A1D9M
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | doub | 1.35Å | 1.35Å | |
| C01 | C04 | sing | 1.42Å | 1.46Å | |
| C01 | C05 | sing | 1.51Å | 1.50Å | |
| C02 | N01 | sing | 1.37Å | 1.38Å | |
| N01 | C03 | sing | 1.34Å | 1.37Å | |
| N01 | C14 | sing | 1.46Å | 1.47Å | |
| C03 | N02 | sing | 1.35Å | 1.38Å | |
| C03 | O02 | doub | 1.22Å | 1.22Å | |
| N02 | C04 | sing | 1.35Å | 1.39Å | |
| C04 | O01 | doub | 1.22Å | 1.22Å | |
| C05 | C06 | sing | 1.53Å | 1.52Å | |
| C07 | C08 | doub | 1.38Å | 1.40Å | Aromatic |
| C07 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C07 | C14 | sing | 1.51Å | 1.51Å | |
| C08 | C09 | sing | 1.38Å | 1.39Å | Aromatic |
| C09 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | F01 | sing | 1.35Å | 1.34Å | |
| C11 | C12 | doub | 1.40Å | 1.39Å | Aromatic |
| C11 | C13 | sing | 1.48Å | 1.51Å | |
| C13 | O03 | doub | 1.22Å | 1.23Å | |
| C13 | N03 | sing | 1.35Å | 1.35Å | |
| N03 | C15 | sing | 1.47Å | 1.47Å | |
| N03 | C18 | sing | 1.47Å | 1.46Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C16 | N04 | sing | 1.47Å | 1.47Å | |
| N04 | C17 | sing | 1.47Å | 1.47Å | |
| N04 | C21 | sing | 1.47Å | 1.47Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| C17 | C19 | sing | 1.53Å | 1.54Å | |
| C19 | C20 | sing | 1.53Å | 1.52Å | |
| C20 | O04 | sing | 1.43Å | 1.43Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C15 | H14 | sing | 1.09Å | 1.10Å | |
| C15 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H28 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C02 | H01 | sing | 1.08Å | 1.08Å | |
| C05 | H04 | sing | 1.09Å | 1.10Å | |
| C05 | H03 | sing | 1.09Å | 1.10Å | |
| C06 | H07 | sing | 1.09Å | 1.10Å | |
| C06 | H05 | sing | 1.09Å | 1.10Å | |
| C06 | H06 | sing | 1.09Å | 1.10Å | |
| C08 | H08 | sing | 1.08Å | 1.08Å | |
| C09 | H09 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C14 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| N02 | H02 | sing | 0.97Å | 1.00Å | |
| O04 | H29 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C01 | C04 | 117.8° | 119.1° |
| C02 | C01 | C05 | 125.0° | 120.4° |
| C01 | C02 | N01 | 123.6° | 119.7° |
| C01 | C02 | H01 | 118.2° | 120.1° |
| C04 | C01 | C05 | 117.1° | 120.5° |
| C01 | C04 | N02 | 115.0° | 119.4° |
| C01 | C04 | O01 | 124.5° | 120.3° |
| C01 | C05 | C06 | 113.8° | 109.4° |
| C01 | C05 | H04 | 108.4° | 109.5° |
| C01 | C05 | H03 | 108.4° | 109.5° |
| C02 | N01 | C03 | 121.6° | 120.6° |
| C02 | N01 | C14 | 119.5° | 119.7° |
| N01 | C02 | H01 | 118.2° | 120.2° |
| C03 | N01 | C14 | 118.9° | 119.7° |
| N01 | C03 | N02 | 114.7° | 121.0° |
| N01 | C03 | O02 | 123.8° | 119.5° |
