WQR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O29 | C28 | sing | 1.43Å | 1.42Å | |
| C30 | C28 | sing | 1.52Å | 1.52Å | |
| C30 | C31 | sing | 1.53Å | 1.53Å | |
| C28 | C25 | sing | 1.53Å | 1.52Å | |
| C26 | C25 | sing | 1.53Å | 1.53Å | |
| C31 | C1 | sing | 1.53Å | 1.53Å | |
| C2 | C1 | sing | 1.53Å | 1.54Å | |
| C25 | C27 | sing | 1.55Å | 1.52Å | |
| C25 | C3 | sing | 1.51Å | 1.56Å | |
| C1 | C3 | sing | 1.51Å | 1.55Å | |
| C1 | C24 | sing | 1.52Å | 1.39Å | |
| C3 | C4 | sing | 1.53Å | 1.50Å | |
| C23 | C24 | sing | 1.51Å | 1.40Å | |
| C23 | C22 | sing | 1.53Å | 1.54Å | |
| C24 | C6 | doub | 1.31Å | 1.41Å | |
| C4 | C5 | sing | 1.53Å | 1.50Å | |
| C22 | C10 | sing | 1.51Å | 1.53Å | |
| C6 | C5 | sing | 1.51Å | 1.40Å | |
| C6 | C7 | sing | 1.50Å | 1.39Å | |
| C11 | C10 | sing | 1.54Å | 1.54Å | |
| C10 | C7 | sing | 1.55Å | 1.52Å | |
| C10 | C12 | sing | 1.53Å | 1.53Å | |
| C7 | C8 | sing | 1.51Å | 1.41Å | |
| C7 | C9 | sing | 1.53Å | 1.49Å | |
| C20 | C13 | sing | 1.53Å | 1.52Å | |
| C8 | O32 | doub | 1.21Å | 1.23Å | |
| C12 | C13 | sing | 1.53Å | 1.54Å | |
| C12 | C21 | sing | 1.55Å | 1.54Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C9 | C21 | sing | 1.55Å | 1.53Å | |
| C18 | C17 | sing | 1.51Å | 1.52Å | |
| C16 | C15 | sing | 1.51Å | 1.53Å | |
| C16 | C17 | doub | 1.31Å | 1.54Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C19 | C17 | sing | 1.51Å | 1.53Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C31 | H4 | sing | 1.09Å | 1.10Å | |
| C31 | H5 | sing | 1.09Å | 1.10Å | |
| C30 | H6 | sing | 1.09Å | 1.10Å | |
| C30 | H7 | sing | 1.10Å | 1.10Å | |
| C28 | H8 | sing | 1.09Å | 1.10Å | |
| O29 | H9 | sing | 0.97Å | 0.95Å | |
| C26 | H10 | sing | 1.09Å | 1.10Å | |
| C26 | H11 | sing | 1.09Å | 1.10Å | |
| C26 | H12 | sing | 1.09Å | 1.10Å | |
| C27 | H13 | sing | 1.09Å | 1.10Å | |
| C27 | H14 | sing | 1.09Å | 1.10Å | |
| C27 | H15 | sing | 1.09Å | 1.10Å | |
| C3 | H16 | sing | 1.12Å | 1.10Å | |
| C4 | H17 | sing | 1.08Å | 1.10Å | |
| C4 | H18 | sing | 1.09Å | 1.10Å | |
| C5 | H19 | sing | 1.09Å | 1.10Å | |
| C5 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.08Å | 1.10Å | |
| C22 | H24 | sing | 1.10Å | 1.10Å | |
| C11 | H25 | sing | 1.09Å | 1.10Å | |
| C11 | H26 | sing | 1.09Å | 1.10Å | |
| C11 | H27 | sing | 1.09Å | 1.10Å | |
| C8 | H28 | sing | 1.08Å | 1.08Å | |
| C9 | H29 | sing | 1.09Å | 1.10Å | |
| C9 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C21 | H32 | sing | 1.09Å | 1.10Å | |
| C12 | H33 | sing | 1.09Å | 1.10Å | |
| C13 | H34 | sing | 1.09Å | 1.10Å | |
| C20 | H35 | sing | 1.09Å | 1.10Å | |
| C20 | H36 | sing | 1.09Å | 1.10Å | |
| C20 | H37 | sing | 1.09Å | 1.10Å | |
| C14 | H38 | sing | 1.09Å | 1.10Å | |
| C14 | H39 | sing | 1.09Å | 1.10Å | |
| C15 | H40 | sing | 1.09Å | 1.10Å | |
| C15 | H41 | sing | 1.09Å | 1.10Å | |
| C16 | H42 | sing | 1.08Å | 1.08Å | |
| C19 | H45 | sing | 1.09Å | 1.10Å | |
| C19 | H46 | sing | 1.09Å | 1.10Å | |
| C19 | H47 | sing | 1.09Å | 1.10Å | |
| C18 | H48 | sing | 1.09Å | 1.10Å | |
| C18 | H49 | sing | 1.09Å | 1.10Å | |
| C18 | H50 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O29 | C28 | C30 | 109.7° | 109.2° |
