IFK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C14 | sing | 1.53Å | 1.51Å | |
| C13 | C14 | sing | 1.53Å | 1.54Å | |
| C13 | C12 | sing | 1.53Å | 1.54Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| C14 | O16 | sing | 1.43Å | 1.44Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C11 | C9 | sing | 1.53Å | 1.54Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C9 | C8 | sing | 1.53Å | 1.54Å | |
| C1 | C2 | sing | 1.53Å | 1.54Å | |
| C8 | C2 | sing | 1.54Å | 1.55Å | |
| C8 | C7 | sing | 1.51Å | 1.53Å | |
| C21 | C2 | sing | 1.53Å | 1.54Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.51Å | 1.56Å | |
| C20 | C19 | sing | 1.53Å | 1.53Å | |
| C32 | C28 | doub | 1.31Å | 1.32Å | |
| C25 | C24 | sing | 1.51Å | 1.50Å | |
| C25 | C26 | sing | 1.53Å | 1.52Å | |
| O27 | C26 | sing | 1.43Å | 1.42Å | |
| C28 | C26 | sing | 1.51Å | 1.50Å | |
| C28 | C29 | sing | 1.51Å | 1.51Å | |
| C31 | C24 | sing | 1.51Å | 1.50Å | |
| C31 | C29 | sing | 1.53Å | 1.52Å | |
| C7 | C6 | sing | 1.52Å | 1.53Å | |
| C24 | C23 | doub | 1.33Å | 1.30Å | |
| C19 | C18 | sing | 1.52Å | 1.50Å | |
| C3 | C18 | sing | 1.50Å | 1.51Å | |
| C3 | C4 | sing | 1.47Å | 1.53Å | |
| C23 | C22 | sing | 1.47Å | 1.39Å | |
| C22 | C18 | doub | 1.33Å | 1.35Å | |
| C29 | O30 | sing | 1.43Å | 1.43Å | |
| C5 | C4 | sing | 1.55Å | 1.53Å | |
| C5 | C6 | sing | 1.48Å | 1.51Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C5 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C10 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C15 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.08Å | 1.08Å | |
| C26 | H24 | sing | 1.09Å | 1.10Å | |
| C1 | H25 | sing | 1.09Å | 1.10Å | |
| C1 | H26 | sing | 1.09Å | 1.10Å | |
| C1 | H27 | sing | 1.09Å | 1.10Å | |
| C11 | H28 | sing | 1.09Å | 1.10Å | |
| C11 | H29 | sing | 1.09Å | 1.10Å | |
| C12 | H30 | sing | 1.09Å | 1.10Å | |
| C12 | H31 | sing | 1.09Å | 1.10Å | |
| C19 | H32 | sing | 1.09Å | 1.10Å | |
| C19 | H33 | sing | 1.09Å | 1.10Å | |
| C23 | H34 | sing | 1.08Å | 1.08Å | |
| C25 | H35 | sing | 1.09Å | 1.10Å | |
| C25 | H36 | sing | 1.09Å | 1.10Å | |
| C29 | H37 | sing | 1.09Å | 1.10Å | |
| C3 | H38 | sing | 1.09Å | 1.10Å | |
| C31 | H39 | sing | 1.09Å | 1.10Å | |
| C31 | H40 | sing | 1.09Å | 1.10Å | |
| C32 | H41 | sing | 1.08Å | 1.08Å | |
| C32 | H42 | sing | 1.08Å | 1.08Å | |
| C9 | H43 | sing | 1.09Å | 1.10Å | |
| O16 | H44 | sing | 0.97Å | 0.95Å | |
| O27 | H45 | sing | 0.97Å | 0.95Å | |
| O30 | H46 | sing | 0.97Å | 0.95Å | |
| C6 | 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 | C14 | C13 | 110.7° | 109.5° |
| C17 | C14 | C15 | 110.5° | 109.5° |
| C17 | C14 | O16 | 107.4° | 109.4° |
| C14 | C17 | H16 | 109.5° | 109.5° |
| C14 | C17 | H17 | 109.5° | 109.5° |
| C14 | C17 | H18 | 109.5° | 109.5° |
| C14 | C13 | C12 | 117.1° | 109.5° |
| C13 | C14 | C15 | 112.1° | 109.5° |
| C13 | C14 | O16 | 108.7° | 109.5° |
