A1CJG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O03 | C16 | doub | 1.21Å | 1.22Å | |
| C16 | C15 | sing | 1.48Å | 1.46Å | |
| C16 | C17 | sing | 1.51Å | 1.47Å | |
| C15 | C14 | doub | 1.36Å | 1.43Å | |
| C17 | C18 | sing | 1.52Å | 1.51Å | |
| C14 | C13 | sing | 1.50Å | 1.47Å | |
| C14 | C19 | sing | 1.49Å | 1.49Å | |
| C20 | C19 | sing | 1.53Å | 1.55Å | |
| C18 | C19 | sing | 1.52Å | 1.57Å | |
| C13 | C12 | sing | 1.54Å | 1.47Å | |
| C19 | C21 | sing | 1.52Å | 1.61Å | |
| C12 | C11 | sing | 1.53Å | 1.54Å | |
| C21 | C11 | sing | 1.53Å | 1.59Å | |
| C21 | C22 | sing | 1.53Å | 1.55Å | |
| C11 | C10 | sing | 1.50Å | 1.59Å | |
| C22 | C23 | sing | 1.54Å | 1.55Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| C10 | C24 | sing | 1.52Å | 1.57Å | |
| C10 | C09 | sing | 1.53Å | 1.55Å | |
| C23 | C24 | sing | 1.52Å | 1.51Å | |
| C24 | C07 | sing | 1.54Å | 1.62Å | |
| C09 | C08 | sing | 1.54Å | 1.54Å | |
| C08 | C07 | sing | 1.53Å | 1.56Å | |
| C07 | C26 | sing | 1.50Å | 1.53Å | |
| C07 | O02 | sing | 1.45Å | 1.44Å | |
| C26 | O04 | doub | 1.21Å | 1.21Å | |
| C26 | C27 | sing | 1.51Å | 1.49Å | |
| O02 | C06 | sing | 1.34Å | 1.40Å | |
| C06 | C05 | sing | 1.51Å | 1.55Å | |
| C06 | O01 | doub | 1.21Å | 1.22Å | |
| C05 | C04 | sing | 1.53Å | 1.55Å | |
| C04 | C03 | sing | 1.53Å | 1.55Å | |
| C03 | C02 | sing | 1.53Å | 1.53Å | |
| C02 | C01 | sing | 1.53Å | 1.52Å | |
| C01 | H01 | sing | 1.09Å | 1.10Å | |
| C01 | H02 | sing | 1.09Å | 1.10Å | |
| C01 | H03 | sing | 1.09Å | 1.10Å | |
| C02 | H05 | sing | 1.09Å | 1.10Å | |
| C02 | H04 | sing | 1.09Å | 1.10Å | |
| C03 | H06 | sing | 1.09Å | 1.10Å | |
| C03 | H07 | sing | 1.09Å | 1.10Å | |
| C04 | H09 | sing | 1.09Å | 1.10Å | |
| C04 | H08 | sing | 1.09Å | 1.10Å | |
| C05 | H10 | sing | 1.09Å | 1.10Å | |
| C05 | H11 | sing | 1.09Å | 1.10Å | |
| C08 | H13 | sing | 1.09Å | 1.10Å | |
| C08 | H12 | sing | 1.09Å | 1.10Å | |
| C09 | H15 | sing | 1.08Å | 1.10Å | |
| C09 | H14 | sing | 1.09Å | 1.10Å | |
| C10 | H16 | sing | 1.12Å | 1.10Å | |
| C11 | H17 | sing | 1.11Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.08Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C13 | H21 | sing | 1.08Å | 1.10Å | |
| C15 | H22 | sing | 1.08Å | 1.08Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.10Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C20 | H28 | sing | 1.09Å | 1.10Å | |
| C20 | H27 | sing | 1.09Å | 1.10Å | |
| C20 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.11Å | 1.10Å | |
| C22 | H31 | sing | 1.08Å | 1.10Å | |
| C22 | H32 | sing | 1.10Å | 1.10Å | |
| C23 | H33 | sing | 1.09Å | 1.10Å | |
| C23 | H34 | sing | 1.09Å | 1.10Å | |
| C25 | H37 | sing | 1.09Å | 1.10Å | |
| C25 | H35 | sing | 1.09Å | 1.10Å | |
| C25 | H36 | sing | 1.09Å | 1.10Å | |
| C27 | H39 | sing | 1.09Å | 1.10Å | |
| C27 | H40 | sing | 1.09Å | 1.10Å | |
