EFO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2A | C23 | sing | 1.56Å | 1.54Å | |
| C2B | C25 | sing | 1.48Å | 1.54Å | |
| O25 | C25 | sing | 1.38Å | 1.42Å | |
| C23 | C22 | sing | 1.57Å | 1.55Å | |
| C23 | C24 | sing | 1.45Å | 1.56Å | |
| C2D | C29 | sing | 1.51Å | 1.54Å | |
| C22 | C21 | sing | 1.49Å | 1.40Å | |
| C25 | C24 | sing | 1.56Å | 1.57Å | |
| C25 | C26 | sing | 1.55Å | 1.42Å | |
| C24 | O24 | sing | 1.47Å | 1.45Å | |
| C29 | C30 | sing | 1.45Å | 1.42Å | |
| C29 | C28 | sing | 1.56Å | 1.55Å | |
| C21 | C20 | doub | 1.36Å | 1.39Å | |
| O30 | C30 | doub | 1.26Å | 1.23Å | |
| C26 | C27 | sing | 1.43Å | 1.43Å | |
| C26 | O26 | doub | 1.27Å | 1.23Å | |
| C30 | C31 | sing | 1.58Å | 1.41Å | |
| C27 | C28 | sing | 1.57Å | 1.55Å | |
| C27 | C2C | sing | 1.49Å | 1.55Å | |
| C3A | C31 | sing | 1.47Å | 1.54Å | |
| C28 | O28 | sing | 1.31Å | 1.43Å | |
| C20 | C19 | sing | 1.48Å | 1.41Å | |
| C31 | C32 | sing | 1.49Å | 1.57Å | |
| O32 | C32 | sing | 1.41Å | 1.46Å | |
| C19 | C18 | doub | 1.35Å | 1.40Å | |
| C32 | C33 | sing | 1.61Å | 1.55Å | |
| C18 | C17 | sing | 1.50Å | 1.42Å | |
| C33 | C34 | sing | 1.48Å | 1.39Å | |
| C33 | C3B | sing | 1.48Å | 1.54Å | |
| C1B | C12 | sing | 1.53Å | 1.55Å | |
| C34 | C35 | doub | 1.30Å | 1.39Å | |
| C17 | C1C | sing | 1.53Å | 1.54Å | |
| C17 | C16 | sing | 1.54Å | 1.54Å | |
| C35 | C36 | sing | 1.44Å | 1.39Å | |
| C1D | C1C | sing | 1.53Å | 1.53Å | |
| C15 | C16 | sing | 1.55Å | 1.53Å | |
| C15 | C13 | sing | 1.56Å | 1.53Å | |
| C12 | C13 | sing | 1.51Å | 1.56Å | |
| C12 | C11 | sing | 1.55Å | 1.55Å | |
| C36 | O36 | doub | 1.25Å | 1.23Å | |
| C36 | O37 | sing | 1.40Å | 1.37Å | |
| O37 | C11 | sing | 1.48Å | 1.42Å | |
| C13 | O14 | sing | 1.44Å | 1.46Å | |
| C11 | C10 | sing | 1.51Å | 1.55Å | |
| O14 | C8 | sing | 1.41Å | 1.45Å | |
| C10 | C8 | sing | 1.56Å | 1.54Å | |
| C10 | C1A | sing | 1.56Å | 1.55Å | |
| C8 | C7 | sing | 1.58Å | 1.56Å | |
| C8 | O9 | sing | 1.38Å | 1.47Å | |
| O2 | C2 | sing | 1.43Å | 1.44Å | |
| C7 | C6 | sing | 1.60Å | 1.54Å | |
| O9 | C4 | sing | 1.42Å | 1.45Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| C2 | C3 | sing | 1.53Å | 1.53Å | |
| C4 | C3 | sing | 1.50Å | 1.55Å | |
| C4 | C5 | sing | 1.47Å | 1.53Å | |
| C6 | C5 | sing | 1.52Å | 1.56Å | |
| C5 | C51 | sing | 1.55Å | 1.54Å | |
| C1A | H1 | sing | 1.09Å | 1.10Å | |
| C1A | H2 | sing | 1.09Å | 1.10Å | |
| C1A | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.01Å | 1.10Å | |
| C11 | H5 | sing | 1.12Å | 1.10Å | |
| C12 | H6 | sing | 1.08Å | 1.10Å | |
| C1B | H7 | sing | 1.09Å | 1.10Å | |
| C1B | H8 | sing | 1.09Å | 1.10Å | |
| C1B | H9 | sing | 1.09Å | 1.10Å | |
| C35 | H10 | sing | 1.06Å | 1.08Å | |
| C34 | H11 | sing | 1.12Å | 1.08Å | |
| C33 | H12 | sing | 1.08Å | 1.10Å | |
| C3B | H13 | sing | 1.09Å | 1.10Å | |
| C3B | H14 | sing | 1.09Å | 1.10Å | |
| C3B | H15 | sing | 1.09Å | 1.10Å | |
| C32 | H16 | sing | 1.10Å | 1.10Å | |
| O32 | H17 | sing | 0.97Å | 0.95Å | |
| C31 | H18 | sing | 1.02Å | 1.10Å | |
| C3A | H19 | sing | 1.09Å | 1.10Å | |
| C3A | H20 | sing | 1.09Å | 1.10Å | |
| C3A | H21 | sing | 1.09Å | 1.10Å | |
| C29 | H22 | sing | 1.11Å | 1.10Å | |
| C2D | H23 | sing | 1.09Å | 1.10Å | |
| C2D | H24 | sing | 1.09Å | 1.10Å | |
| C2D | H25 | sing | 1.09Å | 1.10Å | |
| C28 | H26 | sing | 1.13Å | 1.10Å | |
| O28 | H27 | sing | 0.97Å | 0.95Å | |
| C27 | H28 | sing | 1.10Å | 1.10Å | |
| C2C | H29 | sing | 1.09Å | 1.10Å | |
| C2C | H30 | sing | 1.09Å | 1.10Å | |
| C2C | H31 | sing | 1.09Å | 1.10Å | |
| C2B | H32 | sing | 1.09Å | 1.10Å | |
| C2B | H33 | sing | 1.09Å | 1.10Å | |
| C2B | H34 | sing | 1.09Å | 1.10Å | |
| O25 | H35 | sing | 0.97Å | 0.95Å | |
| C24 | H36 | sing | 1.11Å | 1.10Å | |
| O24 | H37 | sing | 0.97Å | 0.95Å | |
| C23 | H38 | sing | 1.09Å | 1.10Å | |
| C2A | H39 | sing | 1.09Å | 1.10Å | |
| C2A | H40 | sing | 1.09Å | 1.10Å | |
| C2A | H41 | sing | 1.09Å | 1.10Å | |
| C22 | H42 | sing | 1.15Å | 1.10Å | |
| C22 | H43 | sing | 0.99Å | 1.10Å | |
| C21 | H44 | sing | 1.08Å | 1.08Å | |
| C20 | H45 | sing | 1.09Å | 1.08Å | |
| C19 | H46 | sing | 1.02Å | 1.08Å | |
| C18 | H47 | sing | 1.09Å | 1.08Å | |
| C17 | H48 | sing | 1.10Å | 1.10Å | |
| C1C | H49 | sing | 1.09Å | 1.10Å | |
| C1C | H50 | sing | 1.09Å | 1.10Å | |
| C1D | H51 | sing | 1.09Å | 1.10Å | |
| C1D | H52 | sing | 1.09Å | 1.10Å | |
| C1D | H53 | sing | 1.09Å | 1.10Å | |
| C16 | H54 | sing | 1.00Å | 1.10Å | |
| C16 | H55 | sing | 1.16Å | 1.10Å | |
| C15 | H56 | sing | 1.04Å | 1.10Å | |
| C15 | H57 | sing | 1.11Å | 1.10Å | |
| C13 | H58 | sing | 1.07Å | 1.10Å | |
| C7 | H59 | sing | 1.08Å | 1.10Å | |
| C7 | H60 | sing | 1.11Å | 1.10Å | |
| C6 | H61 | sing | 1.07Å | 1.10Å | |