| C14 | C13 | H11 | 107.5° | 109.5° |
| C14 | C13 | H12 | 107.6° | 109.5° |
| C13 | C12 | C11 | 112.1° | 109.5° |
| C12 | C13 | H11 | 107.6° | 109.5° |
| C12 | C13 | H12 | 107.6° | 109.4° |
| C13 | C12 | H30 | 108.8° | 109.4° |
| C13 | C12 | H31 | 108.8° | 109.5° |
| C15 | C14 | O16 | 107.3° | 109.5° |
| C14 | C15 | H13 | 109.5° | 109.5° |
| C14 | C15 | H14 | 109.5° | 109.5° |
| C14 | C15 | H15 | 109.5° | 109.4° |
| C14 | O16 | H44 | 109.5° | 114.1° |
| C12 | C11 | C9 | 118.1° | 109.5° |
| C12 | C11 | H28 | 107.3° | 109.4° |
| C12 | C11 | H29 | 107.3° | 109.5° |
| C11 | C12 | H30 | 108.8° | 109.4° |
| C11 | C12 | H31 | 108.8° | 109.5° |
| C11 | C9 | C10 | 111.3° | 109.5° |
| C11 | C9 | C8 | 108.6° | 109.5° |
| C9 | C11 | H28 | 107.3° | 109.4° |
| C9 | C11 | H29 | 107.3° | 109.5° |
| C11 | C9 | H43 | 107.8° | 109.5° |
| C10 | C9 | C8 | 113.0° | 109.5° |
| C9 | C10 | H8 | 109.5° | 109.5° |
| C9 | C10 | H9 | 109.5° | 109.5° |
| C9 | C10 | H10 | 109.4° | 109.5° |
| C10 | C9 | H43 | 108.1° | 109.4° |
| C9 | C8 | C2 | 114.7° | 109.4° |
| C9 | C8 | C7 | 115.2° | 109.5° |
| C9 | C8 | H7 | 102.4° | 109.4° |
| C8 | C9 | H43 | 107.9° | 109.4° |
| C1 | C2 | C8 | 109.4° | 107.0° |
| C1 | C2 | C21 | 108.0° | 106.9° |
| C1 | C2 | C3 | 110.1° | 106.5° |
| C2 | C1 | H25 | 109.5° | 109.5° |
| C2 | C1 | H26 | 109.5° | 109.5° |
| C2 | C1 | H27 | 109.5° | 109.5° |
| C2 | C8 | C7 | 116.7° | 109.5° |
| C8 | C2 | C21 | 106.3° | 111.7° |
| C8 | C2 | C3 | 115.8° | 114.0° |
| C2 | C8 | H7 | 102.3° | 109.5° |
| C8 | C7 | C6 | 116.0° | 109.9° |
| C8 | C7 | H6 | 107.8° | 109.4° |
| C7 | C8 | H7 | 102.5° | 109.4° |
| C8 | C7 | H48 | 107.8° | 109.3° |
| C2 | C21 | C20 | 113.0° | 109.0° |
| C21 | C2 | C3 | 106.8° | 110.3° |
| C2 | C21 | H21 | 108.6° | 109.6° |
| C2 | C21 | H22 | 108.6° | 109.6° |
| C21 | C20 | C19 | 111.7° | 110.4° |
| C21 | C20 | H19 | 108.9° | 109.3° |
| C21 | C20 | H20 | 108.9° | 109.2° |
| C20 | C21 | H21 | 108.6° | 109.5° |
| C20 | C21 | H22 | 108.6° | 109.5° |
| C2 | C3 | C18 | 110.2° | 110.5° |
| C2 | C3 | C4 | 117.1° | 120.8° |
| C2 | C3 | H38 | 105.4° | 101.9° |
| C20 | C19 | C18 | 109.6° | 109.0° |
| C19 | C20 | H19 | 108.9° | 109.3° |
| C19 | C20 | H20 | 108.9° | 109.4° |
| C20 | C19 | H32 | 109.4° | 109.5° |
| C20 | C19 | H33 | 109.4° | 109.5° |
| C32 | C28 | C26 | 122.5° | 120.6° |
| C32 | C28 | C29 | 123.1° | 120.7° |
| C28 | C32 | H41 | 120.0° | 120.0° |
| C28 | C32 | H42 | 120.0° | 120.0° |
| C24 | C25 | C26 | 113.2° | 108.6° |
| C25 | C24 | C31 | 117.0° | 118.9° |
| C25 | C24 | C23 | 121.1° | 120.6° |
| C24 | C25 | H35 | 108.6° | 109.5° |
| C24 | C25 | H36 | 108.5° | 109.6° |
| C25 | C26 | O27 | 112.0° | 110.0° |
| C25 | C26 | C28 | 110.1° | 108.6° |
| C25 | C26 | H24 | 107.6° | 109.7° |
| C26 | C25 | H35 | 108.5° | 109.6° |
| C26 | C25 | H36 | 108.5° | 109.7° |
| O27 | C26 | C28 | 110.3° | 109.6° |
