 | C35 | 67.0° | 163.8° |
| C15 | O6 | C34 | H34 | 180.0° | 65.0° |
| C15 | O6 | C34 | H34A | 60.0° | 55.0° |
| C15 | O6 | C34 | H34B | 60.0° | 175.1° |
| C34 | O6 | C15 | C14 | 66.6° | 153.6° |
| C34 | O6 | C15 | C16 | 156.7° | 83.6° |
| C34 | O6 | C15 | H15 | 38.7° | 34.9° |
| O6 | C34 | H34 | H34A | 120.0° | 120.0° |
| O6 | C34 | H34 | H34B | 120.0° | 120.0° |
| O6 | C34 | H34A | H34B | 120.0° | 120.1° |
| C7 | C8 | C9 | H8 | 120.0° | 120.0° |
| C7 | C8 | C9 | H8A | 120.0° | 120.9° |
| C7 | C8 | H8 | H8A | 119.1° | 121.0° |
| C7 | C8 | C9 | C10 | 170.8° | 165.2° |
| C7 | C8 | C9 | H9 | 54.9° | 76.9° |
| H7 | C7 | C8 | C9 | 50.8° | 80.7° |
| H7 | C7 | C8 | H8 | 69.2° | 39.2° |
| H7 | C7 | C8 | H8A | 170.8° | 159.5° |
| O7 | C17 | C16 | O13 | 79.6° | 164.8° |
| O7 | C17 | C16 | C15 | 52.5° | 18.5° |
| O7 | C17 | C16 | C18 | 135.8° | 123.3° |
| O7 | C17 | C16 | H17 | 114.7° | 118.3° |
| O7 | C17 | C16 | C35 | 160.8° | 129.9° |
| O7 | C17 | C18 | H17 | 116.7° | 119.7° |
| O7 | C17 | C18 | C19 | 46.5° | 47.9° |
| O7 | C17 | C18 | H18 | 73.5° | 78.5° |
| O7 | C17 | C18 | H18A | 166.5° | 166.6° |
| C17 | O7 | C36 | H36 | 180.0° | 179.9° |
| C17 | O7 | C36 | H36A | 60.0° | 60.1° |
| C17 | O7 | C36 | H36B | 60.0° | 59.9° |
| C36 | O7 | C17 | C16 | 69.0° | 103.7° |
| C36 | O7 | C17 | C18 | 70.8° | 134.0° |
| C36 | O7 | C17 | H17 | 176.0° | 14.2° |
| O7 | C36 | H36 | H36A | 120.0° | 120.0° |
| O7 | C36 | H36 | H36B | 120.0° | 120.0° |
| O7 | C36 | H36A | H36B | 120.0° | 120.0° |
| C9 | C8 | H8 | H8A | 119.0° | 118.7° |
| C8 | C9 | C10 | H9 | 107.6° | 118.5° |
| C8 | C9 | C10 | C11 | 141.6° | 172.9° |
| C8 | C9 | C10 | H10 | 38.4° | 7.1° |
| H8 | C8 | C9 | C10 | 69.2° | 45.1° |
| H8 | C8 | C9 | H9 | 174.9° | 163.0° |
| H8A | C8 | C9 | C10 | 50.8° | 73.9° |
| H8A | C8 | C9 | H9 | 65.1° | 44.0° |
| O8 | C19 | C18 | C17 | 162.8° | 19.4° |
| O8 | C19 | C18 | C20 | 134.8° | 125.8° |
| O8 | C19 | C18 | H19 | 121.0° | 116.2° |
| O8 | C19 | C18 | H18 | 42.7° | 145.1° |
| O8 | C19 | C18 | H18A | 77.2° | 99.0° |
| O8 | C19 | C20 | H19 | 120.8° | 117.2° |
| O8 | C19 | C20 | C21 | 71.3° | 35.1° |
| O8 | C19 | C20 | C38 | 55.2° | 88.3° |
| O8 | C19 | C20 | H20 | 172.3° | 153.1° |
| C19 | O8 | C37 | H37 | 180.0° | 60.0° |