| C6 | H62 | sing | 1.14Å | 1.10Å | |
| C5 | H63 | sing | 1.11Å | 1.10Å | |
| C51 | H64 | sing | 1.09Å | 1.10Å | |
| C51 | H65 | sing | 1.09Å | 1.10Å | |
| C51 | H66 | sing | 1.09Å | 1.10Å | |
| C4 | H67 | sing | 1.08Å | 1.10Å | |
| C3 | H68 | sing | 1.09Å | 1.10Å | |
| C3 | H69 | sing | 1.09Å | 1.10Å | |
| C2 | H70 | sing | 1.09Å | 1.10Å | |
| C1 | H71 | sing | 1.09Å | 1.10Å | |
| C1 | H72 | sing | 1.09Å | 1.10Å | |
| C1 | H73 | sing | 1.09Å | 1.10Å | |
| O2 | H74 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2A | C23 | C22 | 110.1° | 109.9° |
| C2A | C23 | C24 | 112.1° | 113.0° |
| C2A | C23 | H38 | 108.3° | 106.7° |
| C23 | C2A | H39 | 109.5° | 109.5° |
| C23 | C2A | H40 | 109.4° | 109.5° |
| C23 | C2A | H41 | 109.5° | 109.5° |
| C2B | C25 | O25 | 107.9° | 114.7° |
| C2B | C25 | C24 | 111.4° | 108.8° |
| C2B | C25 | C26 | 109.4° | 111.1° |
| C25 | C2B | H32 | 109.5° | 109.5° |
| C25 | C2B | H33 | 109.4° | 109.5° |
| C25 | C2B | H34 | 109.5° | 109.5° |
| O25 | C25 | C24 | 109.2° | 106.9° |
| O25 | C25 | C26 | 111.0° | 107.1° |
| C25 | O25 | H35 | 109.5° | 114.0° |
| C22 | C23 | C24 | 109.8° | 108.7° |
| C23 | C22 | C21 | 110.4° | 107.9° |
| C22 | C23 | H38 | 108.3° | 106.0° |
| C23 | C22 | H42 | 109.2° | 108.1° |
| C23 | C22 | H43 | 109.2° | 109.3° |
| C23 | C24 | C25 | 115.6° | 111.4° |
| C23 | C24 | O24 | 110.1° | 108.2° |
| C23 | C24 | H36 | 106.6° | 113.2° |
| C24 | C23 | H38 | 108.1° | 112.4° |
| C2D | C29 | C30 | 110.5° | 110.3° |
| C2D | C29 | C28 | 111.8° | 115.0° |
| C2D | C29 | H22 | 107.7° | 106.6° |
| C29 | C2D | H23 | 109.5° | 109.5° |
| C29 | C2D | H24 | 109.5° | 109.5° |
| C29 | C2D | H25 | 109.5° | 109.5° |
| C22 | C21 | C20 | 123.5° | 120.1° |
| C21 | C22 | H42 | 109.3° | 104.4° |
| C21 | C22 | H43 | 109.2° | 112.7° |
| C22 | C21 | H44 | 118.2° | 124.4° |
| C24 | C25 | C26 | 108.0° | 107.9° |
| C25 | C24 | O24 | 109.8° | 106.7° |
| C25 | C24 | H36 | 106.5° | 108.6° |
| C25 | C26 | C27 | 122.1° | 122.4° |
| C25 | C26 | O26 | 118.3° | 114.3° |
| O24 | C24 | H36 | 107.9° | 108.4° |
| C24 | O24 | H37 | 109.5° | 114.0° |
| C30 | C29 | C28 | 109.9° | 109.4° |
| C29 | C30 | O30 | 119.9° | 118.9° |
| C29 | C30 | C31 | 120.8° | 124.4° |
| C30 | C29 | H22 | 109.3° | 105.7° |
| C29 | C28 | C27 | 113.7° | 112.2° |
| C29 | C28 | O28 | 109.0° | 111.0° |
| C28 | C29 | H22 | 107.6° | 109.5° |
| C29 | C28 | H26 | 107.5° | 104.5° |
| C21 | C20 | C19 | 120.7° | 124.6° |
| C20 | C21 | H44 | 118.2° | 115.3° |
| C21 | C20 | H45 | 119.6° | 118.3° |
| O30 | C30 | C31 | 119.3° | 116.6° |
| C27 | C26 | O26 | 119.6° | 122.9° |
| C26 | C27 | C28 | 112.5° | 111.7° |
| C26 | C27 | C2C | 110.7° | 113.5° |
| C26 | C27 | H28 | 109.7° | 109.5° |
| C30 | C31 | C3A | 109.0° | 110.3° |
| C30 | C31 | C32 | 110.6° | 105.6° |
| C30 | C31 | H18 | 109.8° | 106.3° |
| C28 | C27 | C2C | 107.5° | 113.1° |
| C27 | C28 | O28 | 109.9° | 111.5° |
| C27 | C28 | H26 | 107.5° | 105.8° |
| C28 | C27 | H28 | 108.1° | 103.5° |
| C2C | C27 | H28 | 108.2° | 104.7° |
| C27 | C2C | H29 | 109.5° | 109.5° |
| C27 | C2C | H30 | 109.5° | 109.5° |
| C27 | C2C | H31 | 109.5° | 109.5° |
| C3A | C31 | C32 | 111.7° | 109.3° |
| C3A | C31 | H18 | 108.0° | 111.8° |
| C31 | C3A | H19 | 109.5° | 109.5° |
| C31 | C3A | H20 | 109.4° | 109.5° |
| C31 | C3A | H21 | 109.5° | 109.5° |
| O28 | C28 | H26 | 109.0° | 111.5° |
| C28 | O28 | H27 | 109.5° | 114.0° |
| C20 | C19 | C18 | 122.5° | 119.4° |
| C19 | C20 | H45 | 119.7° | 117.1° |
| C20 | C19 | H46 | 118.8° | 114.7° |
| C31 | C32 | O32 | 109.9° | 109.2° |
| C31 | C32 | C33 | 113.3° | 110.1° |
| C31 | C32 | H16 | 107.2° | 112.0° |
| C32 | C31 | H18 | 107.6° | 113.2° |
| O32 | C32 | C33 | 110.4° | 107.9° |
| O32 | C32 | H16 | 108.5° | 109.6° |
| C32 | O32 | H17 | 109.5° | 114.0° |
| C19 | C18 | C17 | 121.4° | 119.6° |
| C18 | C19 | H46 | 118.8° | 125.7° |
| C19 | C18 | H47 | 119.3° | 119.2° |
| C32 | C33 | C34 | 110.8° | 109.4° |
| C32 | C33 | C3B | 110.8° | 109.9° |
| C32 | C33 | H12 | 107.9° | 106.1° |
| C33 | C32 | H16 | 107.4° | 108.0° |
| C18 | C17 | C1C | 113.2° | 106.3° |
| C18 | C17 | C16 | 110.6° | 105.9° |
| C17 | C18 | H47 | 119.3° | 121.2° |
| C18 | C17 | H48 | 110.1° | 113.2° |
| C34 | C33 | C3B | 109.2° | 109.9° |
| C33 | C34 | C35 | 119.0° | 123.2° |
| C33 | C34 | H11 | 120.5° | 116.2° |
| C34 | C33 | H12 | 110.1° | 110.3° |
| C3B | C33 | H12 | 108.0° | 111.1° |
| C33 | C3B | H13 | 109.5° | 109.5° |
| C33 | C3B | H14 | 109.5° | 109.5° |
| C33 | C3B | H15 | 109.5° | 109.5° |
| C1B | C12 | C13 | 112.7° | 110.3° |
| C1B | C12 | C11 | 111.2° | 109.2° |
| C1B | C12 | H6 | 108.0° | 105.8° |
| C12 | C1B | H7 | 109.5° | 109.4° |
