POU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | O7 | sing | 1.43Å | 1.43Å | |
| O7 | C7 | sing | 1.43Å | 1.44Å | |
| C7 | C6 | sing | 1.53Å | 1.55Å | |
| C7 | C8 | sing | 1.53Å | 1.55Å | |
| O2 | C2 | sing | 1.43Å | 1.43Å | |
| C6 | C5 | sing | 1.53Å | 1.53Å | |
| C5 | C4 | sing | 1.53Å | 1.56Å | |
| C5 | O9 | sing | 1.43Å | 1.46Å | |
| C2 | C1 | sing | 1.51Å | 1.39Å | |
| C2 | C3 | sing | 1.53Å | 1.48Å | |
| O24 | C24 | sing | 1.43Å | 1.43Å | |
| O91 | C9 | sing | 1.43Å | 1.44Å | |
| O1 | C1 | doub | 1.21Å | 1.22Å | |
| C8 | C9 | sing | 1.53Å | 1.51Å | |
| C8 | O8 | sing | 1.43Å | 1.43Å | |
| C4 | C3 | sing | 1.54Å | 1.51Å | |
| C1 | O15 | sing | 1.34Å | 1.35Å | |
| C24 | C23 | sing | 1.53Å | 1.52Å | |
| C9 | O9 | sing | 1.42Å | 1.45Å | |
| C9 | C10 | sing | 1.54Å | 1.57Å | |
| C3 | O3 | sing | 1.43Å | 1.42Å | |
| O3 | C16 | sing | 1.43Å | 1.42Å | |
| O15 | C15 | sing | 1.45Å | 1.42Å | |
| C23 | C26 | sing | 1.53Å | 1.55Å | |
| C23 | C22 | sing | 1.51Å | 1.54Å | |
| C19 | C10 | sing | 1.53Å | 1.52Å | |
| C10 | C11 | sing | 1.52Å | 1.57Å | |
| C10 | C18 | sing | 1.53Å | 1.53Å | |
| O13 | C20 | sing | 1.43Å | 1.42Å | |
| O13 | C13 | sing | 1.43Å | 1.47Å | |
| C26 | C27 | sing | 1.53Å | 1.54Å | |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C11 | O11 | sing | 1.43Å | 1.47Å | |
| C15 | C21 | sing | 1.51Å | 1.54Å | |
| C15 | C14 | sing | 1.53Å | 1.56Å | |
| C22 | C21 | doub | 1.31Å | 1.56Å | |
| C12 | C13 | sing | 1.53Å | 1.55Å | |
| C21 | C25 | sing | 1.51Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.57Å | |
| C27 | H1 | sing | 1.09Å | 1.10Å | |
| C27 | H2 | sing | 1.09Å | 1.10Å | |
| C27 | H3 | sing | 1.09Å | 1.10Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C16 | H8 | sing | 1.09Å | 1.10Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C17 | H10 | sing | 1.09Å | 1.10Å | |
| C17 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C26 | H23 | sing | 1.09Å | 1.10Å | |
| C26 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H25 | sing | 1.09Å | 1.10Å | |
| C24 | H26 | sing | 1.09Å | 1.10Å | |
| C12 | H27 | sing | 1.09Å | 1.10Å | |
| C12 | H28 | sing | 1.09Å | 1.10Å | |
| C14 | H29 | sing | 1.09Å | 1.10Å | |
| C14 | H30 | sing | 1.09Å | 1.10Å | |
| C4 | H31 | sing | 1.09Å | 1.10Å | |
| C4 | H32 | sing | 1.09Å | 1.10Å | |
| C6 | H33 | sing | 1.09Å | 1.10Å | |
| C6 | H34 | sing | 1.09Å | 1.10Å | |
| O24 | H35 | sing | 0.97Å | 0.95Å | |
| O11 | H36 | sing | 0.97Å | 0.95Å | |
| O2 | H37 | sing | 0.97Å | 0.95Å | |
| O8 | H38 | sing | 0.97Å | 0.95Å | |
| O91 | H39 | sing | 0.97Å | 0.95Å | |
| C23 | H40 | sing | 1.09Å | 1.10Å | |
| C11 | H41 | sing | 1.09Å | 1.10Å | |
| C13 | H42 | sing | 1.09Å | 1.10Å | |
| C5 | H43 | sing | 1.09Å | 1.10Å | |
| C2 | H44 | sing | 1.09Å | 1.10Å | |
| C8 | H45 | sing | 1.09Å | 1.10Å | |
| C15 | H46 | sing | 1.09Å | 1.10Å | |
| C3 | H47 | sing | 1.09Å | 1.10Å | |