| C19 | O8 | C37 | H37A | 60.0° | 180.0° |
| C19 | O8 | C37 | H37B | 60.0° | 60.0° |
| C37 | O8 | C19 | C18 | 68.9° | 90.0° |
| C37 | O8 | C19 | C20 | 150.2° | 144.0° |
| C37 | O8 | C19 | H19 | 41.0° | 26.6° |
| O8 | C37 | H37 | H37A | 120.0° | 120.0° |
| O8 | C37 | H37 | H37B | 120.0° | 120.0° |
| O8 | C37 | H37A | H37B | 120.0° | 120.0° |
| C9 | C10 | C11 | H10 | 180.0° | 180.0° |
| C9 | C10 | C11 | C12 | 15.8° | 0.1° |
| C9 | C10 | C11 | H11 | 164.2° | 180.0° |
| H9 | C9 | C10 | C11 | 110.8° | 68.6° |
| H9 | C9 | C10 | H10 | 69.2° | 111.4° |
| O9 | C23 | C22 | C21 | 49.0° | 24.4° |
| O9 | C23 | C22 | C24 | 135.7° | 120.0° |
| O9 | C23 | C22 | H23 | 117.1° | 120.0° |
| O9 | C23 | C22 | C39 | 172.5° | 144.4° |
| O9 | C23 | C22 | H22 | 67.9° | 95.6° |
| O9 | C23 | C24 | H23 | 118.1° | 120.0° |
| O9 | C23 | C24 | C25 | 76.5° | 53.3° |
| O9 | C23 | C24 | C40 | 53.4° | 173.2° |
| O9 | C23 | C24 | H24 | 166.1° | 66.7° |
| HO9 | O9 | C23 | C22 | 75.5° | 59.9° |
| HO9 | O9 | C23 | C24 | 144.1° | 60.0° |
| HO9 | O9 | C23 | H23 | 32.8° | 180.0° |
| C10 | C11 | C12 | H11 | 180.0° | 180.0° |
| C10 | C11 | C12 | C13 | 9.4° | 48.9° |
| C10 | C11 | C12 | H12 | 129.4° | 169.5° |
| C10 | C11 | C12 | H12A | 110.6° | 71.5° |
| H10 | C10 | C11 | C12 | 164.2° | 179.9° |
| H10 | C10 | C11 | H11 | 15.8° | 0.1° |
| O10 | C27 | C26 | C25 | 70.6° | 65.0° |
| O10 | C27 | C26 | C28 | 118.7° | 119.9° |
| O10 | C27 | C26 | H27 | 125.0° | 120.0° |
| O10 | C27 | C26 | H26 | 169.4° | 175.0° |
| O10 | C27 | C28 | H27 | 125.1° | 120.0° |
| O10 | C27 | C28 | C29 | 40.6° | 57.6° |
| O10 | C27 | C28 | H28 | 79.4° | 177.5° |
| O10 | C27 | C28 | H28A | 160.6° | 62.3° |
| C27 | O10 | C31 | C30 | 54.7° | 61.2° |
| C27 | O10 | C31 | C42 | 174.9° | 58.8° |
| C27 | O10 | C31 | H31 | 64.5° | 178.9° |
| O10 | C27 | C26 | H70 | 49.4° | 55.0° |
| C31 | O10 | C27 | C26 | 75.3° | 178.8° |
| C31 | O10 | C27 | C28 | 48.9° | 61.2° |
| C31 | O10 | C27 | H27 | 165.1° | 58.8° |
| O10 | C31 | C30 | C29 | 48.5° | 57.6° |
| O10 | C31 | C30 | C42 | 118.6° | 120.0° |
| O10 | C31 | C30 | H31 | 120.8° | 120.0° |
| O10 | C31 | C30 | H30 | 71.5° | 177.5° |
| O10 | C31 | C30 | H30A | 168.5° | 62.3° |
| O10 | C31 | C42 | H31 | 120.8° | 120.1° |
| O10 | C31 | C42 | H42 | 180.0° | 54.3° |