| O29 | C28 | C25 | 109.4° | 108.9° |
| O29 | C28 | H8 | 110.3° | 108.4° |
| C28 | O29 | H9 | 109.5° | 114.0° |
| C28 | C30 | C31 | 110.3° | 110.5° |
| C30 | C28 | C25 | 109.6° | 112.4° |
| C28 | C30 | H6 | 109.3° | 110.6° |
| C28 | C30 | H7 | 109.3° | 108.6° |
| C30 | C28 | H8 | 108.9° | 109.1° |
| C30 | C31 | C1 | 110.6° | 109.2° |
| C30 | C31 | H4 | 109.2° | 109.4° |
| C30 | C31 | H5 | 109.2° | 109.7° |
| C31 | C30 | H6 | 109.3° | 111.0° |
| C31 | C30 | H7 | 109.3° | 108.4° |
| C28 | C25 | C26 | 111.5° | 110.1° |
| C28 | C25 | C27 | 108.4° | 106.6° |
| C28 | C25 | C3 | 107.1° | 111.6° |
| C25 | C28 | H8 | 108.9° | 108.8° |
| C26 | C25 | C27 | 107.2° | 107.1° |
| C26 | C25 | C3 | 114.6° | 112.9° |
| C25 | C26 | H10 | 109.5° | 109.5° |
| C25 | C26 | H11 | 109.5° | 109.5° |
| C25 | C26 | H12 | 109.4° | 109.5° |
| C31 | C1 | C2 | 109.7° | 108.5° |
| C31 | C1 | C3 | 109.6° | 110.3° |
| C31 | C1 | C24 | 111.2° | 109.9° |
| C1 | C31 | H4 | 109.2° | 109.6° |
| C1 | C31 | H5 | 109.2° | 109.5° |
| C2 | C1 | C3 | 112.7° | 112.1° |
| C2 | C1 | C24 | 106.7° | 106.4° |
| C1 | C2 | H1 | 109.5° | 109.5° |
| C1 | C2 | H2 | 109.4° | 109.5° |
| C1 | C2 | H3 | 109.5° | 109.5° |
| C27 | C25 | C3 | 107.8° | 108.2° |
| C25 | C27 | H13 | 109.5° | 109.4° |
| C25 | C27 | H14 | 109.5° | 109.5° |
| C25 | C27 | H15 | 109.5° | 109.4° |
| C25 | C3 | C1 | 115.4° | 116.0° |
| C25 | C3 | C4 | 113.0° | 113.7° |
| C25 | C3 | H16 | 107.1° | 106.4° |
| C3 | C1 | C24 | 106.9° | 109.4° |
| C1 | C3 | C4 | 106.1° | 108.3° |
| C1 | C3 | H16 | 107.2° | 106.1° |
| C1 | C24 | C23 | 116.5° | 114.7° |
| C1 | C24 | C6 | 121.2° | 120.8° |
| C3 | C4 | C5 | 103.9° | 106.2° |
| C4 | C3 | H16 | 107.8° | 105.6° |
| C3 | C4 | H17 | 110.9° | 112.7° |
| C3 | C4 | H18 | 110.9° | 110.3° |
| C24 | C23 | C22 | 115.0° | 114.5° |
| C23 | C24 | C6 | 122.3° | 124.5° |
| C24 | C23 | H21 | 108.1° | 108.2° |
| C24 | C23 | H22 | 108.1° | 109.6° |
| C23 | C22 | C10 | 113.2° | 107.3° |
| C22 | C23 | H21 | 108.1° | 107.5° |
| C22 | C23 | H22 | 108.1° | 109.1° |
| C23 | C22 | H23 | 108.5° | 111.0° |
| C23 | C22 | H24 | 108.5° | 108.3° |
| C24 | C6 | C5 | 123.9° | 124.6° |
| C24 | C6 | C7 | 118.7° | 119.2° |
| C4 | C5 | C6 | 112.1° | 112.4° |
| C5 | C4 | H17 | 110.9° | 110.1° |
| C5 | C4 | H18 | 110.8° | 108.4° |
| C4 | C5 | H19 | 108.8° | 108.5° |
| C4 | C5 | H20 | 108.8° | 108.8° |
| C22 | C10 | C11 | 110.5° | 110.3° |
| C22 | C10 | C7 | 110.0° | 107.1° |
| C22 | C10 | C12 | 114.6° | 117.5° |
| C10 | C22 | H23 | 108.5° | 113.3° |
| C10 | C22 | H24 | 108.5° | 108.8° |
| C5 | C6 | C7 | 117.4° | 116.2° |
| C6 | C5 | H19 | 108.8° | 108.9° |
| C6 | C5 | H20 | 108.8° | 109.1° |
| C6 | C7 | C10 | 107.8° | 109.3° |
| C6 | C7 | C8 | 112.6° | 109.1° |
| C6 | C7 | C9 | 115.7° | 117.0° |
| C11 | C10 | C7 | 110.2° | 111.1° |
| C11 | C10 | C12 | 109.2° | 108.5° |
| C10 | C11 | H25 | 109.5° | 109.5° |
| C10 | C11 | H26 | 109.4° | 109.5° |
| C10 | C11 | H27 | 109.5° | 109.5° |
| C7 | C10 | C12 | 102.1° | 102.0° |
| C10 | C7 | C8 | 111.4° | 111.4° |
| C10 | C7 | C9 | 98.2° | 101.6° |