| C7 | H48 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | O7 | C7 | 109.8° | 114.0° |
| O7 | C17 | H10 | 109.5° | 109.4° |
| O7 | C17 | H11 | 109.4° | 109.5° |
| O7 | C17 | H12 | 109.4° | 109.5° |
| O7 | C7 | C6 | 113.5° | 109.5° |
| O7 | C7 | C8 | 111.5° | 109.4° |
| O7 | C7 | H48 | 108.0° | 109.5° |
| C6 | C7 | C8 | 110.2° | 109.5° |
| C7 | C6 | C5 | 107.1° | 109.4° |
| C7 | C6 | H33 | 110.1° | 109.5° |
| C7 | C6 | H34 | 110.1° | 109.5° |
| C6 | C7 | H48 | 106.7° | 109.5° |
| C7 | C8 | C9 | 109.0° | 109.0° |
| C7 | C8 | O8 | 108.3° | 109.6° |
| C7 | C8 | H45 | 108.8° | 109.6° |
| C8 | C7 | H48 | 106.7° | 109.5° |
| O2 | C2 | C1 | 109.5° | 109.7° |
| O2 | C2 | C3 | 108.5° | 109.7° |
| C2 | O2 | H37 | 109.5° | 114.0° |
| O2 | C2 | H44 | 109.8° | 109.7° |
| C6 | C5 | C4 | 115.6° | 109.2° |
| C6 | C5 | O9 | 112.8° | 109.5° |
| C5 | C6 | H33 | 110.0° | 109.5° |
| C5 | C6 | H34 | 110.1° | 109.5° |
| C6 | C5 | H43 | 105.9° | 109.8° |
| C4 | C5 | O9 | 109.6° | 107.9° |
| C5 | C4 | C3 | 107.7° | 107.7° |
| C5 | C4 | H31 | 109.9° | 109.8° |
| C5 | C4 | H32 | 109.9° | 109.8° |
| C4 | C5 | H43 | 105.6° | 109.8° |
| C5 | O9 | C9 | 118.3° | 114.6° |
| O9 | C5 | H43 | 106.7° | 110.5° |
| C1 | C2 | C3 | 109.5° | 108.1° |
| C2 | C1 | O1 | 124.2° | 121.1° |
| C2 | C1 | O15 | 109.7° | 117.8° |
| C1 | C2 | H44 | 110.5° | 109.7° |
| C2 | C3 | C4 | 108.0° | 110.4° |
| C2 | C3 | O3 | 109.1° | 109.3° |
| C3 | C2 | H44 | 109.1° | 109.8° |
| C2 | C3 | H47 | 109.8° | 109.3° |
| O24 | C24 | C23 | 108.0° | 109.5° |
| O24 | C24 | H25 | 109.8° | 109.4° |
| O24 | C24 | H26 | 109.8° | 109.4° |
| C24 | O24 | H35 | 109.5° | 114.0° |
| O91 | C9 | C8 | 106.2° | 109.6° |
| O91 | C9 | O9 | 103.9° | 109.7° |
| O91 | C9 | C10 | 105.8° | 109.6° |
| C9 | O91 | H39 | 109.5° | 114.0° |
| O1 | C1 | O15 | 126.1° | 121.1° |
| C9 | C8 | O8 | 110.9° | 109.5° |
| C8 | C9 | O9 | 112.9° | 109.9° |
| C8 | C9 | C10 | 116.8° | 109.2° |
| C9 | C8 | H45 | 109.3° | 109.6° |
| C8 | O8 | H38 | 109.5° | 114.1° |
| O8 | C8 | H45 | 110.4° | 109.5° |
| C4 | C3 | O3 | 109.7° | 109.3° |
| C3 | C4 | H31 | 109.9° | 109.8° |
| C3 | C4 | H32 | 109.9° | 109.8° |
| C4 | C3 | H47 | 109.4° | 109.3° |
| C1 | O15 | C15 | 126.9° | 118.9° |
| C24 | C23 | C26 | 105.7° | 109.5° |
| C24 | C23 | C22 | 108.8° | 109.5° |
| C23 | C24 | H25 | 109.8° | 109.5° |
| C23 | C24 | H26 | 109.8° | 109.5° |
| C24 | C23 | H40 | 109.6° | 109.5° |
| O9 | C9 | C10 | 110.0° | 108.8° |
| C9 | C10 | C19 | 108.6° | 109.4° |
| C9 | C10 | C11 | 111.5° | 110.0° |
| C9 | C10 | C18 | 110.0° | 109.3° |
| C3 | O3 | C16 | 110.1° | 114.0° |
| O3 | C3 | H47 | 110.7° | 109.1° |
| O3 | C16 | H7 | 109.5° | 109.5° |
| O3 | C16 | H8 | 109.5° | 109.5° |
| O3 | C16 | H9 | 109.4° | 109.5° |
| O15 | C15 | C21 | 119.6° | 109.5° |
| O15 | C15 | C14 | 113.1° | 108.9° |
| O15 | C15 | H46 | 103.6° | 109.6° |