| O10 | C31 | C42 | H42A | 60.0° | 174.2° |
| O10 | C31 | C42 | H42B | 60.0° | 65.7° |
| C11 | C12 | C13 | H12 | 120.0° | 120.5° |
| C11 | C12 | C13 | H12A | 120.0° | 120.5° |
| C11 | C12 | H12 | H12A | 119.0° | 119.3° |
| C11 | C12 | C13 | C14 | 164.7° | 167.4° |
| C11 | C12 | C13 | H13 | 79.9° | 74.9° |
| H11 | C11 | C12 | C13 | 170.6° | 131.1° |
| H11 | C11 | C12 | H12 | 50.6° | 10.5° |
| H11 | C11 | C12 | H12A | 69.4° | 108.5° |
| O11 | C29 | C28 | C27 | 165.6° | 62.9° |
| O11 | C29 | C28 | C30 | 143.5° | 119.9° |
| O11 | C29 | C28 | H29 | 114.1° | 120.2° |
| O11 | C29 | C28 | H28 | 74.4° | 57.0° |
| O11 | C29 | C28 | H28A | 45.6° | 177.2° |
| O11 | C29 | C30 | H29 | 117.3° | 120.2° |
| O11 | C29 | C30 | C31 | 160.3° | 62.9° |
| O11 | C29 | C30 | H30 | 79.7° | 57.0° |
| O11 | C29 | C30 | H30A | 40.3° | 177.2° |
| C29 | O11 | C41 | H41 | 180.0° | 180.0° |
| C29 | O11 | C41 | H41A | 60.0° | 60.0° |
| C29 | O11 | C41 | H41B | 60.0° | 60.0° |
| C41 | O11 | C29 | C28 | 161.0° | 150.0° |
| C41 | O11 | C29 | C30 | 51.3° | 90.5° |
| C41 | O11 | C29 | H29 | 59.0° | 29.8° |
| O11 | C41 | H41 | H41A | 120.0° | 120.0° |
| O11 | C41 | H41 | H41B | 120.0° | 120.0° |
| O11 | C41 | H41A | H41B | 120.0° | 120.0° |
| C13 | C12 | H12 | H12A | 119.0° | 119.1° |
| C12 | C13 | C14 | H13 | 114.9° | 118.1° |
| C12 | C13 | C14 | C15 | 158.1° | 153.9° |
| C12 | C13 | C14 | H14 | 38.1° | 33.9° |
| C12 | C13 | C14 | H14A | 81.9° | 85.1° |
| H12 | C12 | C13 | C14 | 75.3° | 72.0° |
| H12 | C12 | C13 | H13 | 40.2° | 45.6° |
| H12A | C12 | C13 | C14 | 44.7° | 46.9° |
| H12A | C12 | C13 | H13 | 160.2° | 164.6° |
| C13 | C14 | C15 | H14 | 120.0° | 119.7° |
| C13 | C14 | C15 | H14A | 120.0° | 120.2° |
| C13 | C14 | H14 | H14A | 114.1° | 119.0° |
| C13 | C14 | C15 | C16 | 79.1° | 166.9° |
| C13 | C14 | C15 | H15 | 36.1° | 47.7° |
| H13 | C13 | C14 | C15 | 43.3° | 35.9° |
| H13 | C13 | C14 | H14 | 76.7° | 84.1° |
| H13 | C13 | C14 | H14A | 163.3° | 156.8° |
| O13 | C16 | C15 | C14 | 9.1° | 139.7° |
| O13 | C16 | C15 | C17 | 132.4° | 146.1° |
| O13 | C16 | C15 | C35 | 80.1° | 65.6° |
| O13 | C16 | C15 | H15 | 97.3° | 20.3° |
| O13 | C16 | C17 | C35 | 81.2° | 65.3° |
| O13 | C16 | C17 | C18 | 56.3° | 41.5° |
| O13 | C16 | C17 | H17 | 165.8° | 76.9° |