| C12 | C1B | H8 | 109.5° | 109.4° |
| C12 | C1B | H9 | 109.4° | 109.5° |
| C34 | C35 | C36 | 120.9° | 119.1° |
| C34 | C35 | H10 | 119.5° | 122.3° |
| C35 | C34 | H11 | 120.5° | 120.5° |
| C1C | C17 | C16 | 105.8° | 112.6° |
| C17 | C1C | C1D | 112.4° | 109.5° |
| C1C | C17 | H48 | 108.5° | 109.6° |
| C17 | C1C | H49 | 108.7° | 109.5° |
| C17 | C1C | H50 | 108.7° | 109.5° |
| C17 | C16 | C15 | 111.1° | 109.6° |
| C16 | C17 | H48 | 108.5° | 109.3° |
| C17 | C16 | H54 | 109.0° | 110.5° |
| C17 | C16 | H55 | 109.0° | 109.1° |
| C35 | C36 | O36 | 118.3° | 119.7° |
| C35 | C36 | O37 | 117.4° | 120.5° |
| C36 | C35 | H10 | 119.6° | 118.6° |
| C1D | C1C | H49 | 108.7° | 109.5° |
| C1D | C1C | H50 | 108.7° | 109.5° |
| C1C | C1D | H51 | 109.5° | 109.5° |
| C1C | C1D | H52 | 109.5° | 109.5° |
| C1C | C1D | H53 | 109.5° | 109.5° |
| C16 | C15 | C13 | 109.9° | 105.1° |
| C15 | C16 | H54 | 109.1° | 112.9° |
| C15 | C16 | H55 | 109.0° | 106.7° |
| C16 | C15 | H56 | 109.4° | 113.5° |
| C16 | C15 | H57 | 109.4° | 106.8° |
| C15 | C13 | C12 | 112.3° | 112.1° |
| C15 | C13 | O14 | 109.2° | 107.2° |
| C13 | C15 | H56 | 109.4° | 115.6° |
| C13 | C15 | H57 | 109.4° | 109.7° |
| C15 | C13 | H58 | 108.0° | 110.4° |
| C13 | C12 | C11 | 109.1° | 108.6° |
| C12 | C13 | O14 | 110.8° | 107.6° |
| C13 | C12 | H6 | 107.8° | 109.7° |
| C12 | C13 | H58 | 107.6° | 108.3° |
| C12 | C11 | O37 | 111.0° | 106.9° |
| C12 | C11 | C10 | 111.2° | 109.5° |
| C12 | C11 | H5 | 108.5° | 104.9° |
| C11 | C12 | H6 | 107.9° | 113.1° |
| O36 | C36 | O37 | 124.3° | 119.7° |
| C36 | O37 | C11 | 117.9° | 113.9° |
| O37 | C11 | C10 | 107.4° | 107.6° |
| O37 | C11 | H5 | 110.3° | 112.1° |
| C13 | O14 | C8 | 115.0° | 112.3° |
| O14 | C13 | H58 | 108.9° | 111.3° |
| C11 | C10 | C8 | 110.4° | 107.2° |
| C11 | C10 | C1A | 109.8° | 106.2° |
| C11 | C10 | H4 | 108.0° | 112.6° |
| C10 | C11 | H5 | 108.4° | 115.4° |
| O14 | C8 | C10 | 109.4° | 109.6° |
| O14 | C8 | C7 | 106.8° | 110.9° |
| O14 | C8 | O9 | 111.7° | 110.4° |
| C8 | C10 | C1A | 112.3° | 108.6° |
| C10 | C8 | C7 | 109.7° | 106.5° |
| C10 | C8 | O9 | 108.3° | 113.1° |
| C8 | C10 | H4 | 108.2° | 112.4° |
| C10 | C1A | H1 | 109.5° | 109.5° |
| C10 | C1A | H2 | 109.5° | 109.5° |
| C10 | C1A | H3 | 109.5° | 109.5° |
| C1A | C10 | H4 | 108.1° | 109.6° |
| C7 | C8 | O9 | 110.9° | 106.4° |
| C8 | C7 | C6 | 111.1° | 107.1° |
| C8 | C7 | H59 | 109.1° | 111.2° |
| C8 | C7 | H60 | 109.1° | 104.5° |
| C8 | O9 | C4 | 114.6° | 116.8° |
| O2 | C2 | C1 | 110.5° | 109.5° |
| O2 | C2 | C3 | 108.4° | 109.5° |
| O2 | C2 | H70 | 110.2° | 109.5° |
| C2 | O2 | H74 | 109.5° | 114.0° |
| C7 | C6 | C5 | 111.4° | 108.4° |
| C6 | C7 | H59 | 109.0° | 108.7° |
| C6 | C7 | H60 | 109.1° | 109.2° |
| C7 | C6 | H61 | 109.0° | 106.1° |
| C7 | C6 | H62 | 109.0° | 106.4° |
| O9 | C4 | C3 | 111.5° | 110.8° |
| O9 | C4 | C5 | 108.6° | 109.6° |
| O9 | C4 | H67 | 108.8° | 106.7° |
| C1 | C2 | C3 | 110.1° | 109.5° |
| C1 | C2 | H70 | 108.8° | 109.5° |
| C2 | C1 | H71 | 109.5° | 109.5° |
| C2 | C1 | H72 | 109.5° | 109.5° |
| C2 | C1 | H73 | 109.5° | 109.5° |
| C2 | C3 | C4 | 108.9° | 109.5° |
| C2 | C3 | H68 | 109.6° | 109.5° |
| C2 | C3 | H69 | 109.6° | 109.5° |
| C3 | C2 | H70 | 108.9° | 109.4° |
| C3 | C4 | C5 | 112.5° | 109.4° |
| C3 | C4 | H67 | 107.6° | 108.8° |
| C4 | C3 | H68 | 109.6° | 109.5° |
| C4 | C3 | H69 | 109.6° | 109.4° |
| C4 | C5 | C6 | 108.4° | 112.0° |
| C4 | C5 | C51 | 111.4° | 112.3° |
| C4 | C5 | H63 | 109.0° | 107.4° |
| C5 | C4 | H67 | 107.8° | 111.5° |
| C6 | C5 | C51 | 110.6° | 110.7° |
| C5 | C6 | H61 | 109.0° | 114.5° |
| C5 | C6 | H62 | 109.0° | 114.1° |
| C6 | C5 | H63 | 108.6° | 106.2° |
| C51 | C5 | H63 | 108.8° | 107.9° |
| C5 | C51 | H64 | 109.5° | 109.5° |
| C5 | C51 | H65 | 109.4° | 109.5° |
| C5 | C51 | H66 | 109.4° | 109.5° |
| H1 | C1A | H2 | 109.5° | 109.5° |
| H1 | C1A | H3 | 109.5° | 109.4° |
| H2 | C1A | H3 | 109.4° | 109.4° |
| H7 | C1B | H8 | 109.5° | 109.5° |
| H7 | C1B | H9 | 109.5° | 109.4° |
| H8 | C1B | H9 | 109.5° | 109.5° |
| H13 | C3B | H14 | 109.5° | 109.5° |
| H13 | C3B | H15 | 109.5° | 109.5° |
| H14 | C3B | H15 | 109.5° | 109.4° |
| H19 | C3A | H20 | 109.5° | 109.4° |
| H19 | C3A | H21 | 109.4° | 109.5° |
| H20 | C3A | H21 | 109.5° | 109.5° |
| H23 | C2D | H24 | 109.5° | 109.4° |
| H23 | C2D | H25 | 109.5° | 109.5° |
| H24 | C2D | H25 | 109.5° | 109.5° |
| H29 | C2C | H30 | 109.5° | 109.4° |
| H29 | C2C | H31 | 109.5° | 109.5° |
| H30 | C2C | H31 | 109.4° | 109.5° |
| H32 | C2B | H33 | 109.5° | 109.5° |
| H32 | C2B | H34 | 109.5° | 109.4° |
| H33 | C2B | H34 | 109.4° | 109.4° |
| H39 | C2A | H40 | 109.5° | 109.4° |
| H39 | C2A | H41 | 109.5° | 109.5° |