| N01 | C14 | C07 | 115.8° | 109.5° |
| N01 | C14 | H11 | 107.9° | 109.5° |
| N01 | C14 | H12 | 107.9° | 109.5° |
| N02 | C03 | O02 | 121.6° | 119.5° |
| C03 | N02 | C04 | 127.3° | 120.2° |
| C03 | N02 | H02 | 116.3° | 119.9° |
| N02 | C04 | O01 | 120.4° | 120.3° |
| C04 | N02 | H02 | 116.3° | 119.9° |
| C06 | C05 | H04 | 108.4° | 109.4° |
| C06 | C05 | H03 | 108.4° | 109.4° |
| C05 | C06 | H07 | 109.5° | 109.4° |
| C05 | C06 | H05 | 109.5° | 109.5° |
| C05 | C06 | H06 | 109.5° | 109.5° |
| C08 | C07 | C12 | 119.4° | 120.3° |
| C08 | C07 | C14 | 119.4° | 119.9° |
| C07 | C08 | C09 | 120.7° | 120.3° |
| C07 | C08 | H08 | 119.6° | 119.8° |
| C12 | C07 | C14 | 121.2° | 119.8° |
| C07 | C12 | C11 | 121.0° | 119.8° |
| C07 | C12 | H10 | 119.5° | 120.1° |
| C07 | C14 | H11 | 107.9° | 109.5° |
| C07 | C14 | H12 | 107.8° | 109.5° |
| C08 | C09 | C10 | 118.2° | 120.2° |
| C09 | C08 | H08 | 119.7° | 119.8° |
| C08 | C09 | H09 | 120.9° | 119.9° |
| C09 | C10 | C11 | 123.2° | 119.7° |
| C09 | C10 | F01 | 118.4° | 120.1° |
| C10 | C09 | H09 | 120.9° | 120.0° |
| C11 | C10 | F01 | 118.4° | 120.1° |
| C10 | C11 | C12 | 117.5° | 119.7° |
| C10 | C11 | C13 | 124.0° | 120.2° |
| C12 | C11 | C13 | 118.5° | 120.2° |
| C11 | C12 | H10 | 119.5° | 120.1° |
| C11 | C13 | O03 | 117.6° | 120.0° |
| C11 | C13 | N03 | 122.0° | 120.0° |
| O03 | C13 | N03 | 120.4° | 120.0° |
| C13 | N03 | C15 | 123.2° | 120.8° |
| C13 | N03 | C18 | 123.8° | 120.9° |
| C15 | N03 | C18 | 112.9° | 118.2° |
| N03 | C15 | C16 | 109.2° | 108.5° |
| N03 | C15 | H14 | 109.5° | 109.6° |
| N03 | C15 | H13 | 109.5° | 109.8° |
| N03 | C18 | C17 | 111.6° | 108.6° |
| N03 | C18 | H18 | 108.9° | 109.6° |
| N03 | C18 | H19 | 108.9° | 109.8° |
| C15 | C16 | N04 | 111.7° | 109.4° |
| C16 | C15 | H14 | 109.5° | 109.6° |
| C16 | C15 | H13 | 109.5° | 109.6° |
| C15 | C16 | H16 | 108.9° | 109.5° |
| C15 | C16 | H15 | 108.9° | 109.5° |
| C16 | N04 | C17 | 112.2° | 111.3° |
| C16 | N04 | C21 | 110.7° | 111.0° |
| N04 | C16 | H16 | 108.9° | 109.5° |
| N04 | C16 | H15 | 108.9° | 109.5° |
| C17 | N04 | C21 | 112.1° | 111.0° |
| N04 | C17 | C18 | 107.5° | 109.4° |
| N04 | C17 | C19 | 115.9° | 109.5° |
| N04 | C17 | H17 | 107.2° | 109.5° |
| N04 | C21 | C22 | 114.3° | 109.5° |
| N04 | C21 | H25 | 108.2° | 109.5° |
| N04 | C21 | H24 | 108.2° | 109.5° |
| C18 | C17 | C19 | 112.7° | 109.5° |
| C18 | C17 | H17 | 106.6° | 109.5° |
| C17 | C18 | H18 | 109.0° | 109.6° |
| C17 | C18 | H19 | 108.9° | 109.6° |
| C17 | C19 | C20 | 112.0° | 109.4° |
| C19 | C17 | H17 | 106.5° | 109.5° |
| C17 | C19 | H21 | 108.8° | 109.4° |
| C17 | C19 | H20 | 108.8° | 109.5° |