| C10 | C12 | C13 | 113.8° | 110.0° |
| C10 | C12 | C21 | 102.2° | 104.2° |
| C10 | C12 | H33 | 110.5° | 111.0° |
| C8 | C7 | C9 | 110.3° | 108.3° |
| C7 | C8 | O32 | 121.7° | 120.0° |
| C7 | C8 | H28 | 119.1° | 120.0° |
| C7 | C9 | C21 | 100.9° | 102.8° |
| C7 | C9 | H29 | 111.6° | 111.6° |
| C7 | C9 | H30 | 111.6° | 110.1° |
| C20 | C13 | C12 | 111.7° | 109.4° |
| C20 | C13 | C14 | 108.0° | 109.5° |
| C20 | C13 | H34 | 109.7° | 109.5° |
| C13 | C20 | H35 | 109.5° | 109.5° |
| C13 | C20 | H36 | 109.5° | 109.5° |
| C13 | C20 | H37 | 109.5° | 109.4° |
| O32 | C8 | H28 | 119.2° | 120.0° |
| C13 | C12 | C21 | 109.5° | 110.1° |
| C12 | C13 | C14 | 108.3° | 109.5° |
| C13 | C12 | H33 | 110.3° | 110.4° |
| C12 | C13 | H34 | 109.5° | 109.5° |
| C12 | C21 | C9 | 105.6° | 106.6° |
| C12 | C21 | H31 | 110.4° | 109.9° |
| C12 | C21 | H32 | 110.4° | 110.2° |
| C21 | C12 | H33 | 110.3° | 111.0° |
| C13 | C14 | C15 | 112.3° | 109.5° |
| C14 | C13 | H34 | 109.7° | 109.5° |
| C13 | C14 | H38 | 108.8° | 109.5° |
| C13 | C14 | H39 | 108.8° | 109.4° |
| C21 | C9 | H29 | 111.6° | 111.5° |
| C21 | C9 | H30 | 111.5° | 110.4° |
| C9 | C21 | H31 | 110.4° | 110.0° |
| C9 | C21 | H32 | 110.4° | 110.3° |
| C18 | C17 | C16 | 110.5° | 120.0° |
| C18 | C17 | C19 | 108.6° | 120.0° |
| C17 | C18 | H48 | 109.5° | 109.5° |
| C17 | C18 | H49 | 109.5° | 109.5° |
| C17 | C18 | H50 | 109.4° | 109.4° |
| C15 | C16 | C17 | 110.6° | 120.0° |
| C16 | C15 | C14 | 111.5° | 109.5° |
| C16 | C15 | H40 | 109.0° | 109.5° |
| C16 | C15 | H41 | 109.0° | 109.5° |
| C15 | C16 | H42 | 124.7° | 120.0° |
| C16 | C17 | C19 | 109.6° | 120.0° |
| C17 | C16 | H42 | 124.7° | 120.0° |
| C15 | C14 | H38 | 108.8° | 109.5° |
| C15 | C14 | H39 | 108.8° | 109.5° |
| C14 | C15 | H40 | 108.9° | 109.5° |
| C14 | C15 | H41 | 109.0° | 109.5° |
| C17 | C19 | H45 | 109.5° | 109.5° |
| C17 | C19 | H46 | 109.4° | 109.4° |
| C17 | C19 | H47 | 109.5° | 109.4° |
| H1 | C2 | H2 | 109.5° | 109.4° |
| H1 | C2 | H3 | 109.4° | 109.5° |
| H2 | C2 | H3 | 109.5° | 109.5° |
| H4 | C31 | H5 | 109.5° | 109.4° |
| H6 | C30 | H7 | 109.4° | 107.7° |
| H10 | C26 | H11 | 109.5° | 109.5° |
| H10 | C26 | H12 | 109.4° | 109.5° |
| H11 | C26 | H12 | 109.5° | 109.4° |
| H13 | C27 | H14 | 109.5° | 109.5° |
| H13 | C27 | H15 | 109.5° | 109.5° |
| H14 | C27 | H15 | 109.5° | 109.5° |
| H17 | C4 | H18 | 109.5° | 109.1° |
| H19 | C5 | H20 | 109.4° | 109.1° |
| H21 | C23 | H22 | 109.4° | 107.8° |
| H23 | C22 | H24 | 109.5° | 108.0° |
| H25 | C11 | H26 | 109.5° | 109.4° |
| H25 | C11 | H27 | 109.5° | 109.5° |
| H26 | C11 | H27 | 109.5° | 109.5° |
| H29 | C9 | H30 | 109.5° | 110.3° |
| H31 | C21 | H32 | 109.5° | 109.9° |
| H35 | C20 | H36 | 109.5° | 109.5° |
| H35 | C20 | H37 | 109.4° | 109.5° |
| H36 | C20 | H37 | 109.5° | 109.4° |
| H38 | C14 | H39 | 109.5° | 109.5° |
| H40 | C15 | H41 | 109.5° | 109.4° |
| H45 | C19 | H46 | 109.5° | 109.5° |
| H45 | C19 | H47 | 109.5° | 109.5° |
| H46 | C19 | H47 | 109.5° | 109.5° |
| H48 | C18 | H49 | 109.4° | 109.5° |
| H48 | C18 | H50 | 109.5° | 109.5° |
| H49 | C18 | H50 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O29 | C28 | C30 | C25 | 120.2° | 121.0° |