| H40 | C2A | H41 | 109.5° | 109.5° |
| H42 | C22 | H43 | 109.5° | 114.2° |
| H49 | C1C | H50 | 109.5° | 109.4° |
| H51 | C1D | H52 | 109.5° | 109.4° |
| H51 | C1D | H53 | 109.4° | 109.4° |
| H52 | C1D | H53 | 109.5° | 109.4° |
| H54 | C16 | H55 | 109.5° | 107.9° |
| H56 | C15 | H57 | 109.4° | 105.8° |
| H59 | C7 | H60 | 109.5° | 115.9° |
| H61 | C6 | H62 | 109.4° | 106.7° |
| H64 | C51 | H65 | 109.5° | 109.4° |
| H64 | C51 | H66 | 109.5° | 109.5° |
| H65 | C51 | H66 | 109.5° | 109.5° |
| H68 | C3 | H69 | 109.5° | 109.5° |
| H71 | C1 | H72 | 109.4° | 109.5° |
| H71 | C1 | H73 | 109.5° | 109.4° |
| H72 | C1 | H73 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2A | C23 | C22 | C24 | 124.0° | 124.1° |
| C2A | C23 | C22 | H38 | 118.3° | 114.9° |
| C2A | C23 | C24 | H38 | 119.3° | 120.8° |
| C2A | C23 | C22 | C21 | 175.5° | 42.9° |
| C2A | C23 | C24 | C25 | 65.8° | 87.8° |
| C2A | C23 | C24 | O24 | 59.3° | 29.1° |
| C2A | C23 | C24 | H36 | 176.1° | 149.4° |
| C23 | C2A | H39 | H40 | 120.0° | 120.0° |
| C23 | C2A | H39 | H41 | 120.0° | 120.0° |
| C23 | C2A | H40 | H41 | 120.0° | 120.0° |
| C2A | C23 | C22 | H42 | 64.3° | 69.4° |
| C2A | C23 | C22 | H43 | 55.4° | 165.8° |
| C2B | C25 | O25 | C24 | 121.2° | 120.8° |
| C2B | C25 | O25 | C26 | 119.9° | 123.8° |
| C2B | C25 | C24 | C23 | 41.4° | 63.4° |
| C2B | C25 | C24 | C26 | 120.2° | 120.6° |
| C2B | C25 | C24 | O24 | 166.7° | 178.7° |
| C2B | C25 | C26 | C27 | 124.8° | 60.2° |
| C2B | C25 | C26 | O26 | 56.9° | 112.3° |
| C25 | C2B | H32 | H33 | 120.0° | 120.1° |
| C25 | C2B | H32 | H34 | 120.0° | 120.0° |
| C25 | C2B | H33 | H34 | 120.0° | 120.0° |
| C2B | C25 | O25 | H35 | 180.0° | 50.2° |
| C2B | C25 | C24 | H36 | 76.8° | 62.0° |
| O25 | C25 | C24 | C23 | 77.6° | 61.0° |
| O25 | C25 | C24 | C26 | 120.8° | 114.9° |
| O25 | C25 | C24 | O24 | 47.6° | 56.8° |
| O25 | C25 | C26 | C27 | 5.8° | 65.8° |
| O25 | C25 | C26 | O26 | 175.8° | 121.7° |
| O25 | C25 | C2B | H32 | 180.0° | 59.8° |
| O25 | C25 | C2B | H33 | 60.0° | 60.3° |
| O25 | C25 | C2B | H34 | 60.0° | 179.8° |
| O25 | C25 | C24 | H36 | 164.2° | 173.6° |
| C22 | C23 | C24 | H38 | 117.9° | 116.9° |
| C23 | C22 | C21 | H42 | 120.1° | 114.9° |
| C23 | C22 | C21 | H43 | 120.2° | 120.7° |
| C22 | C23 | C24 | C25 | 171.4° | 149.9° |
| C22 | C23 | C24 | O24 | 63.5° | 93.1° |
| C23 | C22 | C21 | C20 | 129.0° | 109.5° |
| C22 | C23 | C24 | H36 | 53.3° | 27.1° |
| C22 | C23 | C2A | H39 | 180.0° | 60.0° |
| C22 | C23 | C2A | H40 | 60.0° | 180.0° |
| C22 | C23 | C2A | H41 | 60.0° | 60.0° |
| C23 | C22 | H42 | H43 | 119.6° | 121.9° |
| C23 | C22 | C21 | H44 | 51.0° | 76.9° |
| C24 | C23 | C22 | C21 | 60.5° | 81.2° |
| C23 | C24 | C25 | O24 | 125.2° | 117.9° |
| C23 | C24 | C25 | H36 | 118.2° | 125.4° |
| C23 | C24 | C25 | C26 | 161.6° | 176.0° |
| C23 | C24 | O24 | H36 | 116.0° | 123.2° |
| C23 | C24 | O24 | H37 | 180.0° | 60.0° |
| C24 | C23 | C2A | H39 | 57.4° | 61.5° |
| C24 | C23 | C2A | H40 | 177.4° | 58.4° |
| C24 | C23 | C2A | H41 | 62.6° | 178.5° |
| C24 | C23 | C22 | H42 | 59.6° | 166.4° |
| C24 | C23 | C22 | H43 | 179.3° | 41.6° |
| C2D | C29 | C30 | C28 | 123.8° | 127.4° |
| C2D | C29 | C30 | H22 | 118.4° | 114.8° |
| C2D | C29 | C28 | H22 | 118.0° | 120.0° |
| C2D | C29 | C30 | O30 | 12.8° | 165.0° |
| C2D | C29 | C30 | C31 | 166.8° | 19.4° |
| C2D | C29 | C28 | C27 | 55.4° | 41.1° |
| C2D | C29 | C28 | O28 | 67.7° | 84.4° |
| C29 | C2D | H23 | H24 | 120.0° | 120.0° |
| C29 | C2D | H23 | H25 | 120.0° | 120.0° |
| C29 | C2D | H24 | H25 | 120.0° | 120.1° |
| C2D | C29 | C28 | H26 | 174.3° | 155.3° |
| C22 | C21 | C20 | H44 | 180.0° | 174.2° |
| C22 | C21 | C20 | C19 | 179.5° | 179.2° |
| C21 | C22 | C23 | H38 | 57.3° | 157.8° |
| C21 | C22 | H42 | H43 | 119.6° | 123.5° |
| C22 | C21 | C20 | H45 | 0.5° | 1.1° |
| C25 | C24 | O24 | H36 | 115.7° | 116.8° |
| C24 | C25 | C26 | C27 | 113.9° | 179.4° |
| C24 | C25 | C26 | O26 | 64.5° | 6.9° |
| C24 | C25 | C2B | H32 | 60.2° | 59.9° |
| C24 | C25 | C2B | H33 | 59.8° | 180.0° |
| C24 | C25 | C2B | H34 | 179.8° | 60.0° |
| C24 | C25 | O25 | H35 | 58.8° | 171.0° |
| C25 | C24 | O24 | H37 | 51.7° | 180.0° |
| C25 | C24 | C23 | H38 | 53.6° | 33.0° |
| C26 | C25 | C24 | O24 | 73.2° | 58.1° |
| C25 | C26 | C27 | O26 | 178.4° | 171.9° |
| C25 | C26 | C27 | C28 | 136.1° | 174.8° |
| C25 | C26 | C27 | C2C | 103.6° | 55.9° |
| C25 | C26 | C27 | H28 | 15.7° | 60.7° |
| C26 | C25 | C2B | H32 | 59.2° | 178.6° |
| C26 | C25 | C2B | H33 | 179.2° | 61.4° |
| C26 | C25 | C2B | H34 | 60.9° | 58.6° |
| C26 | C25 | O25 | H35 | 60.1° | 73.6° |
| C26 | C25 | C24 | H36 | 43.4° | 58.6° |
| O24 | C24 | C23 | H38 | 178.6° | 149.9° |
| C30 | C29 | C28 | H22 | 118.9° | 115.3° |