| C19 | C20 | O04 | 107.8° | 109.4° |
| C19 | C20 | H22 | 109.9° | 109.4° |
| C19 | C20 | H23 | 109.9° | 109.5° |
| C20 | C19 | H21 | 108.8° | 109.5° |
| C20 | C19 | H20 | 108.9° | 109.5° |
| O04 | C20 | H22 | 109.9° | 109.5° |
| O04 | C20 | H23 | 109.9° | 109.5° |
| C20 | O04 | H29 | 109.5° | 114.0° |
| C22 | C21 | H25 | 108.3° | 109.5° |
| C22 | C21 | H24 | 108.3° | 109.5° |
| C21 | C22 | H27 | 109.5° | 109.5° |
| C21 | C22 | H28 | 109.4° | 109.5° |
| C21 | C22 | H26 | 109.5° | 109.4° |
| H14 | C15 | H13 | 109.5° | 109.7° |
| H22 | C20 | H23 | 109.5° | 109.5° |
| H25 | C21 | H24 | 109.4° | 109.5° |
| H27 | C22 | H28 | 109.5° | 109.5° |
| H27 | C22 | H26 | 109.5° | 109.4° |
| H28 | C22 | H26 | 109.5° | 109.5° |
| H04 | C05 | H03 | 109.4° | 109.5° |
| H07 | C06 | H05 | 109.5° | 109.5° |
| H07 | C06 | H06 | 109.4° | 109.5° |
| H05 | C06 | H06 | 109.5° | 109.5° |
| H11 | C14 | H12 | 109.5° | 109.5° |
| H16 | C16 | H15 | 109.5° | 109.5° |
| H18 | C18 | H19 | 109.5° | 109.6° |
| H21 | C19 | H20 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C01 | C04 | C05 | 179.7° | 179.7° |
| C01 | C02 | N01 | H01 | 180.0° | 180.0° |
| C01 | C02 | N01 | C03 | 0.2° | 0.0° |
| C01 | C02 | N01 | C14 | 179.5° | 180.0° |
| C02 | C01 | C04 | N02 | 0.0° | 0.0° |
| C02 | C01 | C04 | O01 | 179.9° | 180.0° |
| C02 | C01 | C05 | C06 | 5.9° | 95.0° |
| C02 | C01 | C05 | H04 | 114.8° | 145.0° |
| C02 | C01 | C05 | H03 | 126.6° | 24.9° |
| C04 | C01 | C02 | N01 | 0.3° | 0.0° |
| C01 | C04 | N02 | C03 | 0.3° | 0.0° |
| C01 | C04 | N02 | O01 | 179.9° | 179.9° |
| C04 | C01 | C05 | C06 | 173.7° | 85.3° |
| C04 | C01 | C02 | H01 | 179.8° | 180.0° |
| C04 | C01 | C05 | H04 | 65.6° | 34.6° |
| C04 | C01 | C05 | H03 | 53.1° | 154.7° |
| C01 | C04 | N02 | H02 | 179.7° | 179.9° |
| C05 | C01 | C02 | N01 | 179.9° | 179.7° |
| C05 | C01 | C04 | N02 | 179.7° | 179.7° |
| C05 | C01 | C04 | O01 | 0.3° | 0.3° |
| C01 | C05 | C06 | H04 | 120.7° | 120.0° |
| C01 | C05 | C06 | H03 | 120.6° | 120.0° |
| C05 | C01 | C02 | H01 | 0.1° | 0.3° |
| C01 | C05 | H04 | H03 | 118.0° | 120.1° |
| C01 | C05 | C06 | H07 | 180.0° | 60.0° |
| C01 | C05 | C06 | H05 | 60.0° | 60.0° |
| C01 | C05 | C06 | H06 | 60.0° | 180.0° |
| C02 | N01 | C03 | C14 | 179.7° | 179.9° |
| C02 | N01 | C03 | N02 | 0.1° | 0.1° |
| C02 | N01 | C03 | O02 | 179.9° | 179.9° |
| C02 | N01 | C14 | C07 | 89.0° | 90.0° |
| C02 | N01 | C14 | H11 | 150.0° | 30.0° |
| C02 | N01 | C14 | H12 | 31.9° | 150.0° |
| N01 | C03 | N02 | O02 | 180.0° | 180.0° |
| N01 | C03 | N02 | C04 | 0.3° | 0.0° |
| C03 | N01 | C14 | C07 | 91.2° | 90.0° |
| C03 | N01 | C02 | H01 | 179.8° | 179.9° |