| C26 | C23 | C22 | 114.0° | 109.5° |
| C23 | C26 | C27 | 111.7° | 109.5° |
| C23 | C26 | H23 | 108.9° | 109.4° |
| C23 | C26 | H24 | 108.9° | 109.5° |
| C26 | C23 | H40 | 109.3° | 109.4° |
| C23 | C22 | C21 | 120.9° | 120.0° |
| C23 | C22 | H22 | 119.6° | 120.0° |
| C22 | C23 | H40 | 109.4° | 109.5° |
| C19 | C10 | C11 | 111.8° | 109.4° |
| C19 | C10 | C18 | 109.6° | 109.3° |
| C10 | C19 | H19 | 109.5° | 109.4° |
| C10 | C19 | H20 | 109.5° | 109.5° |
| C10 | C19 | H21 | 109.5° | 109.5° |
| C11 | C10 | C18 | 105.3° | 109.4° |
| C10 | C11 | C12 | 121.4° | 109.6° |
| C10 | C11 | O11 | 108.1° | 109.4° |
| C10 | C11 | H41 | 106.0° | 109.4° |
| C10 | C18 | H16 | 109.5° | 109.5° |
| C10 | C18 | H17 | 109.5° | 109.4° |
| C10 | C18 | H18 | 109.5° | 109.5° |
| C20 | O13 | C13 | 113.2° | 114.0° |
| O13 | C20 | H4 | 109.5° | 109.5° |
| O13 | C20 | H5 | 109.5° | 109.5° |
| O13 | C20 | H6 | 109.5° | 109.4° |
| O13 | C13 | C12 | 113.7° | 109.4° |
| O13 | C13 | C14 | 108.9° | 109.4° |
| O13 | C13 | H42 | 106.7° | 109.4° |
| C26 | C27 | H1 | 109.5° | 109.5° |
| C26 | C27 | H2 | 109.5° | 109.5° |
| C26 | C27 | H3 | 109.5° | 109.5° |
| C27 | C26 | H23 | 108.9° | 109.5° |
| C27 | C26 | H24 | 108.9° | 109.5° |
| C12 | C11 | O11 | 106.9° | 109.4° |
| C11 | C12 | C13 | 104.6° | 109.6° |
| C11 | C12 | H27 | 110.7° | 109.4° |
| C11 | C12 | H28 | 110.7° | 109.5° |
| C12 | C11 | H41 | 106.6° | 109.4° |
| C11 | O11 | H36 | 109.5° | 114.0° |
| O11 | C11 | H41 | 107.1° | 109.5° |
| C21 | C15 | C14 | 112.9° | 109.6° |
| C15 | C21 | C22 | 125.3° | 120.0° |
| C15 | C21 | C25 | 117.1° | 120.0° |
| C21 | C15 | H46 | 102.5° | 109.7° |
| C15 | C14 | C13 | 111.4° | 109.4° |
| C15 | C14 | H29 | 109.0° | 109.4° |
| C15 | C14 | H30 | 109.0° | 109.4° |
| C14 | C15 | H46 | 102.3° | 109.6° |
| C22 | C21 | C25 | 117.6° | 120.0° |
| C21 | C22 | H22 | 119.6° | 120.0° |
| C12 | C13 | C14 | 115.6° | 109.8° |
| C13 | C12 | H27 | 110.7° | 109.5° |
| C13 | C12 | H28 | 110.7° | 109.5° |
| C12 | C13 | H42 | 105.8° | 109.4° |
| C21 | C25 | H13 | 109.5° | 109.6° |
| C21 | C25 | H14 | 109.5° | 109.4° |
| C21 | C25 | H15 | 109.5° | 109.5° |
| C13 | C14 | H29 | 109.0° | 109.5° |
| C13 | C14 | H30 | 109.0° | 109.5° |
| C14 | C13 | H42 | 105.5° | 109.4° |
| H1 | C27 | H2 | 109.4° | 109.5° |
| H1 | C27 | H3 | 109.5° | 109.5° |
| H2 | C27 | H3 | 109.5° | 109.5° |
| H4 | C20 | H5 | 109.4° | 109.5° |
| H4 | C20 | H6 | 109.5° | 109.5° |
| H5 | C20 | H6 | 109.5° | 109.5° |
| H7 | C16 | H8 | 109.4° | 109.4° |
| H7 | C16 | H9 | 109.4° | 109.5° |
| H8 | C16 | H9 | 109.5° | 109.5° |
| H10 | C17 | H11 | 109.5° | 109.5° |
| H10 | C17 | H12 | 109.5° | 109.5° |
| H11 | C17 | H12 | 109.5° | 109.5° |
| H13 | C25 | H14 | 109.4° | 109.4° |
| H13 | C25 | H15 | 109.5° | 109.5° |
| H14 | C25 | H15 | 109.5° | 109.4° |
| H16 | C18 | H17 | 109.5° | 109.5° |
| H16 | C18 | H18 | 109.4° | 109.5° |