| C27 | H38 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O03 | C16 | C15 | 115.3° | 122.2° |
| O03 | C16 | C17 | 128.0° | 122.0° |
| C15 | C16 | C17 | 116.7° | 115.9° |
| C16 | C15 | C14 | 108.9° | 114.7° |
| C16 | C15 | H22 | 125.6° | 122.8° |
| C16 | C17 | C18 | 111.6° | 110.9° |
| C16 | C17 | H24 | 108.9° | 109.3° |
| C16 | C17 | H23 | 108.9° | 109.1° |
| C15 | C14 | C13 | 107.1° | 115.9° |
| C15 | C14 | C19 | 129.9° | 118.0° |
| C14 | C15 | H22 | 125.6° | 122.5° |
| C17 | C18 | C19 | 114.9° | 113.8° |
| C18 | C17 | H24 | 108.9° | 109.7° |
| C18 | C17 | H23 | 108.9° | 109.4° |
| C17 | C18 | H25 | 108.1° | 109.0° |
| C17 | C18 | H26 | 108.1° | 109.2° |
| C13 | C14 | C19 | 122.9° | 126.1° |
| C14 | C13 | C12 | 100.2° | 109.6° |
| C14 | C13 | H20 | 111.7° | 109.1° |
| C14 | C13 | H21 | 111.7° | 109.2° |
| C14 | C19 | C20 | 103.0° | 105.4° |
| C14 | C19 | C18 | 111.2° | 112.6° |
| C14 | C19 | C21 | 104.0° | 115.8° |
| C20 | C19 | C18 | 108.7° | 105.5° |
| C20 | C19 | C21 | 108.7° | 106.0° |
| C19 | C20 | H28 | 109.5° | 109.5° |
| C19 | C20 | H27 | 109.4° | 109.5° |
| C19 | C20 | H29 | 109.5° | 109.5° |
| C18 | C19 | C21 | 119.9° | 110.6° |
| C19 | C18 | H25 | 108.1° | 108.3° |
| C19 | C18 | H26 | 108.1° | 108.5° |
| C13 | C12 | C11 | 112.9° | 106.7° |
| C13 | C12 | H19 | 108.6° | 108.0° |
| C13 | C12 | H18 | 108.6° | 109.4° |
| C12 | C13 | H20 | 111.7° | 109.1° |
| C12 | C13 | H21 | 111.7° | 109.3° |
| C19 | C21 | C11 | 112.8° | 112.5° |
| C19 | C21 | C22 | 118.5° | 114.8° |
| C19 | C21 | H30 | 104.9° | 105.1° |
| C12 | C11 | C21 | 116.2° | 110.6° |
| C12 | C11 | C10 | 109.4° | 115.8° |
| C12 | C11 | H17 | 105.6° | 106.2° |
| C11 | C12 | H19 | 108.6° | 110.7° |
| C11 | C12 | H18 | 108.6° | 110.7° |
| C11 | C21 | C22 | 108.9° | 112.2° |
| C21 | C11 | C10 | 114.4° | 110.6° |
| C21 | C11 | H17 | 105.0° | 105.9° |
| C11 | C21 | H30 | 105.1° | 105.4° |
| C21 | C22 | C23 | 119.0° | 110.7° |
| C22 | C21 | H30 | 105.4° | 105.9° |
| C21 | C22 | H31 | 107.0° | 111.4° |
| C21 | C22 | H32 | 107.0° | 110.0° |
| C11 | C10 | C24 | 117.8° | 113.3° |
| C11 | C10 | C09 | 118.2° | 118.8° |
| C11 | C10 | H16 | 105.4° | 108.0° |
| C10 | C11 | H17 | 105.0° | 107.0° |
| C22 | C23 | C24 | 116.3° | 108.6° |
| C23 | C22 | H31 | 107.0° | 109.1° |
| C23 | C22 | H32 | 107.1° | 105.6° |
| C22 | C23 | H33 | 107.8° | 109.1° |
| C22 | C23 | H34 | 107.7° | 109.1° |
| C25 | C24 | C10 | 117.0° | 113.3° |
| C25 | C24 | C23 | 106.0° | 110.5° |
| C25 | C24 | C07 | 108.4° | 107.5° |
| C24 | C25 | H37 | 109.5° | 109.5° |
| C24 | C25 | H35 | 109.5° | 109.5° |
| C24 | C25 | H36 | 109.5° | 109.5° |
| C24 | C10 | C09 | 102.9° | 100.8° |
| C10 | C24 | C23 | 103.6° | 108.8° |
| C10 | C24 | C07 | 101.3° | 100.5° |
| C24 | C10 | H16 | 105.6° | 108.2° |
| C10 | C09 | C08 | 104.4° | 101.2° |
| C10 | C09 | H15 | 110.7° | 112.8° |
| C10 | C09 | H14 | 110.7° | 110.4° |