| C29 | C30 | O30 | C31 | 179.7° | 175.9° |
| C30 | C29 | C28 | C27 | 178.5° | 165.8° |
| C29 | C30 | C31 | C3A | 105.3° | 77.7° |
| C30 | C29 | C28 | O28 | 55.4° | 40.4° |
| C29 | C30 | C31 | C32 | 131.5° | 164.2° |
| C29 | C30 | C31 | H18 | 12.9° | 43.7° |
| C30 | C29 | C2D | H23 | 180.0° | 66.5° |
| C30 | C29 | C2D | H24 | 60.0° | 173.6° |
| C30 | C29 | C2D | H25 | 60.0° | 53.5° |
| C30 | C29 | C28 | H26 | 62.6° | 80.0° |
| C28 | C29 | C30 | O30 | 111.0° | 67.6° |
| C29 | C28 | C27 | C26 | 58.5° | 82.8° |
| C28 | C29 | C30 | C31 | 69.4° | 108.0° |
| C29 | C28 | C27 | O28 | 122.5° | 125.2° |
| C29 | C28 | C27 | H26 | 118.9° | 113.4° |
| C29 | C28 | C27 | C2C | 179.4° | 46.7° |
| C29 | C28 | O28 | H26 | 117.1° | 116.1° |
| C28 | C29 | C2D | H23 | 57.3° | 169.3° |
| C28 | C29 | C2D | H24 | 62.7° | 49.4° |
| C28 | C29 | C2D | H25 | 177.3° | 70.7° |
| C29 | C28 | O28 | H27 | 180.0° | 60.0° |
| C29 | C28 | C27 | H28 | 62.8° | 159.4° |
| C21 | C20 | C19 | H45 | 180.0° | 179.8° |
| C21 | C20 | C19 | C18 | 179.7° | 174.0° |
| C20 | C21 | C22 | H42 | 8.9° | 135.6° |
| C20 | C21 | C22 | H43 | 110.8° | 11.2° |
| C21 | C20 | C19 | H46 | 0.3° | 0.8° |
| O30 | C30 | C31 | C3A | 74.4° | 97.9° |
| O30 | C30 | C31 | C32 | 48.8° | 20.1° |
| O30 | C30 | C31 | H18 | 167.5° | 140.6° |
| O30 | C30 | C29 | H22 | 131.2° | 50.2° |
| C26 | C27 | C28 | C2C | 122.1° | 129.5° |
| C26 | C27 | C28 | H28 | 121.3° | 117.8° |
| C26 | C27 | C2C | H28 | 120.3° | 119.4° |
| C26 | C27 | C28 | O28 | 179.0° | 42.4° |
| C26 | C27 | C28 | H26 | 60.4° | 163.8° |
| C26 | C27 | C2C | H29 | 180.0° | 174.2° |
| C26 | C27 | C2C | H30 | 60.0° | 65.9° |
| C26 | C27 | C2C | H31 | 60.0° | 54.1° |
| O26 | C26 | C27 | C28 | 45.5° | 2.9° |
| O26 | C26 | C27 | C2C | 74.8° | 132.2° |
| O26 | C26 | C27 | H28 | 165.9° | 111.2° |
| C30 | C31 | C3A | C32 | 122.6° | 115.8° |
| C30 | C31 | C3A | H18 | 119.2° | 118.1° |
| C30 | C31 | C32 | H18 | 119.9° | 115.9° |
| C30 | C31 | C32 | O32 | 59.2° | 95.5° |
| C30 | C31 | C32 | C33 | 176.8° | 146.2° |
| C30 | C31 | C32 | H16 | 58.6° | 26.0° |
| C30 | C31 | C3A | H19 | 180.0° | 178.5° |
| C30 | C31 | C3A | H20 | 60.0° | 58.6° |
| C30 | C31 | C3A | H21 | 60.0° | 61.4° |
| C31 | C30 | C29 | H22 | 48.5° | 134.3° |
| C28 | C27 | C2C | H28 | 116.5° | 112.0° |
| C27 | C28 | O28 | H26 | 117.6° | 118.0° |
| C27 | C28 | C29 | H22 | 62.7° | 78.8° |
| C27 | C28 | O28 | H27 | 54.8° | 174.1° |
| C28 | C27 | C2C | H29 | 56.7° | 45.5° |
| C28 | C27 | C2C | H30 | 176.8° | 165.5° |
| C28 | C27 | C2C | H31 | 63.3° | 74.5° |
| C2C | C27 | C28 | O28 | 56.8° | 171.9° |
| C2C | C27 | C28 | H26 | 61.7° | 66.6° |
| C27 | C2C | H29 | H30 | 120.0° | 120.0° |
| C27 | C2C | H29 | H31 | 120.0° | 120.0° |
| C27 | C2C | H30 | H31 | 120.0° | 120.0° |
| C3A | C31 | C32 | H18 | 118.4° | 125.4° |
| C3A | C31 | C32 | O32 | 62.5° | 23.2° |
| C3A | C31 | C32 | C33 | 61.5° | 95.1° |
| C3A | C31 | C32 | H16 | 179.8° | 144.7° |
| C31 | C3A | H19 | H20 | 120.0° | 120.0° |
| C31 | C3A | H19 | H21 | 120.0° | 120.0° |
| C31 | C3A | H20 | H21 | 120.0° | 120.0° |
| O28 | C28 | C29 | H22 | 174.3° | 155.7° |
| O28 | C28 | C27 | H28 | 59.7° | 75.4° |
| C20 | C19 | C18 | H46 | 180.0° | 174.2° |
| C20 | C19 | C18 | C17 | 178.8° | 178.8° |
| C19 | C20 | C21 | H44 | 0.5° | 6.7° |
| C20 | C19 | C18 | H47 | 1.2° | 4.9° |
| C31 | C32 | O32 | C33 | 125.7° | 119.7° |
| C31 | C32 | O32 | H16 | 116.9° | 122.9° |
| C31 | C32 | C33 | H16 | 118.1° | 122.6° |
| C31 | C32 | C33 | C34 | 59.8° | 56.7° |
| C31 | C32 | C33 | C3B | 179.0° | 64.0° |
| C31 | C32 | C33 | H12 | 60.9° | 175.7° |
| C31 | C32 | O32 | H17 | 33.6° | 179.6° |
| C32 | C31 | C3A | H19 | 57.4° | 65.7° |
| C32 | C31 | C3A | H20 | 177.4° | 174.4° |
| C32 | C31 | C3A | H21 | 62.6° | 54.3° |
| O32 | C32 | C33 | H16 | 118.1° | 118.3° |
| O32 | C32 | C33 | C34 | 176.5° | 62.4° |
| O32 | C32 | C33 | C3B | 55.3° | 176.9° |
| O32 | C32 | C33 | H12 | 62.8° | 56.6° |
| O32 | C32 | C31 | H18 | 179.1° | 148.5° |
| C19 | C18 | C17 | H47 | 180.0° | 176.2° |
| C19 | C18 | C17 | C1C | 140.2° | 45.7° |
| C19 | C18 | C17 | C16 | 101.3° | 165.6° |
| C18 | C19 | C20 | H45 | 0.3° | 6.2° |
| C19 | C18 | C17 | H48 | 18.6° | 74.6° |
| C32 | C33 | C34 | C3B | 122.2° | 120.8° |
| C32 | C33 | C34 | H12 | 119.3° | 116.4° |
| C32 | C33 | C3B | H12 | 118.0° | 117.2° |
| C32 | C33 | C34 | C35 | 118.4° | 156.5° |
| C32 | C33 | C34 | H11 | 61.6° | 28.2° |
| C32 | C33 | C3B | H13 | 180.0° | 179.6° |
| C32 | C33 | C3B | H14 | 60.0° | 59.6° |
| C32 | C33 | C3B | H15 | 60.0° | 60.3° |
| C33 | C32 | O32 | H17 | 159.3° | 59.9° |
| C33 | C32 | C31 | H18 | 56.9° | 30.3° |
| C18 | C17 | C1C | C16 | 121.2° | 115.5° |