| H17 | C18 | H18 | 109.5° | 109.5° |
| H19 | C19 | H20 | 109.4° | 109.5° |
| H19 | C19 | H21 | 109.5° | 109.4° |
| H20 | C19 | H21 | 109.5° | 109.5° |
| H23 | C26 | H24 | 109.5° | 109.5° |
| H25 | C24 | H26 | 109.5° | 109.5° |
| H27 | C12 | H28 | 109.5° | 109.4° |
| H29 | C14 | H30 | 109.5° | 109.5° |
| H31 | C4 | H32 | 109.5° | 109.9° |
| H33 | C6 | H34 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | O7 | C7 | C6 | 178.4° | 90.0° |
| C17 | O7 | C7 | C8 | 56.5° | 150.0° |
| O7 | C17 | H10 | H11 | 120.0° | 120.0° |
| O7 | C17 | H10 | H12 | 120.0° | 120.0° |
| O7 | C17 | H11 | H12 | 120.0° | 120.0° |
| C17 | O7 | C7 | H48 | 60.4° | 30.0° |
| O7 | C7 | C6 | C8 | 125.8° | 120.0° |
| O7 | C7 | C6 | H48 | 118.8° | 120.0° |
| O7 | C7 | C8 | H48 | 117.6° | 120.0° |
| O7 | C7 | C6 | C5 | 174.1° | 176.4° |
| O7 | C7 | C8 | C9 | 172.8° | 176.5° |
| O7 | C7 | C8 | O8 | 66.5° | 56.6° |
| C7 | O7 | C17 | H10 | 180.0° | 60.0° |
| C7 | O7 | C17 | H11 | 60.0° | 180.0° |
| C7 | O7 | C17 | H12 | 60.0° | 60.0° |
| O7 | C7 | C6 | H33 | 66.3° | 63.7° |
| O7 | C7 | C6 | H34 | 54.4° | 56.4° |
| O7 | C7 | C8 | H45 | 53.6° | 63.6° |
| C6 | C7 | C8 | H48 | 115.5° | 120.0° |
| C7 | C6 | C5 | H33 | 119.6° | 120.0° |
| C7 | C6 | C5 | H34 | 119.6° | 120.0° |
| C7 | C6 | C5 | C4 | 179.9° | 174.5° |
| C7 | C6 | C5 | O9 | 52.7° | 56.4° |
| C6 | C7 | C8 | C9 | 60.3° | 56.5° |
| C6 | C7 | C8 | O8 | 60.4° | 63.4° |
| C7 | C6 | H33 | H34 | 121.1° | 120.1° |
| C7 | C6 | C5 | H43 | 63.7° | 65.1° |
| C6 | C7 | C8 | H45 | 179.5° | 176.4° |
| C8 | C7 | C6 | C5 | 60.1° | 56.4° |
| C7 | C8 | C9 | O91 | 61.8° | 63.5° |
| C7 | C8 | C9 | O8 | 119.2° | 119.9° |
| C7 | C8 | C9 | H45 | 118.8° | 120.0° |
| C7 | C8 | O8 | H45 | 119.1° | 120.3° |
| C7 | C8 | C9 | O9 | 51.5° | 57.1° |
| C7 | C8 | C9 | C10 | 179.5° | 176.4° |
| C8 | C7 | C6 | H33 | 59.5° | 176.4° |
| C8 | C7 | C6 | H34 | 179.8° | 63.6° |
| C7 | C8 | O8 | H38 | 180.0° | 60.4° |
| O2 | C2 | C1 | C3 | 118.8° | 119.7° |
| O2 | C2 | C1 | H44 | 121.0° | 120.6° |
| O2 | C2 | C3 | H44 | 119.6° | 120.7° |
| O2 | C2 | C1 | O1 | 17.4° | 66.6° |
| O2 | C2 | C3 | C4 | 60.8° | 76.7° |
| O2 | C2 | C1 | O15 | 162.2° | 113.5° |
| O2 | C2 | C3 | O3 | 58.4° | 43.6° |
| O2 | C2 | C3 | H47 | 179.9° | 163.0° |
| C6 | C5 | C4 | O9 | 128.8° | 119.0° |
| C6 | C5 | C4 | H43 | 116.6° | 120.5° |
| C6 | C5 | O9 | H43 | 115.9° | 121.1° |
| C6 | C5 | C4 | C3 | 179.4° | 102.6° |
| C6 | C5 | O9 | C9 | 48.2° | 60.1° |
| C6 | C5 | C4 | H31 | 60.9° | 17.0° |
| C6 | C5 | C4 | H32 | 59.7° | 137.9° |
| C5 | C6 | H33 | H34 | 121.1° | 120.0° |
| C5 | C6 | C7 | H48 | 55.3° | 63.6° |
| C4 | C5 | O9 | H43 | 113.8° | 120.0° |
| C5 | C4 | C3 | C2 | 60.4° | 168.2° |
| C5 | C4 | C3 | H31 | 119.7° | 119.6° |
| C5 | C4 | C3 | H32 | 119.7° | 119.5° |
| C4 | C5 | O9 | C9 | 178.5° | 178.9° |
| C5 | C4 | C3 | O3 | 179.2° | 71.5° |