| C09 | C10 | H16 | 105.8° | 107.2° |
| C23 | C24 | C07 | 121.2° | 115.9° |
| C24 | C23 | H33 | 107.7° | 110.2° |
| C24 | C23 | H34 | 107.7° | 110.3° |
| C24 | C07 | C08 | 99.6° | 104.5° |
| C24 | C07 | C26 | 110.8° | 110.0° |
| C24 | C07 | O02 | 116.8° | 110.2° |
| C09 | C08 | C07 | 110.0° | 106.3° |
| C09 | C08 | H13 | 109.4° | 110.1° |
| C09 | C08 | H12 | 109.4° | 109.8° |
| C08 | C09 | H15 | 110.7° | 111.8° |
| C08 | C09 | H14 | 110.8° | 110.2° |
| C08 | C07 | C26 | 113.4° | 110.5° |
| C08 | C07 | O02 | 112.4° | 110.6° |
| C07 | C08 | H13 | 109.4° | 110.3° |
| C07 | C08 | H12 | 109.3° | 110.0° |
| C26 | C07 | O02 | 104.3° | 110.8° |
| C07 | C26 | O04 | 121.2° | 120.0° |
| C07 | C26 | C27 | 120.2° | 120.0° |
| C07 | O02 | C06 | 120.4° | 117.0° |
| O04 | C26 | C27 | 118.6° | 120.0° |
| C26 | C27 | H39 | 109.5° | 109.5° |
| C26 | C27 | H40 | 109.5° | 109.4° |
| C26 | C27 | H38 | 109.5° | 109.5° |
| O02 | C06 | C05 | 122.9° | 120.0° |
| O02 | C06 | O01 | 117.3° | 120.0° |
| C05 | C06 | O01 | 119.8° | 120.0° |
| C06 | C05 | C04 | 115.0° | 109.5° |
| C06 | C05 | H10 | 108.1° | 109.5° |
| C06 | C05 | H11 | 108.1° | 109.5° |
| C05 | C04 | C03 | 115.2° | 109.4° |
| C05 | C04 | H09 | 108.0° | 109.4° |
| C05 | C04 | H08 | 108.0° | 109.5° |
| C04 | C05 | H10 | 108.1° | 109.4° |
| C04 | C05 | H11 | 108.1° | 109.5° |
| C04 | C03 | C02 | 115.1° | 109.4° |
| C04 | C03 | H06 | 108.0° | 109.5° |
| C04 | C03 | H07 | 108.1° | 109.5° |
| C03 | C04 | H09 | 108.0° | 109.5° |
| C03 | C04 | H08 | 108.0° | 109.5° |
| C03 | C02 | C01 | 115.0° | 109.4° |
| C03 | C02 | H05 | 108.1° | 109.5° |
| C03 | C02 | H04 | 108.1° | 109.5° |
| C02 | C03 | H06 | 108.0° | 109.4° |
| C02 | C03 | H07 | 108.1° | 109.5° |
| C02 | C01 | H01 | 109.5° | 109.4° |
| C02 | C01 | H02 | 109.4° | 109.5° |
| C02 | C01 | H03 | 109.5° | 109.5° |
| C01 | C02 | H05 | 108.0° | 109.5° |
| C01 | C02 | H04 | 108.1° | 109.5° |
| H01 | C01 | H02 | 109.5° | 109.5° |
| H01 | C01 | H03 | 109.5° | 109.5° |
| H02 | C01 | H03 | 109.5° | 109.5° |
| H05 | C02 | H04 | 109.5° | 109.5° |
| H06 | C03 | H07 | 109.5° | 109.5° |
| H09 | C04 | H08 | 109.5° | 109.5° |
| H10 | C05 | H11 | 109.5° | 109.5° |
| H13 | C08 | H12 | 109.5° | 110.2° |
| H15 | C09 | H14 | 109.4° | 110.2° |
| H19 | C12 | H18 | 109.5° | 111.1° |
| H20 | C13 | H21 | 109.5° | 110.5° |
| H24 | C17 | H23 | 109.5° | 108.5° |
| H25 | C18 | H26 | 109.5° | 107.8° |
| H28 | C20 | H27 | 109.5° | 109.4° |
| H28 | C20 | H29 | 109.5° | 109.5° |
| H27 | C20 | H29 | 109.5° | 109.4° |
| H31 | C22 | H32 | 109.5° | 109.8° |
| H33 | C23 | H34 | 109.4° | 109.5° |
| H37 | C25 | H35 | 109.5° | 109.5° |
| H37 | C25 | H36 | 109.4° | 109.4° |
| H35 | C25 | H36 | 109.5° | 109.5° |
| H39 | C27 | H40 | 109.5° | 109.5° |
| H39 | C27 | H38 | 109.5° | 109.5° |
| H40 | C27 | H38 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O03 | C16 | C15 | C17 | 179.9° | 179.6° |