| O27 | C26 | H24 | 108.9° | 109.3° |
| C26 | O27 | H45 | 109.5° | 114.0° |
| C26 | C28 | C29 | 114.4° | 118.7° |
| C28 | C26 | H24 | 107.8° | 109.6° |
| C28 | C29 | C31 | 109.7° | 108.7° |
| C28 | C29 | O30 | 109.0° | 109.6° |
| C28 | C29 | H37 | 109.5° | 109.6° |
| C24 | C31 | C29 | 116.3° | 108.6° |
| C31 | C24 | C23 | 121.7° | 120.6° |
| C24 | C31 | H39 | 107.7° | 109.6° |
| C24 | C31 | H40 | 107.7° | 109.6° |
| C31 | C29 | O30 | 108.8° | 109.3° |
| C31 | C29 | H37 | 109.3° | 109.9° |
| C29 | C31 | H39 | 107.7° | 109.7° |
| C29 | C31 | H40 | 107.7° | 109.6° |
| C7 | C6 | C5 | 116.2° | 115.0° |
| C7 | C6 | H5 | 107.8° | 108.3° |
| C6 | C7 | H6 | 107.8° | 109.4° |
| C7 | C6 | H47 | 107.7° | 108.2° |
| C6 | C7 | H48 | 107.8° | 109.4° |
| C24 | C23 | C22 | 125.4° | 120.0° |
| C24 | C23 | H34 | 117.3° | 120.0° |
| C19 | C18 | C3 | 111.0° | 116.9° |
| C19 | C18 | C22 | 125.4° | 121.5° |
| C18 | C19 | H32 | 109.4° | 109.5° |
| C18 | C19 | H33 | 109.4° | 109.6° |
| C18 | C3 | C4 | 111.6° | 116.6° |
| C3 | C18 | C22 | 123.3° | 121.5° |
| C18 | C3 | H38 | 105.9° | 101.4° |
| C3 | C4 | C5 | 115.0° | 111.3° |
| C3 | C4 | H1 | 108.1° | 109.1° |
| C3 | C4 | H2 | 108.1° | 109.1° |
| C4 | C3 | H38 | 105.7° | 101.8° |
| C23 | C22 | C18 | 125.3° | 120.0° |
| C23 | C22 | H23 | 117.3° | 120.0° |
| C22 | C23 | H34 | 117.3° | 120.0° |
| C18 | C22 | H23 | 117.3° | 120.0° |
| O30 | C29 | H37 | 110.6° | 109.6° |
| C29 | O30 | H46 | 109.5° | 114.0° |
| C4 | C5 | C6 | 116.1° | 109.1° |
| C5 | C4 | H1 | 108.1° | 109.1° |
| C5 | C4 | H2 | 108.0° | 109.1° |
| C4 | C5 | H3 | 107.8° | 109.6° |
| C4 | C5 | H4 | 107.8° | 109.5° |
| C6 | C5 | H3 | 107.8° | 109.5° |
| C6 | C5 | H4 | 107.8° | 109.5° |
| C5 | C6 | H5 | 107.8° | 108.4° |
| C5 | C6 | H47 | 107.8° | 108.4° |
| H1 | C4 | H2 | 109.4° | 109.1° |
| H3 | C5 | H4 | 109.5° | 109.6° |
| H5 | C6 | H47 | 109.5° | 108.3° |
| H6 | C7 | H48 | 109.4° | 109.4° |
| H8 | C10 | H9 | 109.4° | 109.5° |
| H8 | C10 | H10 | 109.5° | 109.4° |
| H9 | C10 | H10 | 109.5° | 109.5° |
| H11 | C13 | H12 | 109.4° | 109.5° |
| H13 | C15 | H14 | 109.5° | 109.5° |
| H13 | C15 | H15 | 109.5° | 109.4° |
| H14 | C15 | H15 | 109.5° | 109.5° |
| H16 | C17 | H17 | 109.5° | 109.5° |
| H16 | C17 | H18 | 109.5° | 109.4° |
| H17 | C17 | H18 | 109.4° | 109.4° |
| H19 | C20 | H20 | 109.5° | 109.3° |
| H21 | C21 | H22 | 109.5° | 109.7° |
| H25 | C1 | H26 | 109.5° | 109.5° |
| H25 | C1 | H27 | 109.5° | 109.5° |
| H26 | C1 | H27 | 109.5° | 109.4° |
| H28 | C11 | H29 | 109.5° | 109.5° |
| H30 | C12 | H31 | 109.5° | 109.5° |
| H32 | C19 | H33 | 109.5° | 109.7° |
| H35 | C25 | H36 | 109.5° | 109.8° |
| H39 | C31 | H40 | 109.5° | 109.7° |
| H41 | C32 | H42 | 120.0° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C14 | C13 | C15 | 123.9° | 120.0° |
| C17 | C14 | C13 | O16 | 117.7° | 119.9° |
| C17 | C14 | C13 | C12 | 124.8° | 180.0° |