| C5 | C4 | H31 | H32 | 120.8° | 120.9° |
| C4 | C5 | C6 | H33 | 60.2° | 65.6° |
| C4 | C5 | C6 | H34 | 60.5° | 54.4° |
| C5 | C4 | C3 | H47 | 59.1° | 47.9° |
| C5 | O9 | C9 | O91 | 67.4° | 60.0° |
| C5 | O9 | C9 | C8 | 47.2° | 60.6° |
| O9 | C5 | C4 | C3 | 51.8° | 16.4° |
| C5 | O9 | C9 | C10 | 179.7° | 179.9° |
| O9 | C5 | C4 | H31 | 67.9° | 136.0° |
| O9 | C5 | C4 | H32 | 171.5° | 103.1° |
| O9 | C5 | C6 | H33 | 67.0° | 176.4° |
| O9 | C5 | C6 | H34 | 172.3° | 63.6° |
| C1 | C2 | C3 | H44 | 121.0° | 119.7° |
| C2 | C1 | O1 | O15 | 179.5° | 180.0° |
| C1 | C2 | C3 | C4 | 179.8° | 163.7° |
| C1 | C2 | C3 | O3 | 61.0° | 76.0° |
| C2 | C1 | O15 | C15 | 180.0° | 175.6° |
| C1 | C2 | O2 | H37 | 7.6° | 60.0° |
| C1 | C2 | C3 | H47 | 60.5° | 43.4° |
| C3 | C2 | C1 | O1 | 136.2° | 173.8° |
| C2 | C3 | C4 | O3 | 118.8° | 120.3° |
| C2 | C3 | C4 | H47 | 119.5° | 120.3° |
| C3 | C2 | C1 | O15 | 43.4° | 6.2° |
| C2 | C3 | O3 | H47 | 121.0° | 119.5° |
| C2 | C3 | O3 | C16 | 177.8° | 69.0° |
| C2 | C3 | C4 | H31 | 179.9° | 72.2° |
| C2 | C3 | C4 | H32 | 59.3° | 48.7° |
| C3 | C2 | O2 | H37 | 127.0° | 178.6° |
| O24 | C24 | C23 | H25 | 119.8° | 120.0° |
| O24 | C24 | C23 | H26 | 119.8° | 120.0° |
| O24 | C24 | C23 | C26 | 60.9° | 175.0° |
| O24 | C24 | C23 | C22 | 176.3° | 65.0° |
| O24 | C24 | H25 | H26 | 120.7° | 120.0° |
| O24 | C24 | C23 | H40 | 56.7° | 55.0° |
| O91 | C9 | C8 | O9 | 113.2° | 120.6° |
| O91 | C9 | C8 | C10 | 117.7° | 120.1° |
| O91 | C9 | C8 | O8 | 179.1° | 176.6° |
| O91 | C9 | O9 | C10 | 112.9° | 119.9° |
| O91 | C9 | C10 | C19 | 73.0° | 38.7° |
| O91 | C9 | C10 | C11 | 50.5° | 158.9° |
| O91 | C9 | C10 | C18 | 167.0° | 81.0° |
| O91 | C9 | C8 | H45 | 57.1° | 56.5° |
| O1 | C1 | O15 | C15 | 0.4° | 4.4° |
| O1 | C1 | C2 | H44 | 103.6° | 54.1° |
| C9 | C8 | O8 | H45 | 121.3° | 120.1° |
| C8 | C9 | O9 | C10 | 132.5° | 119.5° |
| C8 | C9 | C10 | C19 | 44.9° | 158.8° |
| C8 | C9 | C10 | C11 | 168.4° | 81.0° |
| C8 | C9 | C10 | C18 | 75.1° | 39.1° |
| C9 | C8 | O8 | H38 | 60.4° | 180.0° |
| C8 | C9 | O91 | H39 | 180.0° | 60.0° |
| C9 | C8 | C7 | H48 | 55.1° | 63.5° |
| O8 | C8 | C9 | O9 | 67.7° | 62.8° |
| O8 | C8 | C9 | C10 | 61.3° | 56.5° |
| O8 | C8 | C7 | H48 | 175.9° | 176.6° |
| C4 | C3 | O3 | H47 | 120.9° | 119.5° |
| C4 | C3 | O3 | C16 | 64.1° | 52.0° |
| C3 | C4 | H31 | H32 | 120.8° | 120.9° |
| C3 | C4 | C5 | H43 | 62.8° | 136.9° |
| C4 | C3 | C2 | H44 | 58.8° | 44.0° |
| C1 | O15 | C15 | C21 | 60.6° | 94.7° |
| C1 | O15 | C15 | C14 | 162.6° | 145.5° |
| O15 | C1 | C2 | H44 | 76.8° | 125.9° |
| C1 | O15 | C15 | H46 | 52.6° | 25.6° |
| C24 | C23 | C26 | C22 | 119.5° | 120.0° |
| C24 | C23 | C26 | H40 | 117.8° | 120.0° |
| C24 | C23 | C22 | H40 | 119.7° | 120.1° |
| C24 | C23 | C26 | C27 | 179.1° | 65.0° |
| C24 | C23 | C22 | C21 | 130.6° | 113.3° |
| C24 | C23 | C22 | H22 | 49.4° | 66.6° |