| O03 | C16 | C15 | C14 | 138.8° | 133.6° |
| O03 | C16 | C17 | C18 | 117.2° | 134.8° |
| O03 | C16 | C15 | H22 | 41.2° | 47.2° |
| O03 | C16 | C17 | H24 | 3.1° | 13.8° |
| O03 | C16 | C17 | H23 | 122.5° | 104.7° |
| C16 | C15 | C14 | H22 | 180.0° | 179.2° |
| C15 | C16 | C17 | C18 | 62.7° | 45.6° |
| C16 | C15 | C14 | C13 | 178.9° | 178.4° |
| C16 | C15 | C14 | C19 | 0.9° | 1.1° |
| C15 | C16 | C17 | H24 | 177.0° | 166.6° |
| C15 | C16 | C17 | H23 | 57.6° | 74.9° |
| C17 | C16 | C15 | C14 | 41.1° | 46.8° |
| C16 | C17 | C18 | H24 | 120.3° | 120.8° |
| C16 | C17 | C18 | H23 | 120.3° | 120.3° |
| C16 | C17 | C18 | C19 | 39.0° | 0.0° |
| C17 | C16 | C15 | H22 | 138.8° | 132.4° |
| C16 | C17 | H24 | H23 | 119.0° | 118.8° |
| C16 | C17 | C18 | H25 | 81.8° | 121.0° |
| C16 | C17 | C18 | H26 | 159.8° | 121.4° |
| C15 | C14 | C13 | C19 | 178.2° | 179.5° |
| C15 | C14 | C19 | C20 | 97.1° | 68.2° |
| C15 | C14 | C19 | C18 | 19.3° | 46.2° |
| C15 | C14 | C13 | C12 | 103.9° | 165.8° |
| C15 | C14 | C19 | C21 | 149.6° | 174.9° |
| C15 | C14 | C13 | H20 | 14.6° | 46.4° |
| C15 | C14 | C13 | H21 | 137.7° | 74.4° |
| C17 | C18 | C19 | C14 | 2.7° | 43.7° |
| C17 | C18 | C19 | C20 | 115.4° | 70.8° |
| C17 | C18 | C19 | H25 | 120.8° | 121.4° |
| C17 | C18 | C19 | H26 | 120.8° | 121.8° |
| C17 | C18 | C19 | C21 | 118.8° | 175.1° |
| C18 | C17 | H24 | H23 | 119.0° | 119.4° |
| C17 | C18 | H25 | H26 | 117.5° | 118.4° |
| C13 | C14 | C19 | C20 | 80.6° | 112.3° |
| C13 | C14 | C19 | C18 | 163.1° | 133.2° |
| C14 | C13 | C12 | H20 | 118.5° | 119.4° |
| C14 | C13 | C12 | H21 | 118.5° | 119.7° |
| C13 | C14 | C19 | C21 | 32.7° | 4.6° |
| C14 | C13 | C12 | C11 | 54.2° | 50.4° |
| C14 | C13 | C12 | H19 | 66.3° | 68.7° |
| C14 | C13 | C12 | H18 | 174.7° | 170.2° |
| C14 | C13 | H20 | H21 | 124.3° | 120.1° |
| C13 | C14 | C15 | H22 | 1.1° | 0.8° |
| C14 | C19 | C20 | C18 | 118.0° | 119.3° |
| C14 | C19 | C20 | C21 | 109.9° | 123.3° |
| C14 | C19 | C18 | C21 | 121.5° | 131.3° |
| C19 | C14 | C13 | C12 | 78.0° | 14.7° |
| C14 | C19 | C21 | C11 | 27.1° | 14.0° |
| C14 | C19 | C21 | C22 | 101.8° | 115.9° |
| C19 | C14 | C13 | H20 | 163.5° | 134.1° |
| C19 | C14 | C13 | H21 | 40.5° | 105.1° |
| C19 | C14 | C15 | H22 | 179.1° | 179.7° |
| C14 | C19 | C18 | H25 | 118.1° | 165.1° |
| C14 | C19 | C18 | H26 | 123.5° | 78.1° |
| C14 | C19 | C20 | H28 | 180.0° | 60.1° |
| C14 | C19 | C20 | H27 | 60.0° | 180.0° |
| C14 | C19 | C20 | H29 | 60.0° | 60.0° |
| C14 | C19 | C21 | H30 | 141.0° | 128.1° |
| C20 | C19 | C18 | C21 | 125.8° | 114.2° |
| C20 | C19 | C21 | C11 | 136.4° | 130.5° |
| C20 | C19 | C21 | C22 | 7.4° | 0.6° |
| C20 | C19 | C18 | H25 | 5.4° | 50.7° |
| C20 | C19 | C18 | H26 | 123.8° | 167.5° |
| C19 | C20 | H28 | H27 | 120.0° | 120.0° |
| C19 | C20 | H28 | H29 | 120.0° | 120.1° |