| C03 | N01 | C14 | H11 | 29.7° | 149.9° |
| C03 | N01 | C14 | H12 | 147.9° | 30.0° |
| N01 | C03 | N02 | H02 | 179.7° | 179.9° |
| C14 | N01 | C03 | N02 | 179.8° | 180.0° |
| C14 | N01 | C03 | O02 | 0.2° | 0.0° |
| N01 | C14 | C07 | C08 | 146.0° | 90.0° |
| N01 | C14 | C07 | C12 | 34.0° | 89.2° |
| N01 | C14 | C07 | H11 | 120.9° | 120.0° |
| N01 | C14 | C07 | H12 | 120.9° | 120.0° |
| C14 | N01 | C02 | H01 | 0.5° | 0.0° |
| N01 | C14 | H11 | H12 | 117.1° | 120.0° |
| C03 | N02 | C04 | H02 | 180.0° | 179.9° |
| C03 | N02 | C04 | O01 | 179.8° | 180.0° |
| O02 | C03 | N02 | C04 | 179.6° | 180.0° |
| O02 | C03 | N02 | H02 | 0.3° | 0.0° |
| O01 | C04 | N02 | H02 | 0.2° | 0.0° |
| C06 | C05 | H04 | H03 | 118.0° | 120.0° |
| C05 | C06 | H07 | H05 | 120.0° | 120.0° |
| C05 | C06 | H07 | H06 | 120.0° | 120.0° |
| C05 | C06 | H05 | H06 | 120.0° | 120.0° |
| C08 | C07 | C12 | C14 | 179.9° | 179.2° |
| C07 | C08 | C09 | H08 | 180.0° | 179.1° |
| C07 | C08 | C09 | C10 | 0.0° | 0.6° |
| C08 | C07 | C12 | C11 | 0.9° | 0.5° |
| C07 | C08 | C09 | H09 | 180.0° | 179.4° |
| C08 | C07 | C12 | H10 | 179.2° | 180.0° |
| C08 | C07 | C14 | H11 | 93.1° | 150.0° |
| C08 | C07 | C14 | H12 | 25.1° | 30.0° |
| C12 | C07 | C08 | C09 | 0.3° | 0.8° |
| C07 | C12 | C11 | C10 | 1.1° | 0.1° |
| C07 | C12 | C11 | H10 | 180.0° | 179.5° |
| C07 | C12 | C11 | C13 | 179.3° | 180.0° |
| C12 | C07 | C08 | H08 | 179.7° | 180.0° |
| C12 | C07 | C14 | H11 | 86.9° | 30.8° |
| C12 | C07 | C14 | H12 | 154.9° | 150.8° |
| C14 | C07 | C08 | C09 | 179.8° | 180.0° |
| C14 | C07 | C12 | C11 | 179.2° | 179.7° |
| C14 | C07 | C08 | H08 | 0.2° | 0.8° |
| C14 | C07 | C12 | H10 | 0.8° | 0.8° |
| C07 | C14 | H11 | H12 | 117.1° | 120.0° |
| C08 | C09 | C10 | H09 | 180.0° | 180.0° |
| C08 | C09 | C10 | C11 | 0.2° | 0.0° |
| C08 | C09 | C10 | F01 | 180.0° | 179.7° |
| C09 | C10 | C11 | F01 | 179.8° | 179.7° |
| C09 | C10 | C11 | C12 | 0.7° | 0.3° |
| C09 | C10 | C11 | C13 | 178.9° | 179.8° |
| C10 | C09 | C08 | H08 | 180.0° | 179.7° |
| C10 | C11 | C12 | C13 | 178.3° | 179.9° |
| C10 | C11 | C13 | O03 | 113.9° | 52.7° |
| C10 | C11 | C13 | N03 | 65.5° | 127.3° |
| C11 | C10 | C09 | H09 | 179.8° | 180.0° |
| C10 | C11 | C12 | H10 | 179.0° | 179.4° |
| F01 | C10 | C11 | C12 | 179.5° | 180.0° |
| F01 | C10 | C11 | C13 | 1.3° | 0.1° |
| F01 | C10 | C09 | H09 | 0.0° | 0.3° |
| C12 | C11 | C13 | O03 | 64.2° | 127.2° |
| C12 | C11 | C13 | N03 | 116.3° | 52.8° |
| C11 | C13 | O03 | N03 | 179.5° | 180.0° |
| C11 | C13 | N03 | C15 | 0.6° | 4.4° |
| C11 | C13 | N03 | C18 | 179.5° | 175.5° |
| C13 | C11 | C12 | H10 | 0.7° | 0.5° |