| C24 | C23 | C26 | H23 | 60.5° | 55.0° |
| C24 | C23 | C26 | H24 | 58.8° | 175.0° |
| C23 | C24 | H25 | H26 | 120.7° | 120.1° |
| C23 | C24 | O24 | H35 | 180.0° | 179.9° |
| O9 | C9 | C10 | C19 | 175.3° | 81.2° |
| O9 | C9 | C10 | C11 | 61.2° | 39.0° |
| O9 | C9 | C10 | C18 | 55.3° | 159.1° |
| O9 | C9 | O91 | H39 | 60.7° | 60.8° |
| C9 | O9 | C5 | H43 | 67.7° | 61.1° |
| O9 | C9 | C8 | H45 | 170.3° | 177.1° |
| C9 | C10 | C19 | C11 | 123.4° | 120.5° |
| C9 | C10 | C19 | C18 | 120.2° | 119.7° |
| C9 | C10 | C11 | C18 | 119.3° | 120.1° |
| C9 | C10 | C11 | C12 | 59.7° | 109.4° |
| C9 | C10 | C11 | O11 | 176.4° | 10.6° |
| C9 | C10 | C18 | H16 | 180.0° | 59.7° |
| C9 | C10 | C18 | H17 | 60.0° | 60.2° |
| C9 | C10 | C18 | H18 | 60.0° | 179.8° |
| C9 | C10 | C19 | H19 | 180.0° | 60.6° |
| C9 | C10 | C19 | H20 | 60.0° | 59.5° |
| C9 | C10 | C19 | H21 | 60.0° | 179.5° |
| C10 | C9 | O91 | H39 | 55.2° | 179.8° |
| C9 | C10 | C11 | H41 | 61.8° | 130.6° |
| C10 | C9 | C8 | H45 | 60.6° | 63.6° |
| C3 | O3 | C16 | H7 | 180.0° | 41.8° |
| C3 | O3 | C16 | H8 | 60.0° | 78.1° |
| C3 | O3 | C16 | H9 | 60.0° | 161.9° |
| O3 | C3 | C4 | H31 | 61.1° | 48.0° |
| O3 | C3 | C4 | H32 | 59.5° | 169.0° |
| O3 | C3 | C2 | H44 | 178.0° | 164.3° |
| O3 | C16 | H7 | H8 | 120.0° | 120.0° |
| O3 | C16 | H7 | H9 | 120.0° | 120.0° |
| O3 | C16 | H8 | H9 | 120.0° | 120.0° |
| C16 | O3 | C3 | H47 | 56.8° | 171.5° |
| O15 | C15 | C21 | C14 | 136.9° | 119.4° |
| O15 | C15 | C21 | H46 | 113.7° | 120.3° |
| O15 | C15 | C14 | H46 | 110.7° | 119.8° |
| O15 | C15 | C21 | C22 | 109.3° | 137.8° |
| O15 | C15 | C21 | C25 | 69.8° | 42.3° |
| O15 | C15 | C14 | C13 | 39.3° | 46.6° |
| O15 | C15 | C14 | H29 | 81.0° | 73.4° |
| O15 | C15 | C14 | H30 | 159.6° | 166.5° |
| C26 | C23 | C22 | H40 | 122.6° | 119.9° |
| C23 | C26 | C27 | H23 | 120.3° | 120.0° |
| C23 | C26 | C27 | H24 | 120.3° | 120.0° |
| C26 | C23 | C22 | C21 | 111.6° | 126.7° |
| C23 | C26 | C27 | H1 | 180.0° | 60.0° |
| C23 | C26 | C27 | H2 | 60.0° | 180.0° |
| C23 | C26 | C27 | H3 | 60.0° | 60.0° |
| C26 | C23 | C22 | H22 | 68.3° | 53.4° |
| C23 | C26 | H23 | H24 | 118.9° | 120.0° |
| C26 | C23 | C24 | H25 | 179.3° | 65.0° |
| C26 | C23 | C24 | H26 | 58.9° | 55.0° |
| C22 | C23 | C26 | C27 | 61.4° | 175.0° |
| C23 | C22 | C21 | C15 | 0.0° | 6.2° |
| C23 | C22 | C21 | H22 | 180.0° | 179.9° |
| C23 | C22 | C21 | C25 | 179.0° | 173.7° |
| C22 | C23 | C26 | H23 | 59.0° | 65.0° |
| C22 | C23 | C26 | H24 | 178.3° | 55.0° |
| C22 | C23 | C24 | H25 | 56.5° | 55.0° |
| C22 | C23 | C24 | H26 | 64.0° | 175.0° |
| C19 | C10 | C11 | C18 | 119.0° | 119.7° |
| C19 | C10 | C11 | C12 | 178.6° | 10.8° |
| C19 | C10 | C11 | O11 | 54.6° | 130.8° |
| C19 | C10 | C18 | H16 | 60.7° | 60.0° |
| C19 | C10 | C18 | H17 | 59.3° | 180.0° |
| C19 | C10 | C18 | H18 | 179.3° | 60.0° |
| C10 | C19 | H19 | H20 | 120.0° | 120.0° |