| C19 | C20 | H27 | H29 | 120.0° | 120.0° |
| C20 | C19 | C21 | H30 | 109.8° | 115.4° |
| C18 | C19 | C21 | C11 | 97.8° | 115.6° |
| C18 | C19 | C21 | C22 | 133.2° | 114.4° |
| C19 | C18 | C17 | H24 | 159.4° | 120.8° |
| C19 | C18 | C17 | H23 | 81.3° | 120.3° |
| C19 | C18 | H25 | H26 | 117.5° | 117.2° |
| C18 | C19 | C20 | H28 | 62.0° | 59.3° |
| C18 | C19 | C20 | H27 | 178.0° | 60.7° |
| C18 | C19 | C20 | H29 | 58.0° | 179.4° |
| C18 | C19 | C21 | H30 | 16.0° | 1.5° |
| C13 | C12 | C11 | H19 | 120.5° | 117.3° |
| C13 | C12 | C11 | H18 | 120.5° | 119.0° |
| C13 | C12 | C11 | C21 | 3.7° | 72.6° |
| C13 | C12 | C11 | C10 | 127.8° | 160.5° |
| C13 | C12 | C11 | H17 | 119.6° | 41.8° |
| C13 | C12 | H19 | H18 | 118.4° | 120.0° |
| C12 | C13 | H20 | H21 | 124.3° | 120.2° |
| C19 | C21 | C11 | C12 | 41.8° | 52.7° |
| C19 | C21 | C11 | C22 | 133.8° | 131.3° |
| C19 | C21 | C11 | H30 | 113.7° | 113.9° |
| C19 | C21 | C22 | H30 | 116.9° | 115.5° |
| C19 | C21 | C11 | C10 | 170.9° | 177.6° |
| C19 | C21 | C22 | C23 | 170.1° | 174.9° |
| C19 | C21 | C11 | H17 | 74.4° | 62.0° |
| C21 | C19 | C18 | H25 | 120.4° | 63.5° |
| C21 | C19 | C18 | H26 | 2.0° | 53.3° |
| C21 | C19 | C20 | H28 | 70.1° | 176.6° |
| C21 | C19 | C20 | H27 | 49.9° | 56.6° |
| C21 | C19 | C20 | H29 | 169.9° | 63.3° |
| C19 | C21 | C22 | H31 | 48.7° | 63.5° |
| C19 | C21 | C22 | H32 | 68.6° | 58.5° |
| C12 | C11 | C21 | C10 | 129.1° | 129.7° |
| C12 | C11 | C21 | H17 | 116.3° | 114.7° |
| C12 | C11 | C21 | C22 | 92.0° | 78.5° |
| C12 | C11 | C10 | H17 | 112.9° | 118.2° |
| C12 | C11 | C10 | C24 | 82.1° | 73.0° |
| C12 | C11 | C10 | C09 | 42.5° | 45.0° |
| C12 | C11 | C10 | H16 | 160.4° | 167.2° |
| C11 | C12 | H19 | H18 | 118.5° | 123.4° |
| C11 | C12 | C13 | H20 | 172.7° | 169.8° |
| C11 | C12 | C13 | H21 | 64.3° | 69.3° |
| C12 | C11 | C21 | H30 | 155.5° | 166.7° |
| C11 | C21 | C22 | H30 | 112.3° | 114.5° |
| C21 | C11 | C10 | H17 | 114.6° | 114.9° |
| C11 | C21 | C22 | C23 | 39.3° | 55.1° |
| C21 | C11 | C10 | C24 | 50.3° | 53.9° |
| C21 | C11 | C10 | C09 | 174.9° | 171.9° |
| C21 | C11 | C10 | H16 | 67.2° | 65.9° |
| C21 | C11 | C12 | H19 | 116.8° | 44.7° |
| C21 | C11 | C12 | H18 | 124.2° | 168.3° |
| C11 | C21 | C22 | H31 | 82.1° | 66.6° |
| C11 | C21 | C22 | H32 | 160.6° | 171.4° |
| C22 | C21 | C11 | C10 | 37.1° | 51.1° |
| C21 | C22 | C23 | H31 | 121.4° | 123.0° |
| C21 | C22 | C23 | H32 | 121.4° | 119.1° |
| C21 | C22 | C23 | C24 | 52.9° | 59.6° |
| C22 | C21 | C11 | H17 | 151.8° | 166.8° |
| C21 | C22 | H31 | H32 | 115.7° | 122.2° |
| C21 | C22 | C23 | H33 | 174.0° | 179.8° |
| C21 | C22 | C23 | H34 | 68.1° | 60.6° |
| C11 | C10 | C24 | C25 | 60.7° | 63.9° |
| C11 | C10 | C24 | C09 | 132.0° | 128.0° |
| C11 | C10 | C24 | H16 | 117.3° | 119.7° |
| C11 | C10 | C09 | H16 | 117.7° | 122.6° |
| C11 | C10 | C24 | C23 | 55.4° | 59.4° |