| O29 | C28 | C30 | H8 | 120.8° | 118.3° |
| O29 | C28 | C30 | C31 | 174.2° | 177.8° |
| O29 | C28 | C25 | H8 | 120.6° | 117.9° |
| O29 | C28 | C25 | C26 | 53.8° | 43.2° |
| O29 | C28 | C25 | C27 | 64.0° | 72.6° |
| O29 | C28 | C25 | C3 | 179.9° | 169.4° |
| O29 | C28 | C30 | H6 | 54.0° | 54.5° |
| O29 | C28 | C30 | H7 | 65.7° | 63.5° |
| C28 | C30 | C31 | H6 | 120.1° | 123.0° |
| C28 | C30 | C31 | H7 | 120.2° | 118.9° |
| C30 | C28 | C25 | H8 | 119.0° | 120.9° |
| C30 | C28 | C25 | C26 | 66.5° | 77.9° |
| C28 | C30 | C31 | C1 | 60.9° | 61.2° |
| C30 | C28 | C25 | C27 | 175.6° | 166.2° |
| C30 | C28 | C25 | C3 | 59.6° | 48.3° |
| C28 | C30 | C31 | H4 | 59.2° | 178.9° |
| C28 | C30 | C31 | H5 | 178.9° | 58.9° |
| C28 | C30 | H6 | H7 | 119.6° | 118.5° |
| C30 | C28 | O29 | H9 | 180.0° | 60.1° |
| C31 | C30 | C28 | C25 | 65.6° | 56.8° |
| C30 | C31 | C1 | H4 | 120.2° | 119.8° |
| C30 | C31 | C1 | H5 | 120.2° | 120.1° |
| C30 | C31 | C1 | C2 | 72.4° | 65.7° |
| C30 | C31 | C1 | C3 | 51.9° | 57.5° |
| C30 | C31 | C1 | C24 | 169.9° | 178.3° |
| C30 | C31 | H4 | H5 | 119.5° | 120.2° |
| C31 | C30 | H6 | H7 | 119.6° | 118.5° |
| C31 | C30 | C28 | H8 | 53.4° | 63.9° |
| C28 | C25 | C26 | C27 | 118.5° | 115.6° |
| C28 | C25 | C26 | C3 | 121.9° | 125.5° |
| C28 | C25 | C27 | C3 | 115.6° | 120.2° |
| C28 | C25 | C3 | C1 | 54.1° | 46.6° |
| C28 | C25 | C3 | C4 | 176.4° | 173.1° |
| C25 | C28 | C30 | H6 | 174.2° | 66.5° |
| C25 | C28 | C30 | H7 | 54.5° | 175.6° |
| C25 | C28 | O29 | H9 | 59.7° | 176.9° |
| C28 | C25 | C26 | H10 | 180.0° | 67.6° |
| C28 | C25 | C26 | H11 | 60.0° | 172.4° |
| C28 | C25 | C26 | H12 | 60.0° | 52.5° |
| C28 | C25 | C27 | H13 | 180.0° | 60.0° |
| C28 | C25 | C27 | H14 | 60.0° | 180.0° |
| C28 | C25 | C27 | H15 | 60.0° | 60.0° |
| C28 | C25 | C3 | H16 | 65.1° | 71.1° |
| C26 | C25 | C27 | C3 | 123.8° | 121.9° |
| C26 | C25 | C3 | C1 | 70.2° | 78.0° |
| C26 | C25 | C3 | C4 | 52.1° | 48.4° |
| C26 | C25 | C28 | H8 | 174.5° | 161.2° |
| C25 | C26 | H10 | H11 | 120.0° | 120.0° |
| C25 | C26 | H10 | H12 | 120.0° | 120.0° |
| C25 | C26 | H11 | H12 | 120.0° | 120.0° |
| C26 | C25 | C27 | H13 | 59.5° | 177.8° |
| C26 | C25 | C27 | H14 | 60.5° | 62.2° |
| C26 | C25 | C27 | H15 | 179.5° | 57.9° |
| C26 | C25 | C3 | H16 | 170.6° | 164.2° |
| C31 | C1 | C2 | C3 | 122.4° | 122.1° |
| C31 | C1 | C2 | C24 | 120.5° | 118.2° |
| C31 | C1 | C3 | C25 | 50.5° | 51.8° |
| C31 | C1 | C3 | C24 | 120.6° | 121.0° |
| C31 | C1 | C3 | C4 | 176.5° | 179.1° |
| C31 | C1 | C24 | C23 | 36.4° | 38.0° |
| C31 | C1 | C24 | C6 | 144.7° | 143.9° |
| C31 | C1 | C2 | H1 | 180.0° | 175.6° |
| C31 | C1 | C2 | H2 | 60.0° | 64.5° |
| C31 | C1 | C2 | H3 | 60.0° | 55.5° |
| C1 | C31 | H4 | H5 | 119.4° | 120.1° |
| C1 | C31 | C30 | H6 | 178.9° | 61.9° |
| C1 | C31 | C30 | H7 | 59.2° | 180.0° |
| C31 | C1 | C3 | H16 | 68.6° | 66.1° |
| C2 | C1 | C3 | C25 | 71.9° | 69.3° |
| C2 | C1 | C3 | C24 | 116.9° | 117.9° |
| C2 | C1 | C3 | C4 | 54.0° | 59.8° |
| C2 | C1 | C24 | C23 | 83.2° | 79.4° |
| C2 | C1 | C24 | C6 | 95.7° | 98.7° |