| C16 | O13 | C35 | H35 | 120.0° | 106.9° |
| C16 | O13 | C35 | H35A | 119.9° | 106.9° |
| O13 | C35 | H35 | H35A | 141.4° | 146.7° |
| C15 | C14 | H14 | H14A | 114.0° | 120.8° |
| C14 | C15 | C16 | H15 | 106.3° | 119.4° |
| C14 | C15 | C16 | C17 | 141.4° | 74.2° |
| C14 | C15 | C16 | C35 | 71.0° | 74.0° |
| H14 | C14 | C15 | C16 | 40.8° | 47.2° |
| H14 | C14 | C15 | H15 | 156.0° | 72.0° |
| H14A | C14 | C15 | C16 | 160.8° | 72.9° |
| H14A | C14 | C15 | H15 | 84.0° | 167.9° |
| C15 | C16 | C17 | C35 | 146.8° | 148.4° |
| C15 | C16 | C17 | C18 | 171.7° | 104.8° |
| C15 | C16 | C17 | H17 | 62.2° | 136.8° |
| C15 | C16 | C35 | H35 | 133.2° | 146.8° |
| C15 | C16 | C35 | H35A | 13.2° | 0.4° |
| H15 | C15 | C16 | C17 | 35.1° | 166.4° |
| H15 | C15 | C16 | C35 | 177.4° | 45.4° |
| C16 | C17 | C18 | H17 | 105.4° | 117.9° |
| C16 | C17 | C18 | C19 | 175.6° | 170.4° |
| C16 | C17 | C18 | H18 | 64.4° | 44.0° |
| C16 | C17 | C18 | H18A | 55.5° | 71.0° |
| C17 | C16 | C35 | H35 | 12.7° | 1.4° |
| C17 | C16 | C35 | H35A | 132.8° | 147.8° |
| C35 | C16 | C17 | C18 | 25.0° | 106.8° |
| C35 | C16 | C17 | H17 | 84.6° | 11.6° |
| C16 | C35 | H35 | H35A | 141.4° | 147.0° |
| C17 | C18 | C19 | H18 | 120.0° | 125.7° |
| C17 | C18 | C19 | H18A | 120.0° | 118.4° |
| C17 | C18 | H18 | H18A | 115.2° | 116.3° |
| C17 | C18 | C19 | C20 | 62.5° | 106.5° |
| C17 | C18 | C19 | H19 | 41.7° | 135.6° |
| H17 | C17 | C18 | C19 | 70.2° | 71.8° |
| H17 | C17 | C18 | H18 | 169.8° | 161.8° |
| H17 | C17 | C18 | H18A | 49.8° | 46.9° |
| C19 | C18 | H18 | H18A | 115.2° | 117.5° |
| C18 | C19 | C20 | H19 | 104.7° | 118.2° |
| C18 | C19 | C20 | C21 | 154.2° | 159.8° |
| C18 | C19 | C20 | C38 | 79.3° | 36.4° |
| C18 | C19 | C20 | H20 | 37.8° | 82.3° |
| H18 | C18 | C19 | C20 | 177.5° | 19.3° |
| H18 | C18 | C19 | H19 | 78.3° | 98.6° |
| H18A | C18 | C19 | C20 | 57.6° | 135.2° |
| H18A | C18 | C19 | H19 | 161.7° | 17.3° |
| C19 | C20 | C21 | C38 | 121.9° | 124.8° |
| C19 | C20 | C21 | H20 | 121.5° | 117.8° |
| C19 | C20 | C38 | H20 | 121.5° | 118.3° |
| C19 | C20 | C21 | C22 | 167.0° | 79.1° |
| C19 | C20 | C21 | H21 | 51.3° | 41.1° |
| C19 | C20 | C38 | H38 | 180.0° | 56.5° |
| C19 | C20 | C38 | H38A | 60.0° | 176.5° |
| C19 | C20 | C38 | H38B | 60.0° | 63.5° |