| C11 | C10 | C24 | C07 | 178.3° | 178.4° |
| C11 | C10 | C09 | C08 | 163.4° | 171.5° |
| C11 | C10 | C09 | H15 | 77.4° | 51.8° |
| C11 | C10 | C09 | H14 | 44.2° | 71.9° |
| C10 | C11 | C12 | H19 | 111.7° | 82.2° |
| C10 | C11 | C12 | H18 | 7.3° | 41.5° |
| C10 | C11 | C21 | H30 | 75.4° | 63.7° |
| C22 | C23 | C24 | C25 | 69.0° | 64.4° |
| C22 | C23 | C24 | C10 | 54.7° | 60.6° |
| C22 | C23 | C24 | H33 | 121.0° | 119.5° |
| C22 | C23 | C24 | H34 | 121.0° | 119.5° |
| C22 | C23 | C24 | C07 | 167.2° | 172.9° |
| C23 | C22 | C21 | H30 | 73.0° | 59.4° |
| C23 | C22 | H31 | H32 | 115.7° | 115.2° |
| C22 | C23 | H33 | H34 | 116.9° | 119.3° |
| C25 | C24 | C10 | C23 | 116.2° | 123.3° |
| C25 | C24 | C10 | C07 | 117.6° | 114.4° |
| C25 | C24 | C10 | C09 | 71.2° | 64.1° |
| C25 | C24 | C23 | C07 | 123.8° | 122.6° |
| C25 | C24 | C07 | C08 | 81.9° | 84.8° |
| C25 | C24 | C07 | C26 | 37.7° | 33.9° |
| C25 | C24 | C07 | O02 | 156.9° | 156.4° |
| C25 | C24 | C10 | H16 | 178.1° | 176.4° |
| C25 | C24 | C23 | H33 | 52.0° | 55.0° |
| C25 | C24 | C23 | H34 | 170.0° | 176.1° |
| C24 | C25 | H37 | H35 | 120.0° | 120.0° |
| C24 | C25 | H37 | H36 | 120.0° | 120.0° |
| C24 | C25 | H35 | H36 | 120.0° | 120.0° |
| C24 | C10 | C09 | H16 | 110.6° | 113.0° |
| C10 | C24 | C23 | C07 | 112.5° | 112.4° |
| C24 | C10 | C09 | C08 | 31.7° | 47.1° |
| C10 | C24 | C07 | C08 | 41.7° | 34.0° |
| C10 | C24 | C07 | C26 | 161.4° | 152.7° |
| C10 | C24 | C07 | O02 | 79.4° | 84.9° |
| C24 | C10 | C09 | H15 | 150.9° | 72.5° |
| C24 | C10 | C09 | H14 | 87.5° | 163.7° |
| C24 | C10 | C11 | H17 | 164.9° | 168.8° |
| C10 | C24 | C23 | H33 | 175.7° | 180.0° |
| C10 | C24 | C23 | H34 | 66.3° | 58.9° |
| C10 | C24 | C25 | H37 | 180.0° | 66.1° |
| C10 | C24 | C25 | H35 | 60.0° | 173.8° |
| C10 | C24 | C25 | H36 | 60.0° | 53.8° |
| C09 | C10 | C24 | C23 | 172.6° | 172.6° |
| C09 | C10 | C24 | C07 | 46.3° | 50.3° |
| C10 | C09 | C08 | H15 | 119.2° | 120.3° |
| C10 | C09 | C08 | H14 | 119.2° | 116.8° |
| C10 | C09 | C08 | C07 | 4.6° | 25.6° |
| C10 | C09 | C08 | H13 | 115.4° | 145.1° |
| C10 | C09 | C08 | H12 | 124.7° | 93.4° |
| C10 | C09 | H15 | H14 | 122.4° | 123.9° |
| C09 | C10 | C11 | H17 | 70.4° | 73.2° |
| C23 | C24 | C07 | C08 | 155.4° | 151.0° |
| C23 | C24 | C07 | C26 | 85.0° | 90.3° |
| C23 | C24 | C07 | O02 | 34.2° | 32.2° |
| C23 | C24 | C10 | H16 | 61.9° | 60.3° |
| C24 | C23 | C22 | H31 | 68.4° | 63.4° |
| C24 | C23 | C22 | H32 | 174.3° | 178.7° |
| C24 | C23 | H33 | H34 | 116.9° | 121.5° |
| C23 | C24 | C25 | H37 | 65.1° | 56.2° |
| C23 | C24 | C25 | H35 | 174.8° | 63.8° |
| C23 | C24 | C25 | H36 | 54.8° | 176.2° |
| C24 | C07 | C08 | C09 | 23.1° | 5.0° |
| C24 | C07 | C08 | C26 | 117.7° | 118.4° |
| C24 | C07 | C08 | O02 | 124.3° | 118.6° |
| C24 | C07 | C26 | O02 | 126.5° | 122.1° |
| C24 | C07 | C26 | O04 | 107.9° | 93.8° |