| C17 | C14 | C15 | O16 | 116.7° | 119.9° |
| C17 | C14 | C13 | H11 | 114.1° | 60.0° |
| C17 | C14 | C13 | H12 | 3.7° | 60.0° |
| C17 | C14 | C15 | H13 | 180.0° | 60.1° |
| C17 | C14 | C15 | H14 | 60.0° | 60.0° |
| C17 | C14 | C15 | H15 | 60.0° | 180.0° |
| C14 | C17 | H16 | H17 | 120.0° | 120.0° |
| C14 | C17 | H16 | H18 | 120.0° | 120.0° |
| C14 | C17 | H17 | H18 | 120.0° | 120.0° |
| C17 | C14 | O16 | H44 | 180.0° | 60.0° |
| C14 | C13 | C12 | H11 | 121.1° | 120.0° |
| C14 | C13 | C12 | H12 | 121.1° | 120.0° |
| C13 | C14 | C15 | O16 | 119.2° | 120.1° |
| C14 | C13 | C12 | C11 | 89.6° | 180.0° |
| C14 | C13 | H11 | H12 | 116.5° | 120.0° |
| C13 | C14 | C15 | H13 | 56.0° | 60.0° |
| C13 | C14 | C15 | H14 | 176.0° | 180.0° |
| C13 | C14 | C15 | H15 | 64.0° | 60.0° |
| C13 | C14 | C17 | H16 | 180.0° | 60.0° |
| C13 | C14 | C17 | H17 | 60.0° | 180.0° |
| C13 | C14 | C17 | H18 | 60.0° | 60.0° |
| C14 | C13 | C12 | H30 | 150.0° | 60.0° |
| C14 | C13 | C12 | H31 | 30.8° | 60.0° |
| C13 | C14 | O16 | H44 | 60.2° | 59.9° |
| C12 | C13 | C14 | C15 | 111.3° | 60.0° |
| C12 | C13 | C14 | O16 | 7.1° | 60.0° |
| C13 | C12 | C11 | H30 | 120.4° | 119.9° |
| C13 | C12 | C11 | H31 | 120.4° | 120.0° |
| C13 | C12 | C11 | C9 | 160.5° | 180.0° |
| C12 | C13 | H11 | H12 | 116.6° | 120.0° |
| C13 | C12 | C11 | H28 | 78.3° | 60.1° |
| C13 | C12 | C11 | H29 | 39.2° | 60.0° |
| C13 | C12 | H30 | H31 | 118.8° | 120.0° |
| C15 | C14 | C13 | H11 | 9.8° | 60.0° |
| C15 | C14 | C13 | H12 | 127.5° | 180.0° |
| C14 | C15 | H13 | H14 | 120.0° | 120.1° |
| C14 | C15 | H13 | H15 | 120.0° | 119.9° |
| C14 | C15 | H14 | H15 | 120.0° | 120.0° |
| C15 | C14 | C17 | H16 | 55.2° | 180.0° |
| C15 | C14 | C17 | H17 | 175.2° | 60.0° |
| C15 | C14 | C17 | H18 | 64.8° | 60.0° |
| C15 | C14 | O16 | H44 | 61.2° | 180.0° |
| O16 | C14 | C13 | H11 | 128.2° | 179.9° |
| O16 | C14 | C13 | H12 | 114.0° | 59.9° |
| O16 | C14 | C15 | H13 | 63.3° | 180.0° |
| O16 | C14 | C15 | H14 | 56.7° | 59.9° |
| O16 | C14 | C15 | H15 | 176.7° | 60.1° |
| O16 | C14 | C17 | H16 | 61.5° | 60.0° |
| O16 | C14 | C17 | H17 | 58.5° | 60.0° |
| O16 | C14 | C17 | H18 | 178.5° | 180.0° |
| C12 | C11 | C9 | H28 | 121.2° | 119.9° |
| C12 | C11 | C9 | H29 | 121.2° | 120.0° |
| C12 | C11 | C9 | C10 | 45.3° | 44.8° |
| C12 | C11 | C9 | C8 | 170.3° | 164.8° |
| C11 | C12 | C13 | H11 | 31.5° | 59.9° |
| C11 | C12 | C13 | H12 | 149.3° | 60.1° |
| C12 | C11 | H28 | H29 | 116.1° | 120.0° |
| C11 | C12 | H30 | H31 | 118.8° | 120.0° |
| C12 | C11 | C9 | H43 | 73.1° | 75.3° |
| C11 | C9 | C10 | C8 | 122.5° | 120.0° |
| C11 | C9 | C10 | H43 | 118.2° | 120.0° |
| C11 | C9 | C8 | H43 | 116.6° | 120.0° |
| C11 | C9 | C8 | C2 | 118.7° | 66.6° |
| C11 | C9 | C8 | C7 | 101.7° | 173.4° |
| C11 | C9 | C8 | H7 | 8.7° | 53.4° |
| C11 | C9 | C10 | H8 | 180.0° | 173.8° |
| C11 | C9 | C10 | H9 | 60.0° | 53.8° |
| C11 | C9 | C10 | H10 | 60.0° | 66.3° |