| O03 | C13 | N03 | C15 | 179.9° | 175.6° |
| O03 | C13 | N03 | C18 | 0.0° | 4.4° |
| C13 | N03 | C15 | C18 | 179.9° | 180.0° |
| C13 | N03 | C15 | C16 | 125.7° | 128.8° |
| C13 | N03 | C18 | C17 | 122.3° | 128.8° |
| C13 | N03 | C15 | H14 | 5.7° | 9.1° |
| C13 | N03 | C15 | H13 | 114.3° | 111.4° |
| C13 | N03 | C18 | H18 | 117.4° | 111.5° |
| C13 | N03 | C18 | H19 | 2.0° | 9.0° |
| N03 | C15 | C16 | H14 | 120.0° | 119.7° |
| N03 | C15 | C16 | H13 | 120.0° | 119.9° |
| N03 | C15 | C16 | N04 | 53.8° | 53.8° |
| C15 | N03 | C18 | C17 | 57.6° | 51.2° |
| N03 | C15 | H14 | H13 | 120.1° | 120.6° |
| N03 | C15 | C16 | H16 | 66.5° | 173.8° |
| N03 | C15 | C16 | H15 | 174.1° | 66.1° |
| C15 | N03 | C18 | H18 | 62.7° | 68.5° |
| C15 | N03 | C18 | H19 | 178.0° | 171.0° |
| C18 | N03 | C15 | C16 | 54.2° | 51.1° |
| N03 | C18 | C17 | N04 | 57.0° | 53.8° |
| N03 | C18 | C17 | H18 | 120.3° | 119.7° |
| N03 | C18 | C17 | H19 | 120.3° | 119.9° |
| N03 | C18 | C17 | C19 | 71.9° | 173.8° |
| C18 | N03 | C15 | H14 | 174.2° | 170.8° |
| C18 | N03 | C15 | H13 | 65.7° | 68.6° |
| N03 | C18 | C17 | H17 | 171.6° | 66.2° |
| N03 | C18 | H18 | H19 | 119.0° | 120.6° |
| C15 | C16 | N04 | H16 | 120.3° | 120.0° |
| C15 | C16 | N04 | H15 | 120.3° | 119.9° |
| C15 | C16 | N04 | C17 | 58.0° | 63.1° |
| C15 | C16 | N04 | C21 | 68.2° | 172.7° |
| C16 | C15 | H14 | H13 | 120.1° | 120.4° |
| C15 | C16 | H16 | H15 | 119.0° | 120.0° |
| C16 | N04 | C17 | C21 | 125.4° | 124.2° |
| C16 | N04 | C17 | C18 | 57.6° | 63.0° |
| C16 | N04 | C17 | C19 | 69.4° | 177.0° |
| C16 | N04 | C21 | C22 | 64.1° | 71.8° |
| N04 | C16 | C15 | H14 | 173.7° | 173.5° |
| N04 | C16 | C15 | H13 | 66.2° | 66.1° |
| C16 | N04 | C17 | H17 | 171.8° | 56.9° |
| C16 | N04 | C21 | H25 | 56.6° | 168.2° |
| C16 | N04 | C21 | H24 | 175.1° | 48.2° |
| N04 | C16 | H16 | H15 | 119.0° | 120.0° |
| N04 | C17 | C18 | C19 | 128.9° | 120.0° |
| N04 | C17 | C18 | H17 | 114.6° | 120.0° |
| N04 | C17 | C19 | H17 | 119.1° | 120.1° |
| N04 | C17 | C19 | C20 | 80.8° | 178.5° |
| C17 | N04 | C21 | C22 | 169.7° | 163.8° |
| C17 | N04 | C21 | H25 | 69.6° | 43.9° |
| C17 | N04 | C21 | H24 | 48.9° | 76.1° |
| C17 | N04 | C16 | H16 | 62.3° | 176.9° |
| C17 | N04 | C16 | H15 | 178.3° | 56.9° |
| N04 | C17 | C18 | H18 | 63.3° | 65.9° |
| N04 | C17 | C18 | H19 | 177.3° | 173.7° |
| N04 | C17 | C19 | H21 | 158.8° | 61.5° |
| N04 | C17 | C19 | H20 | 39.6° | 58.5° |
| C21 | N04 | C17 | C18 | 67.8° | 172.8° |
| C21 | N04 | C17 | C19 | 165.2° | 52.8° |
| N04 | C21 | C22 | H25 | 120.7° | 120.0° |
| N04 | C21 | C22 | H24 | 120.7° | 120.0° |
| C21 | N04 | C17 | H17 | 46.4° | 67.3° |