| H19 | C19 | C20 | C21 | 49.5° | 82.1° |
| H19 | C19 | C20 | C38 | 176.0° | 154.5° |
| H19 | C19 | C20 | H20 | 66.9° | 35.9° |
| C21 | C20 | C38 | H20 | 115.9° | 117.2° |
| C20 | C21 | C22 | H21 | 116.8° | 120.5° |
| C20 | C21 | C22 | C23 | 176.4° | 175.6° |
| C20 | C21 | C22 | C39 | 57.6° | 55.6° |
| C20 | C21 | C22 | H22 | 62.5° | 64.4° |
| C21 | C20 | C38 | H38 | 57.5° | 178.9° |
| C21 | C20 | C38 | H38A | 62.6° | 58.9° |
| C21 | C20 | C38 | H38B | 177.5° | 61.1° |
| C38 | C20 | C21 | C22 | 45.0° | 45.7° |
| C38 | C20 | C21 | H21 | 70.7° | 165.9° |
| C20 | C38 | H38 | H38A | 120.0° | 120.0° |
| C20 | C38 | H38 | H38B | 120.0° | 120.0° |
| C20 | C38 | H38A | H38B | 120.0° | 120.0° |
| H20 | C20 | C21 | C22 | 71.6° | 163.2° |
| H20 | C20 | C21 | H21 | 172.7° | 76.7° |
| H20 | C20 | C38 | H38 | 58.5° | 61.8° |
| H20 | C20 | C38 | H38A | 178.5° | 58.2° |
| H20 | C20 | C38 | H38B | 61.5° | 178.2° |
| C21 | C22 | C23 | C39 | 123.5° | 120.0° |
| C21 | C22 | C23 | H22 | 116.9° | 120.0° |
| C21 | C22 | C39 | H22 | 117.9° | 120.0° |
| C21 | C22 | C23 | C24 | 175.3° | 144.4° |
| C21 | C22 | C23 | H23 | 68.1° | 95.6° |
| C21 | C22 | C39 | H39 | 180.0° | 124.6° |
| C21 | C22 | C39 | H39A | 60.0° | 115.5° |
| C21 | C22 | C39 | H39B | 60.0° | 4.5° |
| H21 | C21 | C22 | C23 | 59.6° | 63.9° |
| H21 | C21 | C22 | C39 | 174.4° | 176.1° |
| H21 | C21 | C22 | H22 | 54.3° | 56.1° |
| C23 | C22 | C39 | H22 | 114.3° | 120.0° |
| C22 | C23 | C24 | H23 | 105.2° | 120.0° |
| C22 | C23 | C24 | C25 | 60.3° | 173.2° |
| C22 | C23 | C24 | C40 | 169.9° | 66.8° |
| C22 | C23 | C24 | H24 | 57.2° | 53.3° |
| C23 | C22 | C39 | H39 | 52.2° | 4.6° |
| C23 | C22 | C39 | H39A | 172.1° | 124.5° |
| C23 | C22 | C39 | H39B | 67.9° | 115.4° |
| C39 | C22 | C23 | C24 | 51.8° | 95.6° |
| C39 | C22 | C23 | H23 | 55.4° | 24.4° |
| C22 | C39 | H39 | H39A | 120.0° | 119.9° |
| C22 | C39 | H39 | H39B | 120.0° | 120.1° |
| C22 | C39 | H39A | H39B | 120.0° | 120.1° |
| H22 | C22 | C23 | C24 | 67.8° | 24.4° |
| H22 | C22 | C23 | H23 | 174.9° | 144.4° |
| H22 | C22 | C39 | H39 | 62.1° | 115.4° |
| H22 | C22 | C39 | H39A | 57.9° | 4.5° |
| H22 | C22 | C39 | H39B | 177.9° | 124.6° |
| C23 | C24 | C25 | C40 | 131.5° | 120.0° |
| C23 | C24 | C25 | H24 | 115.1° | 120.0° |