| C9 | C11 | H28 | H29 | 116.1° | 120.1° |
| C9 | C11 | C12 | H30 | 40.1° | 60.1° |
| C9 | C11 | C12 | H31 | 79.1° | 60.0° |
| C10 | C9 | C8 | H43 | 119.4° | 120.0° |
| C10 | C9 | C8 | C2 | 117.3° | 173.4° |
| C10 | C9 | C8 | C7 | 22.3° | 53.3° |
| C10 | C9 | C8 | H7 | 132.7° | 66.6° |
| C9 | C10 | H8 | H9 | 120.0° | 120.0° |
| C9 | C10 | H8 | H10 | 120.0° | 119.9° |
| C9 | C10 | H9 | H10 | 120.0° | 120.0° |
| C10 | C9 | C11 | H28 | 75.9° | 75.2° |
| C10 | C9 | C11 | H29 | 166.5° | 164.8° |
| C9 | C8 | C2 | C1 | 65.7° | 80.4° |
| C9 | C8 | C2 | C7 | 139.0° | 120.1° |
| C9 | C8 | C2 | H7 | 110.0° | 119.9° |
| C9 | C8 | C7 | H7 | 110.3° | 120.0° |
| C9 | C8 | C2 | C21 | 50.7° | 36.3° |
| C9 | C8 | C2 | C3 | 169.2° | 162.1° |
| C9 | C8 | C7 | C6 | 153.6° | 148.0° |
| C9 | C8 | C7 | H6 | 85.4° | 27.9° |
| C8 | C9 | C10 | H8 | 57.5° | 66.2° |
| C8 | C9 | C10 | H9 | 177.5° | 173.8° |
| C8 | C9 | C10 | H10 | 62.5° | 53.8° |
| C8 | C9 | C11 | H28 | 49.0° | 44.8° |
| C8 | C9 | C11 | H29 | 68.5° | 75.2° |
| C9 | C8 | C7 | H48 | 32.7° | 91.9° |
| C1 | C2 | C8 | C21 | 116.4° | 116.6° |
| C1 | C2 | C8 | C3 | 125.1° | 117.5° |
| C1 | C2 | C8 | C7 | 155.3° | 159.6° |
| C1 | C2 | C21 | C3 | 118.4° | 115.4° |
| C1 | C2 | C21 | C20 | 63.1° | 53.3° |
| C1 | C2 | C3 | C18 | 57.7° | 60.7° |
| C1 | C2 | C3 | C4 | 71.3° | 80.5° |
| C1 | C2 | C8 | H7 | 44.3° | 39.6° |
| C1 | C2 | C21 | H21 | 57.5° | 173.2° |
| C1 | C2 | C21 | H22 | 176.4° | 66.5° |
| C2 | C1 | H25 | H26 | 120.0° | 120.1° |
| C2 | C1 | H25 | H27 | 120.0° | 120.0° |
| C2 | C1 | H26 | H27 | 120.0° | 120.0° |
| C1 | C2 | C3 | H38 | 171.6° | 167.8° |
| C2 | C8 | C7 | H7 | 110.9° | 120.0° |
| C8 | C2 | C21 | C3 | 124.3° | 127.9° |
| C8 | C2 | C21 | C20 | 179.6° | 170.1° |
| C2 | C8 | C7 | C6 | 67.6° | 92.0° |
| C8 | C2 | C3 | C18 | 177.5° | 178.5° |
| C8 | C2 | C3 | C4 | 53.5° | 37.2° |
| C2 | C8 | C7 | H6 | 53.4° | 147.9° |
| C8 | C2 | C21 | H21 | 59.9° | 70.1° |
| C8 | C2 | C21 | H22 | 59.1° | 50.2° |
| C8 | C2 | C1 | H25 | 180.0° | 77.2° |
| C8 | C2 | C1 | H26 | 60.0° | 162.7° |
| C8 | C2 | C1 | H27 | 60.0° | 42.8° |
| C8 | C2 | C3 | H38 | 63.6° | 74.4° |
| C2 | C8 | C9 | H43 | 2.1° | 53.5° |
| C2 | C8 | C7 | H48 | 171.5° | 28.2° |
| C7 | C8 | C2 | C21 | 88.3° | 83.8° |
| C7 | C8 | C2 | C3 | 30.2° | 42.0° |
| C8 | C7 | C6 | H6 | 121.0° | 120.1° |
| C8 | C7 | C6 | H48 | 121.0° | 120.1° |
| C8 | C7 | C6 | C5 | 0.4° | 85.3° |
| C8 | C7 | C6 | H5 | 120.6° | 36.1° |
| C8 | C7 | H6 | H48 | 117.1° | 119.7° |
| C7 | C8 | C9 | H43 | 141.7° | 66.6° |
| C8 | C7 | C6 | H47 | 121.4° | 153.3° |
| C2 | C21 | C20 | H21 | 120.5° | 119.9° |
| C2 | C21 | C20 | H22 | 120.5° | 119.8° |
| C2 | C21 | C20 | C19 | 54.2° | 62.1° |
| C21 | C2 | C3 | C18 | 59.3° | 54.9° |
| C21 | C2 | C3 | C4 | 171.7° | 163.9° |
| C21 | C2 | C8 | H7 | 160.7° | 156.2° |
| C2 | C21 | C20 | H19 | 66.2° | 58.1° |