| C10 | C19 | H19 | H21 | 120.0° | 120.0° |
| C10 | C19 | H20 | H21 | 120.0° | 120.0° |
| C19 | C10 | C11 | H41 | 59.9° | 109.3° |
| C10 | C11 | C12 | O11 | 124.4° | 120.0° |
| C10 | C11 | C12 | H41 | 121.2° | 120.0° |
| C10 | C11 | O11 | H41 | 113.8° | 119.9° |
| C10 | C11 | C12 | C13 | 179.7° | 173.3° |
| C11 | C10 | C18 | H16 | 59.8° | 179.8° |
| C11 | C10 | C18 | H17 | 179.8° | 60.2° |
| C11 | C10 | C18 | H18 | 60.2° | 59.8° |
| C11 | C10 | C19 | H19 | 56.6° | 60.0° |
| C11 | C10 | C19 | H20 | 63.4° | 180.0° |
| C11 | C10 | C19 | H21 | 176.6° | 60.0° |
| C10 | C11 | C12 | H27 | 60.4° | 66.7° |
| C10 | C11 | C12 | H28 | 61.1° | 53.2° |
| C10 | C11 | O11 | H36 | 180.0° | 172.9° |
| C18 | C10 | C11 | C12 | 59.6° | 130.5° |
| C18 | C10 | C11 | O11 | 64.4° | 109.5° |
| C10 | C18 | H16 | H17 | 120.0° | 120.0° |
| C10 | C18 | H16 | H18 | 120.0° | 120.0° |
| C10 | C18 | H17 | H18 | 120.0° | 120.0° |
| C18 | C10 | C19 | H19 | 59.8° | 179.7° |
| C18 | C10 | C19 | H20 | 179.8° | 60.2° |
| C18 | C10 | C19 | H21 | 60.2° | 59.8° |
| C18 | C10 | C11 | H41 | 178.9° | 10.5° |
| C20 | O13 | C13 | C12 | 164.6° | 153.5° |
| C20 | O13 | C13 | C14 | 65.0° | 86.2° |
| O13 | C20 | H4 | H5 | 120.0° | 120.0° |
| O13 | C20 | H4 | H6 | 120.0° | 120.0° |
| O13 | C20 | H5 | H6 | 120.0° | 119.9° |
| C20 | O13 | C13 | H42 | 48.4° | 33.6° |
| O13 | C13 | C12 | C11 | 59.8° | 75.0° |
| O13 | C13 | C14 | C15 | 59.4° | 132.8° |
| O13 | C13 | C12 | C14 | 126.9° | 120.1° |
| O13 | C13 | C12 | H42 | 116.7° | 119.9° |
| O13 | C13 | C14 | H42 | 114.2° | 119.8° |
| C13 | O13 | C20 | H4 | 180.0° | 175.3° |
| C13 | O13 | C20 | H5 | 60.0° | 64.6° |
| C13 | O13 | C20 | H6 | 60.0° | 55.3° |
| O13 | C13 | C12 | H27 | 179.0° | 164.9° |
| O13 | C13 | C12 | H28 | 59.4° | 45.0° |
| O13 | C13 | C14 | H29 | 179.7° | 107.2° |
| O13 | C13 | C14 | H30 | 60.8° | 12.9° |
| C26 | C27 | H1 | H2 | 120.0° | 120.0° |
| C26 | C27 | H1 | H3 | 120.0° | 120.0° |
| C26 | C27 | H2 | H3 | 120.0° | 120.0° |
| C27 | C26 | H23 | H24 | 119.0° | 120.0° |
| C27 | C26 | C23 | H40 | 61.3° | 55.0° |
| C12 | C11 | O11 | H41 | 114.0° | 120.0° |
| C11 | C12 | C13 | H27 | 119.2° | 120.0° |
| C11 | C12 | C13 | H28 | 119.2° | 120.1° |
| C11 | C12 | C13 | C14 | 173.3° | 164.9° |
| C11 | C12 | H27 | H28 | 122.2° | 119.9° |
| C12 | C11 | O11 | H36 | 47.7° | 67.0° |
| C11 | C12 | C13 | H42 | 56.9° | 44.9° |
| O11 | C11 | C12 | C13 | 55.2° | 66.7° |
| O11 | C11 | C12 | H27 | 64.0° | 53.3° |
| O11 | C11 | C12 | H28 | 174.5° | 173.2° |
| C21 | C15 | C14 | H46 | 109.5° | 120.4° |
| C15 | C21 | C22 | C25 | 179.1° | 179.9° |
| C21 | C15 | C14 | C13 | 179.0° | 73.2° |
| C15 | C21 | C25 | H13 | 180.0° | 86.0° |
| C15 | C21 | C25 | H14 | 60.0° | 34.0° |
| C15 | C21 | C25 | H15 | 60.0° | 154.0° |
| C15 | C21 | C22 | H22 | 179.9° | 173.7° |
| C21 | C15 | C14 | H29 | 58.8° | 166.8° |
| C21 | C15 | C14 | H30 | 60.6° | 46.7° |