| C18 | C17 | C1C | H48 | 122.5° | 122.7° |
| C18 | C17 | C16 | H48 | 120.8° | 122.3° |
| C18 | C17 | C1C | C1D | 55.3° | 55.8° |
| C18 | C17 | C16 | C15 | 66.3° | 174.6° |
| C17 | C18 | C19 | H46 | 1.2° | 4.6° |
| C18 | C17 | C1C | H49 | 175.8° | 64.2° |
| C18 | C17 | C1C | H50 | 65.1° | 175.9° |
| C18 | C17 | C16 | H54 | 53.9° | 60.4° |
| C18 | C17 | C16 | H55 | 173.4° | 58.1° |
| C34 | C33 | C3B | H12 | 119.8° | 122.4° |
| C33 | C34 | C35 | H11 | 180.0° | 175.1° |
| C33 | C34 | C35 | C36 | 179.1° | 178.0° |
| C33 | C34 | C35 | H10 | 0.9° | 1.1° |
| C34 | C33 | C3B | H13 | 57.8° | 60.0° |
| C34 | C33 | C3B | H14 | 177.8° | 180.0° |
| C34 | C33 | C3B | H15 | 62.2° | 60.1° |
| C34 | C33 | C32 | H16 | 58.4° | 179.3° |
| C3B | C33 | C34 | C35 | 119.4° | 35.8° |
| C3B | C33 | C34 | H11 | 60.6° | 148.9° |
| C33 | C3B | H13 | H14 | 120.0° | 120.0° |
| C33 | C3B | H13 | H15 | 120.0° | 120.0° |
| C33 | C3B | H14 | H15 | 120.0° | 120.0° |
| C3B | C33 | C32 | H16 | 62.9° | 58.6° |
| C1B | C12 | C13 | C15 | 52.0° | 58.3° |
| C1B | C12 | C13 | C11 | 123.9° | 119.7° |
| C1B | C12 | C13 | H6 | 119.1° | 116.2° |
| C1B | C12 | C11 | H6 | 118.2° | 117.6° |
| C1B | C12 | C11 | O37 | 47.5° | 55.1° |
| C1B | C12 | C13 | O14 | 70.4° | 59.3° |
| C1B | C12 | C11 | C10 | 72.0° | 61.3° |
| C1B | C12 | C11 | H5 | 168.8° | 174.3° |
| C12 | C1B | H7 | H8 | 120.0° | 119.9° |
| C12 | C1B | H7 | H9 | 120.0° | 120.0° |
| C12 | C1B | H8 | H9 | 120.0° | 120.0° |
| C1B | C12 | C13 | H58 | 170.7° | 179.7° |
| C34 | C35 | C36 | H10 | 180.0° | 177.0° |
| C34 | C35 | C36 | O36 | 179.3° | 1.3° |
| C34 | C35 | C36 | O37 | 0.3° | 178.2° |
| C35 | C34 | C33 | H12 | 0.9° | 87.1° |
| C1C | C17 | C16 | H48 | 116.3° | 122.0° |
| C17 | C1C | C1D | H49 | 120.5° | 120.1° |
| C17 | C1C | C1D | H50 | 120.4° | 120.0° |
| C1C | C17 | C16 | C15 | 170.7° | 58.8° |
| C1C | C17 | C18 | H47 | 39.8° | 138.1° |
| C17 | C1C | H49 | H50 | 118.6° | 119.9° |
| C17 | C1C | C1D | H51 | 180.0° | 175.3° |
| C17 | C1C | C1D | H52 | 60.0° | 55.3° |
| C17 | C1C | C1D | H53 | 60.0° | 64.7° |
| C1C | C17 | C16 | H54 | 69.1° | 176.1° |
| C1C | C17 | C16 | H55 | 50.5° | 57.7° |
| C16 | C17 | C1C | C1D | 176.6° | 59.6° |
| C17 | C16 | C15 | H54 | 120.2° | 123.6° |
| C17 | C16 | C15 | H55 | 120.2° | 118.0° |
| C17 | C16 | C15 | C13 | 172.6° | 162.3° |
| C16 | C17 | C18 | H47 | 78.8° | 18.2° |
| C16 | C17 | C1C | H49 | 63.0° | 179.7° |
| C16 | C17 | C1C | H50 | 56.1° | 60.4° |
| C17 | C16 | H54 | H55 | 119.2° | 119.2° |
| C17 | C16 | C15 | H56 | 52.5° | 35.0° |
| C17 | C16 | C15 | H57 | 67.4° | 81.2° |
| C35 | C36 | O36 | O37 | 179.6° | 179.5° |
| C35 | C36 | O37 | C11 | 179.9° | 179.0° |
| C36 | C35 | C34 | H11 | 0.9° | 2.9° |
| C1D | C1C | C17 | H48 | 67.2° | 178.5° |
| C1D | C1C | H49 | H50 | 118.7° | 120.0° |
| C1C | C1D | H51 | H52 | 120.0° | 120.1° |
| C1C | C1D | H51 | H53 | 120.0° | 120.0° |
| C1C | C1D | H52 | H53 | 120.0° | 120.0° |
| C16 | C15 | C13 | H56 | 120.1° | 126.0° |
| C16 | C15 | C13 | H57 | 120.1° | 114.5° |
| C16 | C15 | C13 | C12 | 174.3° | 67.9° |
| C16 | C15 | C13 | O14 | 51.1° | 174.3° |
| C15 | C16 | C17 | H48 | 54.4° | 63.2° |
| C15 | C16 | H54 | H55 | 119.3° | 117.7° |
| C16 | C15 | H56 | H57 | 119.8° | 116.8° |
| C16 | C15 | C13 | H58 | 67.2° | 52.9° |
| C15 | C13 | C12 | O14 | 122.3° | 117.6° |
| C15 | C13 | C12 | H58 | 118.7° | 122.0° |
| C15 | C13 | C12 | C11 | 175.9° | 178.0° |
| C15 | C13 | O14 | H58 | 117.7° | 120.8° |
| C15 | C13 | O14 | C8 | 176.5° | 173.7° |
| C15 | C13 | C12 | H6 | 67.1° | 57.8° |
| C13 | C15 | C16 | H54 | 67.2° | 74.1° |
| C13 | C15 | C16 | H55 | 52.3° | 44.2° |
| C13 | C15 | H56 | H57 | 119.8° | 121.6° |
| C13 | C12 | C11 | H6 | 116.9° | 122.0° |
| C13 | C12 | C11 | O37 | 172.4° | 175.4° |
| C12 | C13 | O14 | H58 | 118.2° | 118.5° |
| C13 | C12 | C11 | C10 | 52.8° | 59.1° |
| C12 | C13 | O14 | C8 | 59.3° | 65.6° |
| C13 | C12 | C11 | H5 | 66.3° | 65.4° |
| C13 | C12 | C1B | H7 | 180.0° | 60.0° |
| C13 | C12 | C1B | H8 | 60.0° | 180.0° |
| C13 | C12 | C1B | H9 | 60.0° | 60.0° |
| C12 | C13 | C15 | H56 | 65.6° | 58.1° |
| C12 | C13 | C15 | H57 | 54.2° | 177.6° |
| C12 | C11 | O37 | C36 | 78.4° | 88.7° |
| C12 | C11 | O37 | C10 | 121.8° | 117.6° |
| C12 | C11 | O37 | H5 | 120.2° | 114.5° |
| C11 | C12 | C13 | O14 | 53.6° | 60.4° |
| C12 | C11 | C10 | H5 | 119.2° | 118.1° |
| C12 | C11 | C10 | C8 | 54.9° | 56.2° |
| C12 | C11 | C10 | C1A | 179.1° | 172.2° |
| C12 | C11 | C10 | H4 | 63.3° | 67.9° |
| C11 | C12 | C1B | H7 | 57.2° | 59.3° |
| C11 | C12 | C1B | H8 | 177.2° | 60.6° |
| C11 | C12 | C1B | H9 | 62.8° | 179.3° |
| C11 | C12 | C13 | H58 | 65.4° | 60.0° |
| O36 | C36 | O37 | C11 | 0.4° | 1.4° |