| C2 | C21 | C20 | H20 | 174.5° | 177.7° |
| C2 | C21 | H21 | H22 | 118.4° | 120.3° |
| C21 | C2 | C1 | H25 | 64.7° | 42.6° |
| C21 | C2 | C1 | H26 | 175.3° | 77.5° |
| C21 | C2 | C1 | H27 | 55.4° | 162.6° |
| C21 | C2 | C3 | H38 | 54.6° | 52.2° |
| C20 | C21 | C2 | C3 | 55.3° | 62.1° |
| C21 | C20 | C19 | H19 | 120.3° | 120.2° |
| C21 | C20 | C19 | H20 | 120.3° | 120.1° |
| C21 | C20 | C19 | C18 | 53.8° | 54.2° |
| C21 | C20 | H19 | H20 | 119.0° | 119.4° |
| C20 | C21 | H21 | H22 | 118.4° | 120.2° |
| C21 | C20 | C19 | H32 | 173.8° | 174.0° |
| C21 | C20 | C19 | H33 | 66.2° | 65.7° |
| C2 | C3 | C18 | C19 | 63.4° | 50.4° |
| C2 | C3 | C18 | C4 | 131.9° | 143.0° |
| C2 | C3 | C18 | H38 | 113.6° | 107.4° |
| C2 | C3 | C4 | H38 | 117.0° | 111.7° |
| C2 | C3 | C18 | C22 | 110.3° | 129.7° |
| C2 | C3 | C4 | C5 | 49.4° | 88.3° |
| C2 | C3 | C4 | H1 | 71.4° | 151.2° |
| C2 | C3 | C4 | H2 | 170.2° | 32.1° |
| C3 | C2 | C8 | H7 | 80.8° | 77.9° |
| C3 | C2 | C21 | H21 | 175.9° | 57.7° |
| C3 | C2 | C21 | H22 | 65.2° | 178.1° |
| C3 | C2 | C1 | H25 | 51.6° | 160.5° |
| C3 | C2 | C1 | H26 | 68.4° | 40.4° |
| C3 | C2 | C1 | H27 | 171.7° | 79.5° |
| C20 | C19 | C18 | H32 | 120.0° | 119.8° |
| C20 | C19 | C18 | H33 | 120.0° | 119.8° |
| C20 | C19 | C18 | C3 | 59.0° | 49.7° |
| C20 | C19 | C18 | C22 | 114.5° | 130.3° |
| C19 | C20 | H19 | H20 | 119.0° | 119.7° |
| C19 | C20 | C21 | H21 | 174.7° | 57.7° |
| C19 | C20 | C21 | H22 | 66.3° | 178.0° |
| C20 | C19 | H32 | H33 | 119.9° | 120.2° |
| C32 | C28 | C26 | C25 | 122.0° | 124.7° |
| C32 | C28 | C26 | O27 | 2.1° | 115.1° |
| C32 | C28 | C26 | C29 | 178.4° | 179.8° |
| C32 | C28 | C29 | C31 | 126.6° | 124.7° |
| C32 | C28 | C29 | O30 | 114.5° | 5.2° |
| C32 | C28 | C26 | H24 | 120.9° | 4.9° |
| C32 | C28 | C29 | H37 | 6.6° | 115.1° |
| C28 | C32 | H41 | H42 | 180.0° | 180.0° |
| C24 | C25 | C26 | H35 | 120.6° | 119.6° |
| C24 | C25 | C26 | H36 | 120.5° | 119.8° |
| C24 | C25 | C26 | O27 | 172.9° | 70.6° |
| C24 | C25 | C26 | C28 | 49.8° | 49.4° |
| C25 | C24 | C31 | C23 | 175.9° | 179.7° |
| C25 | C24 | C31 | C29 | 37.4° | 54.9° |
| C25 | C24 | C23 | C22 | 1.1° | 174.6° |
| C24 | C25 | C26 | H24 | 67.4° | 169.2° |
| C25 | C24 | C23 | H34 | 178.9° | 5.4° |
| C24 | C25 | H35 | H36 | 118.3° | 120.4° |
| C25 | C24 | C31 | H39 | 83.6° | 174.8° |
| C25 | C24 | C31 | H40 | 158.4° | 64.8° |
| C25 | C26 | O27 | C28 | 123.0° | 119.4° |
| C25 | C26 | O27 | H24 | 119.0° | 120.5° |
| C25 | C26 | C28 | H24 | 117.1° | 119.8° |
| C25 | C26 | C28 | C29 | 59.6° | 55.5° |
| C26 | C25 | C24 | C31 | 40.3° | 54.9° |
| C26 | C25 | C24 | C23 | 143.7° | 124.8° |
| C26 | C25 | H35 | H36 | 118.3° | 120.5° |
| C25 | C26 | O27 | H45 | 180.0° | 179.5° |
| O27 | C26 | C28 | H24 | 118.7° | 120.0° |
| O27 | C26 | C28 | C29 | 176.3° | 64.7° |
| O27 | C26 | C25 | H35 | 66.5° | 169.8° |
| O27 | C26 | C25 | H36 | 52.4° | 49.2° |