| C24 | C07 | C26 | C27 | 73.6° | 86.2° |
| C24 | C07 | O02 | C06 | 165.7° | 177.9° |
| C24 | C07 | C08 | H13 | 143.2° | 114.4° |
| C24 | C07 | C08 | H12 | 96.9° | 123.9° |
| C07 | C24 | C10 | H16 | 64.4° | 61.9° |
| C07 | C24 | C23 | H33 | 71.8° | 67.6° |
| C07 | C24 | C23 | H34 | 46.2° | 53.4° |
| C07 | C24 | C25 | H37 | 66.4° | 176.3° |
| C07 | C24 | C25 | H35 | 53.7° | 63.7° |
| C07 | C24 | C25 | H36 | 173.7° | 56.4° |
| C09 | C08 | C07 | H13 | 120.1° | 119.4° |
| C09 | C08 | C07 | H12 | 120.1° | 118.8° |
| C09 | C08 | C07 | C26 | 140.8° | 123.4° |
| C09 | C08 | C07 | O02 | 101.2° | 113.6° |
| C09 | C08 | H13 | H12 | 119.8° | 121.3° |
| C08 | C09 | H15 | H14 | 122.4° | 122.9° |
| C08 | C09 | C10 | H16 | 78.9° | 65.9° |
| C08 | C07 | C26 | O02 | 122.6° | 122.9° |
| C08 | C07 | C26 | O04 | 3.0° | 21.1° |
| C08 | C07 | C26 | C27 | 175.4° | 158.9° |
| C08 | C07 | O02 | C06 | 80.1° | 62.8° |
| C07 | C08 | H13 | H12 | 119.8° | 121.7° |
| C07 | C08 | C09 | H15 | 123.8° | 94.7° |
| C07 | C08 | C09 | H14 | 114.6° | 142.4° |
| C07 | C26 | O04 | C27 | 178.5° | 180.0° |
| C26 | C07 | O02 | C06 | 43.1° | 60.1° |
| C26 | C07 | C08 | H13 | 99.1° | 4.0° |
| C26 | C07 | C08 | H12 | 20.7° | 117.8° |
| C07 | C26 | C27 | H39 | 178.5° | 3.8° |
| C07 | C26 | C27 | H40 | 61.5° | 123.9° |
| C07 | C26 | C27 | H38 | 58.5° | 116.2° |
| O02 | C07 | C26 | O04 | 125.6° | 144.1° |
| O02 | C07 | C26 | C27 | 52.8° | 35.9° |
| C07 | O02 | C06 | C05 | 42.1° | 174.9° |
| C07 | O02 | C06 | O01 | 137.3° | 5.0° |
| O02 | C07 | C08 | H13 | 18.9° | 127.0° |
| O02 | C07 | C08 | H12 | 138.7° | 5.2° |
| O04 | C26 | C27 | H39 | 0.0° | 176.2° |
| O04 | C26 | C27 | H40 | 120.0° | 56.1° |
| O04 | C26 | C27 | H38 | 120.0° | 63.8° |
| C26 | C27 | H39 | H40 | 120.0° | 120.0° |
| C26 | C27 | H39 | H38 | 120.0° | 120.0° |
| C26 | C27 | H40 | H38 | 120.0° | 120.0° |
| O02 | C06 | C05 | O01 | 179.4° | 180.0° |
| O02 | C06 | C05 | C04 | 179.0° | 180.0° |
| O02 | C06 | C05 | H10 | 58.2° | 60.0° |
| O02 | C06 | C05 | H11 | 60.2° | 60.0° |
| C06 | C05 | C04 | H10 | 120.8° | 120.0° |
| C06 | C05 | C04 | H11 | 120.8° | 120.0° |
| C06 | C05 | C04 | C03 | 67.5° | 180.0° |
| C06 | C05 | C04 | H09 | 171.7° | 60.1° |
| C06 | C05 | C04 | H08 | 53.4° | 60.0° |
| C06 | C05 | H10 | H11 | 117.5° | 120.0° |
| O01 | C06 | C05 | C04 | 1.7° | 0.1° |
| O01 | C06 | C05 | H10 | 122.5° | 120.0° |
| O01 | C06 | C05 | H11 | 119.1° | 120.0° |
| C05 | C04 | C03 | H09 | 120.8° | 119.9° |
| C05 | C04 | C03 | H08 | 120.8° | 120.0° |
| C05 | C04 | C03 | C02 | 133.5° | 180.0° |
| C05 | C04 | C03 | H06 | 12.7° | 60.1° |
| C05 | C04 | C03 | H07 | 105.7° | 60.0° |
| C05 | C04 | H09 | H08 | 117.4° | 120.0° |
| C04 | C05 | H10 | H11 | 117.5° | 120.0° |
| C04 | C03 | C02 | H06 | 120.8° | 120.0° |
| C04 | C03 | C02 | H07 | 120.8° | 120.0° |
| C04 | C03 | C02 | C01 | 56.6° | 180.0° |