| C1 | C2 | H1 | H2 | 120.0° | 120.0° |
| C1 | C2 | H1 | H3 | 120.0° | 120.1° |
| C1 | C2 | H2 | H3 | 120.0° | 120.1° |
| C2 | C1 | C31 | H4 | 167.4° | 54.1° |
| C2 | C1 | C31 | H5 | 47.8° | 174.1° |
| C2 | C1 | C3 | H16 | 169.0° | 172.8° |
| C27 | C25 | C3 | C1 | 170.5° | 163.7° |
| C27 | C25 | C3 | C4 | 67.2° | 69.9° |
| C27 | C25 | C28 | H8 | 56.6° | 45.3° |
| C27 | C25 | C26 | H10 | 61.5° | 48.0° |
| C27 | C25 | C26 | H11 | 178.5° | 72.0° |
| C27 | C25 | C26 | H12 | 58.5° | 168.0° |
| C25 | C27 | H13 | H14 | 120.0° | 120.0° |
| C25 | C27 | H13 | H15 | 120.0° | 120.0° |
| C25 | C27 | H14 | H15 | 120.0° | 120.0° |
| C27 | C25 | C3 | H16 | 51.4° | 45.9° |
| C25 | C3 | C1 | C4 | 125.9° | 129.1° |
| C25 | C3 | C1 | H16 | 119.1° | 117.9° |
| C25 | C3 | C1 | C24 | 171.1° | 172.8° |
| C25 | C3 | C4 | H16 | 118.1° | 116.3° |
| C25 | C3 | C4 | C5 | 157.5° | 159.7° |
| C3 | C25 | C28 | H8 | 59.4° | 72.7° |
| C3 | C25 | C26 | H10 | 58.1° | 167.0° |
| C3 | C25 | C26 | H11 | 61.9° | 47.0° |
| C3 | C25 | C26 | H12 | 178.1° | 73.0° |
| C3 | C25 | C27 | H13 | 64.4° | 60.2° |
| C3 | C25 | C27 | H14 | 175.6° | 59.8° |
| C3 | C25 | C27 | H15 | 55.6° | 179.8° |
| C25 | C3 | C4 | H17 | 83.4° | 79.7° |
| C25 | C3 | C4 | H18 | 38.4° | 42.5° |
| C1 | C3 | C4 | H16 | 114.5° | 113.3° |
| C3 | C1 | C24 | C23 | 156.0° | 159.2° |
| C3 | C1 | C24 | C6 | 25.1° | 22.7° |
| C1 | C3 | C4 | C5 | 75.1° | 69.9° |
| C3 | C1 | C2 | H1 | 57.5° | 53.5° |
| C3 | C1 | C2 | H2 | 177.6° | 173.4° |
| C3 | C1 | C2 | H3 | 62.4° | 66.6° |
| C3 | C1 | C31 | H4 | 68.3° | 177.3° |
| C3 | C1 | C31 | H5 | 172.1° | 62.6° |
| C1 | C3 | C4 | H17 | 44.0° | 50.7° |
| C1 | C3 | C4 | H18 | 165.8° | 172.9° |
| C24 | C1 | C3 | C4 | 62.9° | 58.1° |
| C1 | C24 | C23 | C6 | 178.9° | 178.0° |
| C1 | C24 | C23 | C22 | 152.4° | 174.6° |
| C1 | C24 | C6 | C5 | 0.6° | 0.9° |
| C1 | C24 | C6 | C7 | 177.8° | 177.3° |
| C24 | C1 | C2 | H1 | 59.5° | 66.2° |
| C24 | C1 | C2 | H2 | 60.5° | 53.7° |
| C24 | C1 | C2 | H3 | 179.5° | 173.8° |
| C24 | C1 | C31 | H4 | 49.7° | 61.9° |
| C24 | C1 | C31 | H5 | 69.9° | 58.1° |
| C24 | C1 | C3 | H16 | 52.1° | 54.9° |
| C1 | C24 | C23 | H21 | 86.8° | 54.8° |
| C1 | C24 | C23 | H22 | 31.6° | 62.5° |
| C3 | C4 | C5 | H17 | 119.1° | 122.2° |
| C3 | C4 | C5 | H18 | 119.1° | 118.5° |
| C3 | C4 | C5 | C6 | 48.6° | 44.9° |
| C3 | C4 | H17 | H18 | 122.6° | 122.8° |
| C3 | C4 | C5 | H19 | 169.0° | 165.3° |
| C3 | C4 | C5 | H20 | 71.8° | 76.1° |
| C24 | C23 | C22 | H21 | 120.8° | 120.2° |
| C24 | C23 | C22 | H22 | 120.8° | 123.2° |
| C24 | C23 | C22 | C10 | 3.4° | 37.9° |
| C23 | C24 | C6 | C5 | 179.4° | 177.0° |
| C23 | C24 | C6 | C7 | 1.0° | 4.8° |
| C24 | C23 | H21 | H22 | 117.5° | 118.4° |
| C24 | C23 | C22 | H23 | 124.0° | 86.4° |
| C24 | C23 | C22 | H24 | 117.1° | 155.2° |
| C22 | C23 | C24 | C6 | 26.5° | 7.4° |
| C23 | C22 | C10 | H23 | 120.5° | 122.9° |
| C23 | C22 | C10 | H24 | 120.6° | 117.0° |
| C23 | C22 | C10 | C11 | 81.9° | 55.3° |
| C23 | C22 | C10 | C7 | 39.9° | 65.7° |
| C23 | C22 | C10 | C12 | 154.3° | 179.6° |
| C22 | C23 | H21 | H22 | 117.5° | 117.5° |
| C23 | C22 | H23 | H24 | 118.3° | 118.5° |