| O36 | C36 | C35 | H10 | 0.7° | 178.3° |
| C36 | O37 | C11 | C10 | 159.8° | 153.7° |
| C36 | O37 | C11 | H5 | 41.8° | 25.8° |
| O37 | C36 | C35 | H10 | 179.7° | 1.2° |
| O37 | C11 | C10 | H5 | 119.2° | 126.0° |
| O37 | C11 | C10 | C8 | 176.5° | 172.1° |
| O37 | C11 | C10 | C1A | 59.2° | 71.9° |
| O37 | C11 | C10 | H4 | 58.4° | 48.1° |
| O37 | C11 | C12 | H6 | 70.7° | 62.5° |
| C13 | O14 | C8 | C10 | 60.0° | 64.7° |
| C13 | O14 | C8 | C7 | 178.7° | 178.1° |
| C13 | O14 | C8 | O9 | 59.9° | 60.5° |
| O14 | C13 | C12 | H6 | 170.6° | 175.4° |
| O14 | C13 | C15 | H56 | 171.1° | 59.7° |
| O14 | C13 | C15 | H57 | 69.0° | 59.7° |
| C11 | C10 | C8 | O14 | 56.1° | 58.7° |
| C11 | C10 | C8 | C1A | 122.8° | 114.3° |
| C11 | C10 | C8 | H4 | 118.0° | 124.3° |
| C11 | C10 | C1A | H4 | 117.6° | 121.9° |
| C11 | C10 | C8 | C7 | 172.9° | 178.7° |
| C11 | C10 | C8 | O9 | 65.9° | 64.9° |
| C11 | C10 | C1A | H1 | 180.0° | 55.0° |
| C11 | C10 | C1A | H2 | 60.0° | 65.0° |
| C11 | C10 | C1A | H3 | 60.0° | 175.0° |
| C10 | C11 | C12 | H6 | 169.7° | 178.9° |
| O14 | C8 | C10 | C7 | 116.8° | 120.0° |
| O14 | C8 | C10 | O9 | 121.9° | 123.6° |
| O14 | C8 | C10 | C1A | 178.9° | 173.1° |
| O14 | C8 | C7 | O9 | 121.9° | 120.0° |
| O14 | C8 | C7 | C6 | 73.2° | 61.2° |
| O14 | C8 | O9 | C4 | 62.1° | 55.1° |
| O14 | C8 | C10 | H4 | 61.9° | 65.6° |
| C8 | O14 | C13 | H58 | 58.8° | 53.0° |
| O14 | C8 | C7 | H59 | 166.6° | 179.8° |
| O14 | C8 | C7 | H60 | 47.1° | 54.6° |
| C8 | C10 | C1A | H4 | 119.3° | 123.1° |
| C10 | C8 | C7 | O9 | 119.6° | 120.9° |
| C10 | C8 | C7 | C6 | 168.3° | 179.7° |
| C10 | C8 | O9 | C4 | 177.4° | 178.2° |
| C8 | C10 | C1A | H1 | 56.9° | 60.0° |
| C8 | C10 | C1A | H2 | 63.2° | 180.0° |
| C8 | C10 | C1A | H3 | 176.9° | 60.0° |
| C8 | C10 | C11 | H5 | 64.3° | 61.9° |
| C10 | C8 | C7 | H59 | 48.1° | 61.1° |
| C10 | C8 | C7 | H60 | 71.4° | 64.5° |
| C1A | C10 | C8 | C7 | 64.3° | 67.0° |
| C1A | C10 | C8 | O9 | 56.9° | 49.5° |
| C10 | C1A | H1 | H2 | 120.0° | 120.0° |
| C10 | C1A | H1 | H3 | 120.0° | 120.0° |
| C10 | C1A | H2 | H3 | 120.0° | 120.0° |
| C1A | C10 | C11 | H5 | 59.9° | 54.1° |
| C8 | C7 | C6 | H59 | 120.2° | 120.2° |
| C8 | C7 | C6 | H60 | 120.3° | 112.5° |
| C7 | C8 | O9 | C4 | 56.9° | 65.3° |
| C8 | C7 | C6 | C5 | 50.3° | 55.4° |
| C7 | C8 | C10 | H4 | 54.9° | 54.4° |
| C8 | C7 | H59 | H60 | 119.3° | 119.0° |
| C8 | C7 | C6 | H61 | 170.6° | 178.8° |
| C8 | C7 | C6 | H62 | 70.0° | 67.8° |
| O9 | C8 | C7 | C6 | 48.7° | 58.8° |
| C8 | O9 | C4 | C3 | 172.0° | 176.0° |
| C8 | O9 | C4 | C5 | 63.5° | 63.1° |
| O9 | C8 | C10 | H4 | 176.1° | 170.9° |
| O9 | C8 | C7 | H59 | 71.5° | 59.7° |
| O9 | C8 | C7 | H60 | 169.0° | 174.6° |
| C8 | O9 | C4 | H67 | 53.5° | 57.7° |
| O2 | C2 | C1 | C3 | 119.7° | 120.0° |
| O2 | C2 | C1 | H70 | 121.1° | 120.1° |
| O2 | C2 | C3 | H70 | 119.8° | 120.0° |
| O2 | C2 | C3 | C4 | 72.5° | 65.0° |
| O2 | C2 | C3 | H68 | 47.4° | 175.0° |
| O2 | C2 | C3 | H69 | 167.6° | 55.0° |
| O2 | C2 | C1 | H71 | 180.0° | 60.0° |
| O2 | C2 | C1 | H72 | 60.0° | 60.0° |
| O2 | C2 | C1 | H73 | 60.0° | 180.0° |
| C7 | C6 | C5 | C4 | 56.4° | 54.4° |
| C7 | C6 | C5 | H61 | 120.3° | 118.2° |
| C7 | C6 | C5 | H62 | 120.3° | 118.3° |
| C7 | C6 | C5 | C51 | 66.0° | 71.8° |
| C6 | C7 | H59 | H60 | 119.2° | 123.4° |
| C7 | C6 | H61 | H62 | 119.1° | 113.2° |
| C7 | C6 | C5 | H63 | 174.7° | 171.3° |
| O9 | C4 | C3 | C2 | 62.4° | 65.0° |
| O9 | C4 | C3 | C5 | 122.2° | 120.9° |
| O9 | C4 | C3 | H67 | 119.2° | 117.0° |
| O9 | C4 | C5 | H67 | 117.7° | 117.9° |
| O9 | C4 | C5 | C6 | 61.0° | 54.7° |
| O9 | C4 | C5 | C51 | 60.9° | 70.6° |
| O9 | C4 | C5 | H63 | 179.0° | 170.9° |
| O9 | C4 | C3 | H68 | 177.7° | 55.0° |
| O9 | C4 | C3 | H69 | 57.5° | 175.0° |
| C1 | C2 | C3 | H70 | 119.2° | 120.0° |
| C1 | C2 | C3 | C4 | 166.5° | 175.0° |
| C1 | C2 | C3 | H68 | 73.6° | 55.0° |
| C1 | C2 | C3 | H69 | 46.6° | 65.0° |
| C2 | C1 | H71 | H72 | 120.0° | 120.0° |
| C2 | C1 | H71 | H73 | 120.0° | 120.0° |
| C2 | C1 | H72 | H73 | 120.0° | 120.1° |
| C1 | C2 | O2 | H74 | 180.0° | 60.0° |
| C2 | C3 | C4 | H68 | 119.9° | 120.0° |
| C2 | C3 | C4 | H69 | 119.9° | 120.0° |
| C2 | C3 | C4 | C5 | 175.3° | 174.0° |
| C2 | C3 | C4 | H67 | 56.8° | 52.0° |
| C2 | C3 | H68 | H69 | 120.3° | 120.0° |
| C3 | C2 | C1 | H71 | 60.3° | 60.0° |
| C3 | C2 | C1 | H72 | 59.7° | 180.0° |
| C3 | C2 | C1 | H73 | 179.7° | 60.0° |
| C3 | C2 | O2 | H74 | 59.2° | 180.0° |
| C3 | C4 | C5 | H67 | 118.5° | 120.4° |
| C3 | C4 | C5 | C6 | 175.2° | 176.4° |
| C3 | C4 | C5 | C51 | 62.9° | 51.1° |
| C3 | C4 | C5 | H63 | 57.1° | 67.4° |
| C4 | C3 | H68 | H69 | 120.3° | 119.9° |
| C4 | C3 | C2 | H70 | 47.4° | 55.0° |