| C23 | C24 | C40 | H24 | 114.1° | 120.1° |
| C23 | C24 | C25 | C26 | 173.7° | 175.0° |
| C23 | C24 | C25 | H25 | 66.4° | 65.0° |
| C23 | C24 | C40 | H40 | 180.0° | 45.0° |
| C23 | C24 | C40 | H40A | 60.0° | 165.0° |
| C23 | C24 | C40 | H40B | 60.0° | 75.0° |
| C23 | C24 | C25 | H69 | 53.6° | 55.0° |
| H23 | C23 | C24 | C25 | 165.4° | 66.8° |
| H23 | C23 | C24 | C40 | 64.7° | 53.2° |
| H23 | C23 | C24 | H24 | 48.0° | 173.3° |
| C25 | C24 | C40 | H24 | 117.0° | 119.9° |
| C24 | C25 | C26 | H25 | 120.0° | 120.0° |
| C24 | C25 | C26 | H69 | 120.0° | 119.9° |
| C24 | C25 | H25 | H69 | 115.3° | 120.0° |
| C24 | C25 | C26 | C27 | 176.3° | NaN° |
| C24 | C25 | C26 | H26 | 56.3° | 60.0° |
| C25 | C24 | C40 | H40 | 51.1° | 75.0° |
| C25 | C24 | C40 | H40A | 171.1° | 45.0° |
| C25 | C24 | C40 | H40B | 68.9° | 165.0° |
| C24 | C25 | C26 | H70 | 63.7° | 60.1° |
| C40 | C24 | C25 | C26 | 54.8° | 65.0° |
| C40 | C24 | C25 | H25 | 65.2° | 55.0° |
| C24 | C40 | H40 | H40A | 120.0° | 120.0° |
| C24 | C40 | H40 | H40B | 120.0° | 120.0° |
| C24 | C40 | H40A | H40B | 120.0° | 120.0° |
| C40 | C24 | C25 | H69 | 174.8° | 175.1° |
| H24 | C24 | C25 | C26 | 58.5° | 55.0° |
| H24 | C24 | C25 | H25 | 178.5° | 175.0° |
| H24 | C24 | C40 | H40 | 66.0° | 165.1° |
| H24 | C24 | C40 | H40A | 54.1° | 74.9° |
| H24 | C24 | C40 | H40B | 174.1° | 45.1° |
| H24 | C24 | C25 | H69 | 61.5° | 65.0° |
| C26 | C25 | H25 | H69 | 115.2° | 120.0° |
| C25 | C26 | C27 | H26 | 120.0° | 120.0° |
| C25 | C26 | C27 | H70 | 120.0° | 119.9° |
| C25 | C26 | H26 | H70 | 115.9° | 120.0° |
| C25 | C26 | C27 | C28 | 170.7° | 175.1° |
| C25 | C26 | C27 | H27 | 54.4° | 55.0° |
| H25 | C25 | C26 | C27 | 63.7° | 60.0° |
| H25 | C25 | C26 | H26 | 176.3° | 180.0° |
| H25 | C25 | C26 | H70 | 56.3° | 60.0° |
| C27 | C26 | H26 | H70 | 115.9° | 120.0° |
| C26 | C27 | C28 | H27 | 119.8° | 120.0° |
| C26 | C27 | C28 | C29 | 74.5° | 177.6° |
| C26 | C27 | C28 | H28 | 165.5° | 62.5° |
| C26 | C27 | C28 | H28A | 45.5° | 57.7° |
| C27 | C26 | C25 | H69 | 56.3° | 60.1° |
| H26 | C26 | C27 | C28 | 50.7° | 55.1° |
| H26 | C26 | C27 | H27 | 65.6° | 65.0° |
| H26 | C26 | C25 | H69 | 63.7° | 59.9° |
| C27 | C28 | C29 | H28 | 120.0° | 119.9° |
| C27 | C28 | C29 | H28A | 120.0° | 119.9° |