| C24 | C6 | C5 | C4 | 12.7° | 11.2° |
| C24 | C6 | C5 | C7 | 178.4° | 178.3° |
| C24 | C6 | C7 | C10 | 44.5° | 32.6° |
| C24 | C6 | C7 | C8 | 78.7° | 89.4° |
| C24 | C6 | C7 | C9 | 153.2° | 147.4° |
| C24 | C6 | C5 | H19 | 133.1° | 131.4° |
| C24 | C6 | C5 | H20 | 107.7° | 109.6° |
| C6 | C24 | C23 | H21 | 94.4° | 127.2° |
| C6 | C24 | C23 | H22 | 147.3° | 115.5° |
| C4 | C5 | C6 | H19 | 120.4° | 120.2° |
| C4 | C5 | C6 | H20 | 120.4° | 120.8° |
| C4 | C5 | C6 | C7 | 165.7° | 170.5° |
| C5 | C4 | C3 | H16 | 39.4° | 43.5° |
| C5 | C4 | H17 | H18 | 122.6° | 118.8° |
| C4 | C5 | H19 | H20 | 118.8° | 118.4° |
| C22 | C10 | C7 | C6 | 64.1° | 63.8° |
| C22 | C10 | C11 | C7 | 121.8° | 118.6° |
| C22 | C10 | C11 | C12 | 126.9° | 130.0° |
| C22 | C10 | C7 | C12 | 122.1° | 124.0° |
| C22 | C10 | C7 | C8 | 59.8° | 56.8° |
| C22 | C10 | C7 | C9 | 175.5° | 171.9° |
| C22 | C10 | C12 | C13 | 90.4° | 89.9° |
| C22 | C10 | C12 | C21 | 151.7° | 152.1° |
| C10 | C22 | C23 | H21 | 117.4° | 158.1° |
| C10 | C22 | C23 | H22 | 124.2° | 85.3° |
| C10 | C22 | H23 | H24 | 118.3° | 120.6° |
| C22 | C10 | C11 | H25 | 180.0° | 60.7° |
| C22 | C10 | C11 | H26 | 60.0° | 179.3° |
| C22 | C10 | C11 | H27 | 60.0° | 59.3° |
| C22 | C10 | C12 | H33 | 34.3° | 32.5° |
| C5 | C6 | C7 | C10 | 134.0° | 149.0° |
| C5 | C6 | C7 | C8 | 102.8° | 89.0° |
| C5 | C6 | C7 | C9 | 25.3° | 34.3° |
| C6 | C5 | C4 | H17 | 70.5° | 77.4° |
| C6 | C5 | C4 | H18 | 167.7° | 163.4° |
| C6 | C5 | H19 | H20 | 118.8° | 119.0° |
| C6 | C7 | C10 | C11 | 57.9° | 56.7° |
| C6 | C7 | C10 | C8 | 124.0° | 120.6° |
| C6 | C7 | C10 | C9 | 120.4° | 124.3° |
| C6 | C7 | C10 | C12 | 173.8° | 172.2° |
| C6 | C7 | C8 | C9 | 130.9° | 128.3° |
| C6 | C7 | C8 | O32 | 87.6° | 0.7° |
| C6 | C7 | C9 | C21 | 166.0° | 159.8° |
| C7 | C6 | C5 | H19 | 45.3° | 50.3° |
| C7 | C6 | C5 | H20 | 73.9° | 68.7° |
| C6 | C7 | C8 | H28 | 92.4° | 179.3° |
| C6 | C7 | C9 | H29 | 47.4° | 40.3° |
| C6 | C7 | C9 | H30 | 75.4° | 82.5° |
| C11 | C10 | C7 | C12 | 115.9° | 115.5° |
| C11 | C10 | C7 | C8 | 178.1° | 177.3° |
| C11 | C10 | C7 | C9 | 62.5° | 67.6° |
| C11 | C10 | C12 | C13 | 34.1° | 36.0° |
| C11 | C10 | C12 | C21 | 83.9° | 82.0° |
| C11 | C10 | C22 | H23 | 157.5° | 178.2° |
| C11 | C10 | C22 | H24 | 38.6° | 61.7° |
| C10 | C11 | H25 | H26 | 120.0° | 120.0° |
| C10 | C11 | H25 | H27 | 120.0° | 120.0° |
| C10 | C11 | H26 | H27 | 120.0° | 120.0° |
| C11 | C10 | C12 | H33 | 158.8° | 158.4° |
| C10 | C7 | C8 | C9 | 107.9° | 110.9° |
| C10 | C7 | C8 | O32 | 151.2° | 120.1° |
| C7 | C10 | C12 | C13 | 150.7° | 153.3° |
| C7 | C10 | C12 | C21 | 32.8° | 35.3° |
| C10 | C7 | C9 | C21 | 51.7° | 40.9° |
| C7 | C10 | C22 | H23 | 80.6° | 57.2° |
| C7 | C10 | C22 | H24 | 160.5° | 177.3° |
| C7 | C10 | C11 | H25 | 58.2° | 57.9° |
| C7 | C10 | C11 | H26 | 178.2° | 62.1° |
| C7 | C10 | C11 | H27 | 61.8° | 177.9° |
| C10 | C7 | C8 | H28 | 28.8° | 60.0° |
| C10 | C7 | C9 | H29 | 66.9° | 78.7° |
| C10 | C7 | C9 | H30 | 170.3° | 158.5° |
| C7 | C10 | C12 | H33 | 84.6° | 84.2° |
| C12 | C10 | C7 | C8 | 62.3° | 67.2° |
| C12 | C10 | C7 | C9 | 53.4° | 47.9° |