| C4 | C5 | C6 | C51 | 122.4° | 126.2° |
| C4 | C5 | C6 | H63 | 118.3° | 116.9° |
| C4 | C5 | C51 | H63 | 120.1° | 118.2° |
| C4 | C5 | C6 | H61 | 176.7° | 172.6° |
| C4 | C5 | C6 | H62 | 63.9° | 64.0° |
| C4 | C5 | C51 | H64 | 180.0° | 174.0° |
| C4 | C5 | C51 | H65 | 60.0° | 54.1° |
| C4 | C5 | C51 | H66 | 60.0° | 66.0° |
| C5 | C4 | C3 | H68 | 55.4° | 65.9° |
| C5 | C4 | C3 | H69 | 64.8° | 54.0° |
| C6 | C5 | C51 | H63 | 119.2° | 115.9° |
| C5 | C6 | C7 | H59 | 69.9° | 64.8° |
| C5 | C6 | C7 | H60 | 170.6° | 167.9° |
| C5 | C6 | H61 | H62 | 119.1° | 127.3° |
| C6 | C5 | C51 | H64 | 59.3° | 60.1° |
| C6 | C5 | C51 | H65 | 179.3° | 180.0° |
| C6 | C5 | C51 | H66 | 60.7° | 60.0° |
| C6 | C5 | C4 | H67 | 56.7° | 63.2° |
| C51 | C5 | C6 | H61 | 54.3° | 46.4° |
| C51 | C5 | C6 | H62 | 173.7° | 169.9° |
| C5 | C51 | H64 | H65 | 120.0° | 120.0° |
| C5 | C51 | H64 | H66 | 120.0° | 120.1° |
| C5 | C51 | H65 | H66 | 120.0° | 120.1° |
| C51 | C5 | C4 | H67 | 178.6° | 171.6° |
| H1 | C1A | H2 | H3 | 120.0° | 119.9° |
| H1 | C1A | C10 | H4 | 62.4° | 176.9° |
| H2 | C1A | C10 | H4 | 177.5° | 56.9° |
| H3 | C1A | C10 | H4 | 57.6° | 63.1° |
| H4 | C10 | C11 | H5 | 177.6° | 174.0° |
| H5 | C11 | C12 | H6 | 50.6° | 56.7° |
| H6 | C12 | C1B | H7 | 61.0° | 178.6° |
| H6 | C12 | C1B | H8 | 59.0° | 61.5° |
| H6 | C12 | C1B | H9 | 179.0° | 58.6° |
| H6 | C12 | C13 | H58 | 51.6° | 64.1° |
| H7 | C1B | H8 | H9 | 120.0° | 120.0° |
| H10 | C35 | C34 | H11 | 179.1° | 174.0° |
| H11 | C34 | C33 | H12 | 179.1° | 88.2° |
| H12 | C33 | C3B | H13 | 61.9° | 62.4° |
| H12 | C33 | C3B | H14 | 58.0° | 57.6° |
| H12 | C33 | C3B | H15 | 178.0° | 177.5° |
| H12 | C33 | C32 | H16 | 179.0° | 61.7° |
| H13 | C3B | H14 | H15 | 120.0° | 120.0° |
| H16 | C32 | O32 | H17 | 83.2° | 57.4° |
| H16 | C32 | C31 | H18 | 61.4° | 90.0° |
| H18 | C31 | C3A | H19 | 60.8° | 60.4° |
| H18 | C31 | C3A | H20 | 59.2° | 59.5° |
| H18 | C31 | C3A | H21 | 179.2° | 179.5° |
| H19 | C3A | H20 | H21 | 120.0° | 120.0° |
| H22 | C29 | C2D | H23 | 60.7° | 47.8° |
| H22 | C29 | C2D | H24 | 179.4° | 72.2° |
| H22 | C29 | C2D | H25 | 59.3° | 167.8° |
| H22 | C29 | C28 | H26 | 56.2° | 35.3° |
| H23 | C2D | H24 | H25 | 120.0° | 120.0° |
| H26 | C28 | O28 | H27 | 62.9° | 56.1° |
| H26 | C28 | C27 | H28 | 178.2° | 46.1° |
| H28 | C27 | C2C | H29 | 59.8° | 66.5° |
| H28 | C27 | C2C | H30 | 60.3° | 53.5° |
| H28 | C27 | C2C | H31 | 179.8° | 173.5° |
| H29 | C2C | H30 | H31 | 120.0° | 120.0° |
| H32 | C2B | H33 | H34 | 120.0° | 119.9° |
| H36 | C24 | O24 | H37 | 64.0° | 63.1° |
| H36 | C24 | C23 | H38 | 64.5° | 89.8° |
| H38 | C23 | C2A | H39 | 61.8° | 174.5° |
| H38 | C23 | C2A | H40 | 58.2° | 65.6° |
| H38 | C23 | C2A | H41 | 178.2° | 54.5° |
| H38 | C23 | C22 | H42 | 177.4° | 45.4° |
| H38 | C23 | C22 | H43 | 62.9° | 79.4° |
| H39 | C2A | H40 | H41 | 120.0° | 120.0° |
| H42 | C22 | C21 | H44 | 171.1° | 38.0° |
| H43 | C22 | C21 | H44 | 69.2° | 162.4° |
| H44 | C21 | C20 | H45 | 179.5° | 173.1° |
| H45 | C20 | C19 | H46 | 179.7° | 179.0° |
| H46 | C19 | C18 | H47 | 178.8° | 179.1° |
| H47 | C18 | C17 | H48 | 161.4° | 101.6° |
| H48 | C17 | C1C | H49 | 53.3° | 58.4° |
| H48 | C17 | C1C | H50 | 172.4° | 61.5° |
| H48 | C17 | C16 | H54 | 174.7° | 61.9° |
| H48 | C17 | C16 | H55 | 65.8° | 179.7° |
| H49 | C1C | C1D | H51 | 59.5° | 64.6° |
| H49 | C1C | C1D | H52 | 179.5° | 175.4° |
| H49 | C1C | C1D | H53 | 60.5° | 55.4° |
| H50 | C1C | C1D | H51 | 59.6° | 55.3° |
| H50 | C1C | C1D | H52 | 60.4° | 64.7° |
| H50 | C1C | C1D | H53 | 179.6° | 175.3° |
| H51 | C1D | H52 | H53 | 120.0° | 119.9° |
| H54 | C16 | C15 | H56 | 172.7° | 158.6° |
| H54 | C16 | C15 | H57 | 52.9° | 42.4° |
| H55 | C16 | C15 | H56 | 67.7° | 83.0° |
| H55 | C16 | C15 | H57 | 172.4° | 160.8° |
| H56 | C15 | C13 | H58 | 52.9° | 178.9° |
| H57 | C15 | C13 | H58 | 172.7° | 61.6° |
| H59 | C7 | C6 | H61 | 50.4° | 58.6° |
| H59 | C7 | C6 | H62 | 169.8° | 172.1° |
| H60 | C7 | C6 | H61 | 69.1° | 68.7° |
| H60 | C7 | C6 | H62 | 50.3° | 44.8° |
| H61 | C6 | C5 | H63 | 65.0° | 70.5° |
| H62 | C6 | C5 | H63 | 54.4° | 53.0° |
| H63 | C5 | C51 | H64 | 59.9° | 55.8° |
| H63 | C5 | C51 | H65 | 60.1° | 64.1° |
| H63 | C5 | C51 | H66 | 179.9° | 175.9° |
| H63 | C5 | C4 | H67 | 61.4° | 53.1° |
| H64 | C51 | H65 | H66 | 120.0° | 120.0° |
| H67 | C4 | C3 | H68 | 63.1° | 172.0° |
| H67 | C4 | C3 | H69 | 176.7° | 68.0° |
| H68 | C3 | C2 | H70 | 167.2° | 65.0° |
| H69 | C3 | C2 | H70 | 72.6° | 175.0° |
| H70 | C2 | C1 | H71 | 58.9° | 179.9° |
| H70 | C2 | C1 | H72 | 178.9° | 60.1° |
| H70 | C2 | C1 | H73 | 61.1° | 59.9° |
| H70 | C2 | O2 | H74 | 59.8° | 60.1° |
| H71 | C1 | H72 | H73 | 120.0° | 119.9° |