| C27 | C28 | H28 | H28A | 120.1° | 120.2° |
| C27 | C28 | C29 | C30 | 51.0° | 57.0° |
| C27 | C28 | C29 | H29 | 51.5° | 177.0° |
| C28 | C27 | C26 | H70 | 69.3° | 65.0° |
| H27 | C27 | C28 | C29 | 165.7° | 62.4° |
| H27 | C27 | C28 | H28 | 45.7° | 57.5° |
| H27 | C27 | C28 | H28A | 74.3° | 177.7° |
| H27 | C27 | C26 | H70 | 174.4° | 175.0° |
| C29 | C28 | H28 | H28A | 120.0° | 120.1° |
| C28 | C29 | C30 | H29 | 97.6° | 119.9° |
| C28 | C29 | C30 | C31 | 54.5° | 57.0° |
| C28 | C29 | C30 | H30 | 65.5° | 176.9° |
| C28 | C29 | C30 | H30A | 174.5° | 62.9° |
| H28 | C28 | C29 | C30 | 69.0° | 176.9° |
| H28 | C28 | C29 | H29 | 171.5° | 63.2° |
| H28A | C28 | C29 | C30 | 171.0° | 62.9° |
| H28A | C28 | C29 | H29 | 68.5° | 57.0° |
| C29 | C30 | C31 | H30 | 120.0° | 119.9° |
| C29 | C30 | C31 | H30A | 120.0° | 119.9° |
| C29 | C30 | H30 | H30A | 121.6° | 120.2° |
| C29 | C30 | C31 | C42 | 167.1° | 62.4° |
| C29 | C30 | C31 | H31 | 72.3° | 177.6° |
| H29 | C29 | C30 | C31 | 43.0° | 176.9° |
| H29 | C29 | C30 | H30 | 163.0° | 63.2° |
| H29 | C29 | C30 | H30A | 77.0° | 56.9° |
| C31 | C30 | H30 | H30A | 121.6° | 120.2° |
| C30 | C31 | C42 | H31 | 119.2° | 120.0° |
| C30 | C31 | C42 | H42 | 60.0° | 65.7° |
| C30 | C31 | C42 | H42A | 180.0° | 54.3° |
| C30 | C31 | C42 | H42B | 60.0° | 174.3° |
| H30 | C30 | C31 | C42 | 47.1° | 57.5° |
| H30 | C30 | C31 | H31 | 167.6° | 62.5° |
| H30A | C30 | C31 | C42 | 72.9° | 177.7° |
| H30A | C30 | C31 | H31 | 47.7° | 57.7° |
| C31 | C42 | H42 | H42A | 120.0° | 120.0° |
| C31 | C42 | H42 | H42B | 120.0° | 120.0° |
| C31 | C42 | H42A | H42B | 120.0° | 120.0° |
| H31 | C31 | C42 | H42 | 59.2° | 174.4° |
| H31 | C31 | C42 | H42A | 60.8° | 65.7° |
| H31 | C31 | C42 | H42B | 179.2° | 54.4° |
| H32 | C32 | H32A | H32B | 119.9° | 120.1° |
| H33 | C33 | H33A | H33B | 120.0° | 120.0° |
| H34 | C34 | H34A | H34B | 120.0° | 119.9° |
| H36 | C36 | H36A | H36B | 120.0° | 120.0° |
| H37 | C37 | H37A | H37B | 120.0° | 120.0° |
| H38 | C38 | H38A | H38B | 120.0° | 119.9° |
| H39 | C39 | H39A | H39B | 120.0° | 120.0° |
| H40 | C40 | H40A | H40B | 120.0° | 119.9° |
| H41 | C41 | H41A | H41B | 119.9° | 120.0° |
| H42 | C42 | H42A | H42B | 120.0° | 120.0° |
| H69 | C25 | C26 | H70 | 176.3° | 180.0° |