| N04 | C21 | H25 | H24 | 117.7° | 120.0° |
| N04 | C21 | C22 | H27 | 180.0° | 60.0° |
| N04 | C21 | C22 | H28 | 60.0° | 60.0° |
| N04 | C21 | C22 | H26 | 60.0° | 179.9° |
| C21 | N04 | C16 | H16 | 171.5° | 52.7° |
| C21 | N04 | C16 | H15 | 52.2° | 67.3° |
| C18 | C17 | C19 | H17 | 116.5° | 120.1° |
| C18 | C17 | C19 | C20 | 154.8° | 61.6° |
| C17 | C18 | H18 | H19 | 119.0° | 120.4° |
| C18 | C17 | C19 | H21 | 34.5° | 58.4° |
| C18 | C17 | C19 | H20 | 84.8° | 178.4° |
| C17 | C19 | C20 | H21 | 120.4° | 120.0° |
| C17 | C19 | C20 | H20 | 120.4° | 120.0° |
| C17 | C19 | C20 | O04 | 141.8° | 176.7° |
| C17 | C19 | C20 | H22 | 22.1° | 63.3° |
| C17 | C19 | C20 | H23 | 98.4° | 56.7° |
| C19 | C17 | C18 | H18 | 167.8° | 54.1° |
| C19 | C17 | C18 | H19 | 48.4° | 66.3° |
| C17 | C19 | H21 | H20 | 118.8° | 120.0° |
| C19 | C20 | O04 | H22 | 119.7° | 120.0° |
| C19 | C20 | O04 | H23 | 119.7° | 120.0° |
| C20 | C19 | C17 | H17 | 38.3° | 58.5° |
| C19 | C20 | H22 | H23 | 120.8° | 120.0° |
| C20 | C19 | H21 | H20 | 118.9° | 120.1° |
| C19 | C20 | O04 | H29 | 180.0° | 179.9° |
| O04 | C20 | H22 | H23 | 120.8° | 120.1° |
| O04 | C20 | C19 | H21 | 97.8° | 56.8° |
| O04 | C20 | C19 | H20 | 21.4° | 63.3° |
| C22 | C21 | H25 | H24 | 117.8° | 120.0° |
| C21 | C22 | H27 | H28 | 120.0° | 120.0° |
| C21 | C22 | H27 | H26 | 120.0° | 119.9° |
| C21 | C22 | H28 | H26 | 120.0° | 120.0° |
| H14 | C15 | C16 | H16 | 53.4° | 66.5° |
| H14 | C15 | C16 | H15 | 65.9° | 53.6° |
| H13 | C15 | C16 | H16 | 173.5° | 53.9° |
| H13 | C15 | C16 | H15 | 54.1° | 174.0° |
| H17 | C17 | C18 | H18 | 51.3° | 174.1° |
| H17 | C17 | C18 | H19 | 68.0° | 53.8° |
| H17 | C17 | C19 | H21 | 82.0° | 178.4° |
| H17 | C17 | C19 | H20 | 158.7° | 61.5° |
| H22 | C20 | C19 | H21 | 142.4° | 176.7° |
| H22 | C20 | C19 | H20 | 98.3° | 56.7° |
| H22 | C20 | O04 | H29 | 60.2° | 60.0° |
| H23 | C20 | C19 | H21 | 21.9° | 63.3° |
| H23 | C20 | C19 | H20 | 141.2° | 176.7° |
| H23 | C20 | O04 | H29 | 60.3° | 60.1° |
| H25 | C21 | C22 | H27 | 59.3° | 59.9° |
| H25 | C21 | C22 | H28 | 179.3° | 180.0° |
| H25 | C21 | C22 | H26 | 60.7° | 60.0° |
| H24 | C21 | C22 | H27 | 59.3° | 179.9° |
| H24 | C21 | C22 | H28 | 60.7° | 60.0° |
| H24 | C21 | C22 | H26 | 179.3° | 60.0° |
| H27 | C22 | H28 | H26 | 120.0° | 120.0° |
| H04 | C05 | C06 | H07 | 59.3° | 180.0° |
| H04 | C05 | C06 | H05 | 179.4° | 60.0° |
| H04 | C05 | C06 | H06 | 60.6° | 60.0° |
| H03 | C05 | C06 | H07 | 59.4° | 60.0° |
| H03 | C05 | C06 | H05 | 60.7° | 180.0° |
| H03 | C05 | C06 | H06 | 179.3° | 60.0° |
| H07 | C06 | H05 | H06 | 120.0° | 120.0° |
| H08 | C08 | C09 | H09 | 0.0° | 0.3° |