| C10 | C12 | C13 | C20 | 74.9° | 65.0° |
| C10 | C12 | C13 | C21 | 113.6° | 114.3° |
| C10 | C12 | C13 | H33 | 124.8° | 122.8° |
| C10 | C12 | C21 | H33 | 117.5° | 119.5° |
| C10 | C12 | C13 | C14 | 166.3° | 175.0° |
| C10 | C12 | C21 | C9 | 0.8° | 10.1° |
| C12 | C10 | C22 | H23 | 33.7° | 56.7° |
| C12 | C10 | C22 | H24 | 85.2° | 63.4° |
| C12 | C10 | C11 | H25 | 53.1° | 169.3° |
| C12 | C10 | C11 | H26 | 66.9° | 49.3° |
| C12 | C10 | C11 | H27 | 173.1° | 70.7° |
| C10 | C12 | C21 | H31 | 120.2° | 109.0° |
| C10 | C12 | C21 | H32 | 118.5° | 129.8° |
| C10 | C12 | C13 | H34 | 46.7° | 55.0° |
| C7 | C8 | O32 | H28 | 180.0° | 180.0° |
| C8 | C7 | C9 | C21 | 64.8° | 76.5° |
| C8 | C7 | C9 | H29 | 176.6° | 163.9° |
| C8 | C7 | C9 | H30 | 53.8° | 41.1° |
| C9 | C7 | C8 | O32 | 43.2° | 129.0° |
| C7 | C9 | C21 | C12 | 32.0° | 19.2° |
| C7 | C9 | C21 | H29 | 118.6° | 119.7° |
| C7 | C9 | C21 | H30 | 118.6° | 117.4° |
| C9 | C7 | C8 | H28 | 136.8° | 51.0° |
| C7 | C9 | H29 | H30 | 124.0° | 122.7° |
| C7 | C9 | C21 | H31 | 87.4° | 138.4° |
| C7 | C9 | C21 | H32 | 151.4° | 100.3° |
| C20 | C13 | C12 | C14 | 118.8° | 120.0° |
| C20 | C13 | C12 | H34 | 121.6° | 120.0° |
| C20 | C13 | C12 | C21 | 171.5° | 179.3° |
| C20 | C13 | C14 | H34 | 119.5° | 120.0° |
| C20 | C13 | C14 | C15 | 50.8° | 65.0° |
| C20 | C13 | C12 | H33 | 49.9° | 57.7° |
| C13 | C20 | H35 | H36 | 120.0° | 120.1° |
| C13 | C20 | H35 | H37 | 120.0° | 119.9° |
| C13 | C20 | H36 | H37 | 120.0° | 119.9° |
| C20 | C13 | C14 | H38 | 171.3° | 175.0° |
| C20 | C13 | C14 | H39 | 69.6° | 55.0° |
| C13 | C12 | C21 | H33 | 121.6° | 122.6° |
| C12 | C13 | C14 | H34 | 119.4° | 120.0° |
| C13 | C12 | C21 | C9 | 121.8° | 128.0° |
| C12 | C13 | C14 | C15 | 171.9° | 175.0° |
| C13 | C12 | C21 | H31 | 118.9° | 8.8° |
| C13 | C12 | C21 | H32 | 2.4° | 112.4° |
| C12 | C13 | C20 | H35 | 180.0° | 52.8° |
| C12 | C13 | C20 | H36 | 60.0° | 67.3° |
| C12 | C13 | C20 | H37 | 60.0° | 172.7° |
| C12 | C13 | C14 | H38 | 67.6° | 55.0° |
| C12 | C13 | C14 | H39 | 51.5° | 65.0° |
| C21 | C12 | C13 | C14 | 52.7° | 60.7° |
| C12 | C21 | C9 | H31 | 119.4° | 119.1° |
| C12 | C21 | C9 | H32 | 119.4° | 119.6° |
| C12 | C21 | C9 | H29 | 86.6° | 100.5° |
| C12 | C21 | C9 | H30 | 150.6° | 136.7° |
| C12 | C21 | H31 | H32 | 121.8° | 121.4° |
| C21 | C12 | C13 | H34 | 66.9° | 59.3° |
| C13 | C14 | C15 | C16 | 69.2° | 180.0° |
| C13 | C14 | C15 | H38 | 120.4° | 120.0° |
| C13 | C14 | C15 | H39 | 120.4° | 119.9° |
| C14 | C13 | C12 | H33 | 68.9° | 62.2° |
| C14 | C13 | C20 | H35 | 61.0° | 67.2° |
| C14 | C13 | C20 | H36 | 59.0° | 172.7° |
| C14 | C13 | C20 | H37 | 179.0° | 52.8° |
| C13 | C14 | H38 | H39 | 118.7° | 120.0° |
| C13 | C14 | C15 | H40 | 51.1° | 60.0° |
| C13 | C14 | C15 | H41 | 170.5° | 60.0° |
| C21 | C9 | H29 | H30 | 124.0° | 122.9° |
| C9 | C21 | H31 | H32 | 121.8° | 121.6° |
| C9 | C21 | C12 | H33 | 116.6° | 109.4° |
| C18 | C17 | C16 | C15 | 55.6° | 172.7° |
| C18 | C17 | C16 | C19 | 119.7° | 180.0° |
| C18 | C17 | C16 | H42 | 124.4° | 7.3° |
| C18 | C17 | C19 | H45 | 180.0° | 174.7° |
| C18 | C17 | C19 | H46 | 60.0° | 54.7° |