| C04 | C03 | C02 | H05 | 64.2° | 60.0° |
| C04 | C03 | C02 | H04 | 177.4° | 60.0° |
| C04 | C03 | H06 | H07 | 117.5° | 120.1° |
| C03 | C04 | H09 | H08 | 117.4° | 120.1° |
| C03 | C04 | C05 | H10 | 53.3° | 60.0° |
| C03 | C04 | C05 | H11 | 171.7° | 60.0° |
| C03 | C02 | C01 | H05 | 120.8° | 120.1° |
| C03 | C02 | C01 | H04 | 120.8° | 120.0° |
| C03 | C02 | C01 | H01 | 180.0° | 180.0° |
| C03 | C02 | C01 | H02 | 60.0° | 60.0° |
| C03 | C02 | C01 | H03 | 60.0° | 60.0° |
| C03 | C02 | H05 | H04 | 117.5° | 120.0° |
| C02 | C03 | H06 | H07 | 117.5° | 120.0° |
| C02 | C03 | C04 | H09 | 105.7° | 60.1° |
| C02 | C03 | C04 | H08 | 12.7° | 60.0° |
| C02 | C01 | H01 | H02 | 120.0° | 120.0° |
| C02 | C01 | H01 | H03 | 120.0° | 120.0° |
| C02 | C01 | H02 | H03 | 120.0° | 120.0° |
| C01 | C02 | H05 | H04 | 117.5° | 120.0° |
| C01 | C02 | C03 | H06 | 177.4° | 60.0° |
| C01 | C02 | C03 | H07 | 64.2° | 60.0° |
| H01 | C01 | H02 | H03 | 120.0° | 120.0° |
| H01 | C01 | C02 | H05 | 59.2° | 60.0° |
| H01 | C01 | C02 | H04 | 59.2° | 60.0° |
| H02 | C01 | C02 | H05 | 179.2° | 60.0° |
| H02 | C01 | C02 | H04 | 60.8° | NaN° |
| H03 | C01 | C02 | H05 | 60.8° | 180.0° |
| H03 | C01 | C02 | H04 | 179.2° | 60.0° |
| H05 | C02 | C03 | H06 | 56.6° | 180.0° |
| H05 | C02 | C03 | H07 | 175.0° | 60.0° |
| H04 | C02 | C03 | H06 | 61.8° | 60.0° |
| H04 | C02 | C03 | H07 | 56.6° | 180.0° |
| H06 | C03 | C04 | H09 | 133.5° | NaN° |
| H06 | C03 | C04 | H08 | 108.1° | 59.9° |
| H07 | C03 | C04 | H09 | 15.2° | 59.9° |
| H07 | C03 | C04 | H08 | 133.5° | 180.0° |
| H09 | C04 | C05 | H10 | 67.5° | 180.0° |
| H09 | C04 | C05 | H11 | 50.9° | 60.0° |
| H08 | C04 | C05 | H10 | 174.2° | 60.0° |
| H08 | C04 | C05 | H11 | 67.4° | 180.0° |
| H13 | C08 | C09 | H15 | 3.8° | 24.8° |
| H13 | C08 | C09 | H14 | 125.4° | 98.1° |
| H12 | C08 | C09 | H15 | 116.1° | 146.3° |
| H12 | C08 | C09 | H14 | 5.5° | 23.4° |
| H15 | C09 | C10 | H16 | 40.3° | 174.4° |
| H14 | C09 | C10 | H16 | 161.9° | 50.7° |
| H16 | C10 | C11 | H17 | 47.5° | 49.0° |
| H17 | C11 | C12 | H19 | 0.9° | 159.2° |
| H17 | C11 | C12 | H18 | 119.9° | 77.2° |
| H17 | C11 | C21 | H30 | 39.3° | 52.0° |
| H19 | C12 | C13 | H20 | 52.2° | 50.7° |
| H19 | C12 | C13 | H21 | 175.2° | 171.6° |
| H18 | C12 | C13 | H20 | 66.8° | 70.4° |
| H18 | C12 | C13 | H21 | 56.2° | 50.5° |
| H24 | C17 | C18 | H25 | 38.6° | 0.2° |
| H24 | C17 | C18 | H26 | 79.8° | 117.8° |
| H23 | C17 | C18 | H25 | 157.9° | 118.6° |
| H23 | C17 | C18 | H26 | 39.5° | 1.1° |
| H28 | C20 | H27 | H29 | 120.0° | 120.0° |
| H30 | C21 | C22 | H31 | 165.6° | 179.0° |
| H30 | C21 | C22 | H32 | 48.3° | 56.9° |
| H31 | C22 | C23 | H33 | 52.6° | 56.8° |
| H31 | C22 | C23 | H34 | 170.6° | 176.4° |
| H32 | C22 | C23 | H33 | 64.7° | 61.1° |
| H32 | C22 | C23 | H34 | 53.3° | 58.4° |
| H37 | C25 | H35 | H36 | 120.0° | 120.0° |
| H39 | C27 | H40 | H38 | 120.0° | 120.0° |