| C26 | C28 | C29 | C31 | 55.1° | 55.5° |
| C26 | C28 | C29 | O30 | 63.9° | 175.0° |
| C28 | C26 | C25 | H35 | 170.4° | 70.3° |
| C28 | C26 | C25 | H36 | 70.7° | 169.2° |
| C26 | C28 | C29 | H37 | 175.0° | 64.6° |
| C26 | C28 | C32 | H41 | 178.2° | 0.0° |
| C26 | C28 | C32 | H42 | 1.7° | 180.0° |
| C28 | C26 | O27 | H45 | 57.0° | 60.2° |
| C28 | C29 | C31 | C24 | 42.7° | 49.5° |
| C28 | C29 | C31 | O30 | 119.1° | 119.7° |
| C28 | C29 | C31 | H37 | 120.1° | 120.0° |
| C28 | C29 | O30 | H37 | 120.4° | 120.4° |
| C29 | C28 | C26 | H24 | 57.5° | 175.3° |
| C28 | C29 | C31 | H39 | 78.2° | 169.3° |
| C28 | C29 | C31 | H40 | 163.7° | 70.2° |
| C29 | C28 | C32 | H41 | 0.0° | 179.7° |
| C29 | C28 | C32 | H42 | 180.0° | 0.3° |
| C28 | C29 | O30 | H46 | 180.0° | 60.0° |
| C24 | C31 | C29 | H39 | 121.0° | 119.8° |
| C24 | C31 | C29 | H40 | 121.0° | 119.7° |
| C31 | C24 | C23 | C22 | 174.6° | 5.1° |
| C24 | C31 | C29 | O30 | 76.3° | 169.2° |
| C31 | C24 | C23 | H34 | 5.4° | 174.9° |
| C31 | C24 | C25 | H35 | 160.9° | 64.7° |
| C31 | C24 | C25 | H36 | 80.2° | 174.8° |
| C24 | C31 | C29 | H37 | 162.8° | 70.5° |
| C24 | C31 | H39 | H40 | 116.9° | 120.4° |
| C29 | C31 | C24 | C23 | 146.7° | 124.7° |
| C31 | C29 | O30 | H37 | 120.0° | 120.6° |
| C29 | C31 | H39 | H40 | 116.9° | 120.4° |
| C31 | C29 | O30 | H46 | 60.5° | 179.0° |
| C7 | C6 | C5 | C4 | 73.3° | 63.2° |
| C7 | C6 | C5 | H5 | 121.0° | 121.4° |
| C7 | C6 | C5 | H47 | 121.0° | 121.3° |
| C7 | C6 | C5 | H3 | 47.7° | 176.9° |
| C7 | C6 | C5 | H4 | 165.7° | 56.7° |
| C7 | C6 | H5 | H47 | 116.9° | 117.2° |
| C6 | C7 | H6 | H48 | 117.0° | 119.9° |
| C6 | C7 | C8 | H7 | 43.3° | 28.0° |
| C24 | C23 | C22 | H34 | 180.0° | 179.9° |
| C24 | C23 | C22 | C18 | 166.0° | 174.9° |
| C24 | C23 | C22 | H23 | 14.0° | 5.0° |
| C23 | C24 | C25 | H35 | 23.1° | 115.6° |
| C23 | C24 | C25 | H36 | 95.7° | 4.9° |
| C23 | C24 | C31 | H39 | 92.3° | 4.9° |
| C23 | C24 | C31 | H40 | 25.7° | 115.5° |
| C19 | C18 | C3 | C22 | 173.7° | 180.0° |
| C19 | C18 | C3 | C4 | 164.7° | 166.6° |
| C19 | C18 | C22 | C23 | 4.0° | 6.5° |
| C18 | C19 | C20 | H19 | 66.5° | 66.0° |
| C18 | C19 | C20 | H20 | 174.1° | 174.3° |
| C19 | C18 | C22 | H23 | 176.0° | 173.5° |
| C18 | C19 | H32 | H33 | 119.9° | 120.3° |
| C19 | C18 | C3 | H38 | 50.2° | 57.0° |
| C18 | C3 | C4 | H38 | 114.7° | 109.3° |
| C3 | C18 | C22 | C23 | 176.8° | 173.5° |
| C18 | C3 | C4 | C5 | 177.7° | 132.7° |
| C18 | C3 | C4 | H1 | 56.9° | 12.2° |
| C18 | C3 | C4 | H2 | 61.5° | 106.9° |
| C3 | C18 | C22 | H23 | 3.2° | 6.5° |
| C3 | C18 | C19 | H32 | 179.0° | 169.5° |
| C3 | C18 | C19 | H33 | 61.0° | 70.1° |
| C4 | C3 | C18 | C22 | 21.5° | 13.4° |
| C3 | C4 | C5 | H1 | 120.8° | 120.4° |
| C3 | C4 | C5 | H2 | 120.8° | 120.5° |
| C3 | C4 | C5 | C6 | 37.6° | 72.9° |
| C3 | C4 | H1 | H2 | 117.5° | 119.1° |
| C3 | C4 | C5 | H3 | 83.3° | 167.2° |