| C18 | C17 | C19 | H47 | 60.0° | 65.2° |
| C17 | C18 | H48 | H49 | 120.0° | 120.0° |
| C17 | C18 | H48 | H50 | 120.0° | 120.0° |
| C17 | C18 | H49 | H50 | 120.0° | 120.0° |
| C15 | C16 | C17 | H42 | 180.0° | 180.0° |
| C16 | C15 | C14 | H40 | 120.3° | 120.0° |
| C16 | C15 | C14 | H41 | 120.3° | 120.0° |
| C15 | C16 | C17 | C19 | 175.3° | 7.2° |
| C16 | C15 | C14 | H38 | 51.2° | 60.0° |
| C16 | C15 | C14 | H39 | 170.4° | 60.0° |
| C16 | C15 | H40 | H41 | 119.1° | 120.0° |
| C17 | C16 | C15 | C14 | 164.6° | 127.8° |
| C17 | C16 | C15 | H40 | 75.1° | 7.8° |
| C17 | C16 | C15 | H41 | 44.3° | 112.2° |
| C16 | C17 | C19 | H45 | 59.2° | 5.3° |
| C16 | C17 | C19 | H46 | 179.2° | 125.3° |
| C16 | C17 | C19 | H47 | 60.8° | 114.7° |
| C16 | C17 | C18 | H48 | 180.0° | 90.0° |
| C16 | C17 | C18 | H49 | 60.0° | 150.0° |
| C16 | C17 | C18 | H50 | 60.0° | 30.0° |
| C15 | C14 | C13 | H34 | 68.7° | 55.0° |
| C15 | C14 | H38 | H39 | 118.7° | 120.0° |
| C14 | C15 | H40 | H41 | 119.1° | 120.0° |
| C14 | C15 | C16 | H42 | 15.4° | 52.2° |
| C19 | C17 | C16 | H42 | 4.7° | 172.7° |
| C17 | C19 | H45 | H46 | 120.0° | 120.0° |
| C17 | C19 | H45 | H47 | 120.0° | 120.0° |
| C17 | C19 | H46 | H47 | 120.0° | 119.9° |
| C19 | C17 | C18 | H48 | 59.7° | 90.0° |
| C19 | C17 | C18 | H49 | 179.7° | 30.0° |
| C19 | C17 | C18 | H50 | 60.3° | 150.0° |
| H1 | C2 | H2 | H3 | 120.0° | 119.9° |
| H4 | C31 | C30 | H6 | 60.9° | 58.1° |
| H4 | C31 | C30 | H7 | 179.4° | 60.0° |
| H5 | C31 | C30 | H6 | 58.7° | 178.1° |
| H5 | C31 | C30 | H7 | 61.0° | 60.0° |
| H6 | C30 | C28 | H8 | 66.8° | 172.8° |
| H7 | C30 | C28 | H8 | 173.5° | 54.8° |
| H8 | C28 | O29 | H9 | 60.0° | 58.7° |
| H10 | C26 | H11 | H12 | 120.0° | 120.0° |
| H13 | C27 | H14 | H15 | 120.0° | 120.0° |
| H16 | C3 | C4 | H17 | 158.5° | 164.1° |
| H16 | C3 | C4 | H18 | 79.7° | 73.8° |
| H17 | C4 | C5 | H19 | 49.9° | 43.1° |
| H17 | C4 | C5 | H20 | 169.1° | 161.7° |
| H18 | C4 | C5 | H19 | 71.9° | 76.2° |
| H18 | C4 | C5 | H20 | 47.3° | 42.4° |
| H21 | C23 | C22 | H23 | 3.2° | 33.8° |
| H21 | C23 | C22 | H24 | 122.1° | 84.6° |
| H22 | C23 | C22 | H23 | 115.2° | 150.4° |
| H22 | C23 | C22 | H24 | 3.7° | 32.1° |
| H25 | C11 | H26 | H27 | 120.0° | 120.0° |
| H29 | C9 | C21 | H31 | 154.0° | 18.7° |
| H29 | C9 | C21 | H32 | 32.7° | 140.0° |
| H30 | C9 | C21 | H31 | 31.2° | 104.2° |
| H30 | C9 | C21 | H32 | 90.1° | 17.1° |
| H31 | C21 | C12 | H33 | 2.7° | 131.4° |
| H32 | C21 | C12 | H33 | 124.0° | 10.2° |
| H33 | C12 | C13 | H34 | 171.5° | 177.8° |
| H34 | C13 | C20 | H35 | 58.5° | 172.8° |
| H34 | C13 | C20 | H36 | 178.5° | 52.7° |
| H34 | C13 | C20 | H37 | 61.5° | 67.2° |
| H34 | C13 | C14 | H38 | 51.8° | 65.0° |
| H34 | C13 | C14 | H39 | 170.9° | 175.0° |
| H35 | C20 | H36 | H37 | 120.0° | 120.0° |
| H38 | C14 | C15 | H40 | 171.5° | 180.0° |
| H38 | C14 | C15 | H41 | 69.1° | 60.0° |
| H39 | C14 | C15 | H40 | 69.3° | 60.0° |
| H39 | C14 | C15 | H41 | 50.0° | 180.0° |
| H40 | C15 | C16 | H42 | 104.9° | 172.2° |
| H41 | C15 | C16 | H42 | 135.7° | 67.8° |
| H45 | C19 | H46 | H47 | 120.0° | 120.1° |
| H48 | C18 | H49 | H50 | 120.0° | 120.0° |