| C14 | C15 | C21 | C22 | 113.8° | 102.8° |
| C15 | C14 | C13 | C12 | 69.9° | 107.1° |
| C14 | C15 | C21 | C25 | 67.1° | 77.1° |
| C15 | C14 | C13 | H29 | 120.3° | 120.0° |
| C15 | C14 | C13 | H30 | 120.3° | 119.9° |
| C15 | C14 | H29 | H30 | 119.1° | 120.0° |
| C15 | C14 | C13 | H42 | 173.6° | 13.0° |
| C22 | C21 | C25 | H13 | 0.9° | 93.9° |
| C22 | C21 | C25 | H14 | 120.8° | 146.1° |
| C22 | C21 | C25 | H15 | 119.1° | 26.2° |
| C21 | C22 | C23 | H40 | 11.0° | 6.8° |
| C22 | C21 | C15 | H46 | 4.4° | 17.5° |
| C12 | C13 | C14 | H42 | 116.5° | 120.1° |
| C13 | C12 | H27 | H28 | 122.3° | 119.9° |
| C12 | C13 | C14 | H29 | 50.4° | 12.9° |
| C12 | C13 | C14 | H30 | 169.8° | 133.0° |
| C13 | C12 | C11 | H41 | 59.1° | 53.3° |
| C21 | C25 | H13 | H14 | 120.0° | 120.0° |
| C21 | C25 | H13 | H15 | 120.0° | 120.1° |
| C21 | C25 | H14 | H15 | 120.0° | 120.0° |
| C25 | C21 | C22 | H22 | 1.0° | 6.4° |
| C25 | C21 | C15 | H46 | 176.5° | 162.6° |
| C14 | C13 | C12 | H27 | 54.0° | 44.9° |
| C14 | C13 | C12 | H28 | 67.5° | 75.0° |
| C13 | C14 | H29 | H30 | 119.2° | 120.1° |
| C13 | C14 | C15 | H46 | 71.5° | 166.4° |
| H1 | C27 | H2 | H3 | 120.0° | 120.0° |
| H1 | C27 | C26 | H23 | 59.7° | 180.0° |
| H1 | C27 | C26 | H24 | 59.7° | 60.0° |
| H2 | C27 | C26 | H23 | 179.7° | 60.0° |
| H2 | C27 | C26 | H24 | 60.3° | 60.0° |
| H3 | C27 | C26 | H23 | 60.3° | 60.0° |
| H3 | C27 | C26 | H24 | 179.7° | 180.0° |
| H4 | C20 | H5 | H6 | 120.0° | 120.0° |
| H7 | C16 | H8 | H9 | 120.0° | 120.0° |
| H10 | C17 | H11 | H12 | 120.0° | 120.0° |
| H13 | C25 | H14 | H15 | 120.0° | 120.0° |
| H16 | C18 | H17 | H18 | 120.0° | 120.0° |
| H19 | C19 | H20 | H21 | 120.0° | 120.0° |
| H22 | C22 | C23 | H40 | 169.0° | 173.4° |
| H23 | C26 | C23 | H40 | 178.3° | 175.0° |
| H24 | C26 | C23 | H40 | 59.0° | 65.0° |
| H25 | C24 | O24 | H35 | 60.2° | 60.1° |
| H25 | C24 | C23 | H40 | 63.1° | 175.0° |
| H26 | C24 | O24 | H35 | 60.2° | 59.9° |
| H26 | C24 | C23 | H40 | 176.5° | 64.9° |
| H27 | C12 | C11 | H41 | 178.3° | 173.3° |
| H27 | C12 | C13 | H42 | 62.3° | 75.2° |
| H28 | C12 | C11 | H41 | 60.1° | 66.8° |
| H28 | C12 | C13 | H42 | 176.1° | 164.9° |
| H29 | C14 | C13 | H42 | 66.1° | 133.0° |
| H29 | C14 | C15 | H46 | 168.3° | 46.4° |
| H30 | C14 | C13 | H42 | 53.3° | 106.9° |
| H30 | C14 | C15 | H46 | 48.9° | 73.6° |
| H31 | C4 | C5 | H43 | 177.5° | 103.6° |
| H31 | C4 | C3 | H47 | 60.6° | 167.4° |
| H32 | C4 | C5 | H43 | 56.9° | 17.4° |
| H32 | C4 | C3 | H47 | 178.8° | 71.6° |
| H33 | C6 | C5 | H43 | 176.7° | 54.9° |
| H33 | C6 | C7 | H48 | 174.9° | 56.4° |
| H34 | C6 | C5 | H43 | 55.9° | 174.9° |
| H34 | C6 | C7 | H48 | 64.3° | 176.4° |
| H36 | O11 | C11 | H41 | 66.2° | 53.0° |
| H37 | O2 | C2 | H44 | 113.9° | 60.7° |
| H38 | O8 | C8 | H45 | 60.9° | 59.9° |
| H44 | C2 | C3 | H47 | 60.5° | 76.3° |
| H45 | C8 | C7 | H48 | 64.0° | 56.4° |