| C3 | C4 | C5 | H4 | 158.6° | 46.9° |
| C23 | C22 | C18 | H23 | 180.0° | 180.0° |
| C22 | C18 | C19 | H32 | 5.5° | 10.5° |
| C22 | C18 | C19 | H33 | 125.4° | 109.8° |
| C18 | C22 | C23 | H34 | 14.0° | 5.0° |
| C22 | C18 | C3 | H38 | 136.1° | 122.9° |
| O30 | C29 | C31 | H39 | 162.7° | 71.0° |
| O30 | C29 | C31 | H40 | 44.6° | 49.4° |
| C4 | C5 | C6 | H3 | 121.0° | 119.9° |
| C4 | C5 | C6 | H4 | 121.0° | 119.9° |
| C5 | C4 | H1 | H2 | 117.4° | 119.1° |
| C4 | C5 | H3 | H4 | 117.0° | 120.2° |
| C4 | C5 | C6 | H5 | 47.7° | 58.2° |
| C5 | C4 | C3 | H38 | 67.6° | 23.3° |
| C4 | C5 | C6 | H47 | 165.7° | 175.6° |
| C6 | C5 | C4 | H1 | 158.4° | 166.6° |
| C6 | C5 | C4 | H2 | 83.2° | 47.5° |
| C6 | C5 | H3 | H4 | 117.0° | 120.2° |
| C5 | C6 | H5 | H47 | 116.9° | 117.4° |
| C5 | C6 | C7 | H6 | 121.3° | 154.6° |
| C5 | C6 | C7 | H48 | 120.6° | 34.7° |
| H1 | C4 | C5 | H3 | 37.5° | 46.7° |
| H1 | C4 | C5 | H4 | 80.6° | 73.5° |
| H1 | C4 | C3 | H38 | 171.6° | 97.1° |
| H2 | C4 | C5 | H3 | 155.8° | 72.4° |
| H2 | C4 | C5 | H4 | 37.7° | 167.4° |
| H2 | C4 | C3 | H38 | 53.3° | 143.8° |
| H3 | C5 | C6 | H5 | 168.7° | 61.7° |
| H3 | C5 | C6 | H47 | 73.3° | 55.6° |
| H4 | C5 | C6 | H5 | 73.3° | 178.1° |
| H4 | C5 | C6 | H47 | 44.8° | 64.6° |
| H5 | C6 | C7 | H6 | 0.4° | 84.0° |
| H5 | C6 | C7 | H48 | 118.4° | 156.1° |
| H6 | C7 | C8 | H7 | 164.3° | 92.1° |
| H6 | C7 | C6 | H47 | 117.7° | 33.2° |
| H7 | C8 | C9 | H43 | 107.9° | 173.4° |
| H7 | C8 | C7 | H48 | 77.7° | 148.2° |
| H8 | C10 | H9 | H10 | 120.0° | 120.0° |
| H8 | C10 | C9 | H43 | 61.8° | 53.8° |
| H9 | C10 | C9 | H43 | 58.2° | 66.3° |
| H10 | C10 | C9 | H43 | 178.2° | 173.7° |
| H11 | C13 | C12 | H30 | 88.9° | 60.0° |
| H11 | C13 | C12 | H31 | 151.9° | 180.0° |
| H12 | C13 | C12 | H30 | 28.9° | 180.0° |
| H12 | C13 | C12 | H31 | 90.3° | 60.0° |
| H13 | C15 | H14 | H15 | 120.0° | 120.0° |
| H16 | C17 | H17 | H18 | 120.0° | 119.9° |
| H19 | C20 | C21 | H21 | 54.4° | 178.0° |
| H19 | C20 | C21 | H22 | 173.3° | 61.7° |
| H19 | C20 | C19 | H32 | 53.5° | 53.8° |
| H19 | C20 | C19 | H33 | 173.5° | 174.1° |
| H20 | C20 | C21 | H21 | 64.9° | 62.5° |
| H20 | C20 | C21 | H22 | 54.0° | 57.8° |
| H20 | C20 | C19 | H32 | 65.8° | 65.8° |
| H20 | C20 | C19 | H33 | 54.1° | 54.4° |
| H23 | C22 | C23 | H34 | 166.0° | 175.0° |
| H24 | C26 | C25 | H35 | 53.1° | 49.5° |
| H24 | C26 | C25 | H36 | 172.1° | 71.1° |
| H24 | C26 | O27 | H45 | 61.0° | 60.0° |
| H25 | C1 | H26 | H27 | 120.0° | 120.0° |
| H28 | C11 | C12 | H30 | 161.3° | 180.0° |
| H28 | C11 | C12 | H31 | 42.1° | 60.0° |
| H28 | C11 | C9 | H43 | 165.7° | 164.8° |
| H29 | C11 | C12 | H30 | 81.2° | 60.0° |
| H29 | C11 | C12 | H31 | 159.6° | 180.0° |
| H29 | C11 | C9 | H43 | 48.1° | 44.8° |
| H37 | C29 | C31 | H39 | 41.9° | 49.3° |
| H37 | C29 | C31 | H40 | 76.2° | 169.8° |
| H37 | C29 | O30 | H46 | 59.5° | 60.4° |
| H47 | C6 | C7 | H48 | 0.4° | 86.6° |
