A1CH5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | C02 | doub | 1.38Å | 1.40Å | Aromatic |
| C01 | C05 | sing | 1.38Å | 1.39Å | Aromatic |
| C02 | C03 | sing | 1.40Å | 1.40Å | Aromatic |
| C03 | C04 | doub | 1.39Å | 1.41Å | Aromatic |
| C03 | C06 | sing | 1.48Å | 1.49Å | |
| C04 | N01 | sing | 1.32Å | 1.36Å | Aromatic |
| C04 | C07 | sing | 1.51Å | 1.53Å | |
| N01 | C05 | doub | 1.32Å | 1.36Å | Aromatic |
| C06 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C06 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C07 | N02 | sing | 1.46Å | 1.46Å | |
| C07 | C08 | sing | 1.53Å | 1.56Å | |
| N02 | C20 | sing | 1.35Å | 1.34Å | |
| C08 | C09 | sing | 1.51Å | 1.52Å | |
| C09 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C09 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C10 | C11 | sing | 1.38Å | 1.40Å | Aromatic |
| C11 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | F02 | sing | 1.35Å | 1.35Å | |
| C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | F01 | sing | 1.35Å | 1.35Å | |
| C15 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C17 | CL01 | sing | 1.74Å | 1.73Å | |
| C18 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.51Å | 1.53Å | |
| C20 | O01 | doub | 1.21Å | 1.23Å | |
| C21 | C22 | sing | 1.51Å | 1.52Å | |
| C22 | C23 | doub | 1.34Å | 1.38Å | Aromatic |
| C22 | C25 | sing | 1.46Å | 1.44Å | Aromatic |
| C23 | N03 | sing | 1.37Å | 1.37Å | Aromatic |
| N03 | C24 | sing | 1.38Å | 1.38Å | Aromatic |
| C24 | C25 | doub | 1.41Å | 1.43Å | Aromatic |
| C24 | C26 | sing | 1.39Å | 1.40Å | Aromatic |
| C25 | C29 | sing | 1.40Å | 1.40Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | C28 | sing | 1.39Å | 1.39Å | Aromatic |
| C28 | C29 | doub | 1.38Å | 1.39Å | Aromatic |
| C28 | O02 | sing | 1.36Å | 1.37Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C15 | H13 | sing | 1.08Å | 1.08Å | |
| C21 | H17 | sing | 1.09Å | 1.10Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.08Å | 1.08Å | |
| C01 | H04 | sing | 1.08Å | 1.08Å | |
| C02 | H05 | sing | 1.08Å | 1.08Å | |
| C05 | H06 | sing | 1.08Å | 1.08Å | |
| C07 | H07 | sing | 1.09Å | 1.10Å | |
| C08 | H08 | sing | 1.09Å | 1.10Å | |
| C08 | H09 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.08Å | 1.08Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C16 | H14 | sing | 1.08Å | 1.08Å | |
| C18 | H15 | sing | 1.08Å | 1.08Å | |
| C19 | H16 | sing | 1.08Å | 1.08Å | |
| C23 | H19 | sing | 1.08Å | 1.08Å | |
| C27 | H21 | sing | 1.08Å | 1.08Å | |
| C29 | H22 | sing | 1.08Å | 1.08Å | |
| N02 | H02 | sing | 0.97Å | 1.00Å | |
| N03 | H01 | sing | 0.97Å | 1.00Å | |
| O02 | H03 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C01 | C05 | 118.6° | 119.3° |
| C01 | C02 | C03 | 120.3° | 118.3° |
| C02 | C01 | H04 | 120.7° | 120.3° |
| C01 | C02 | H05 | 119.8° | 120.9° |
| C01 | C05 | N01 | 122.6° | 121.0° |
| C05 | C01 | H04 | 120.7° | 120.4° |
| C01 | C05 | H06 | 118.7° | 119.5° |
| C02 | C03 | C04 | 117.4° | 119.0° |
| C02 | C03 | C06 | 120.5° | 120.5° |
| C03 | C02 | H05 | 119.8° | 120.9° |
| C04 | C03 | C06 | 122.1° | 120.5° |
| C03 | C04 | N01 | 122.7° | 120.6° |
| C03 | C04 | C07 | 121.0° | 119.7° |
| C03 | C06 | C15 | 119.8° | 120.1° |
| C03 | C06 | C19 | 121.2° | 120.1° |
| N01 | C04 | C07 | 116.3° | 119.7° |
| C04 | N01 | C05 | 118.4° | 121.9° |
| C04 | C07 | N02 | 112.9° | 109.4° |
| C04 | C07 | C08 | 112.3° | 109.5° |
| C04 | C07 | H07 | 106.5° | 109.5° |
| N01 | C05 | H06 | 118.7° | 119.5° |
| C15 | C06 | C19 | 119.0° | 119.8° |
| C06 | C15 | C16 | 120.5° | 119.9° |
| C06 | C15 | H13 | 119.8° | 120.0° |
| C06 | C19 | C18 | 120.7° | 119.9° |
| C06 | C19 | H16 | 119.7° | 120.1° |
| N02 | C07 | C08 | 111.0° | 109.5° |
| C07 | N02 | C20 | 125.4° | 120.0° |
| N02 | C07 | H07 | 107.4° | 109.4° |
| C07 | N02 | H02 | 117.3° | 120.0° |
| C07 | C08 | C09 | 113.8° | 109.5° |
| C08 | C07 | H07 | 106.3° | 109.5° |
| C07 | C08 | H08 | 108.4° | 109.5° |
| C07 | C08 | H09 | 108.4° | 109.5° |
| N02 | C20 | C21 | 117.1° | 120.0° |
| N02 | C20 | O01 | 123.0° | 120.0° |
| C20 | N02 | H02 | 117.3° | 119.9° |
| C08 | C09 | C10 | 120.1° | 120.0° |
| C08 | C09 | C14 | 120.4° | 119.9° |
| C09 | C08 | H08 | 108.4° | 109.5° |
| C09 | C08 | H09 | 108.4° | 109.5° |
| C10 | C09 | C14 | 119.5° | 120.1° |
| C09 | C10 | C11 | 120.3° | 120.0° |
| C09 | C10 | H10 | 119.9° | 120.0° |
| C09 | C14 | C13 | 120.1° | 120.0° |
| C09 | C14 | H12 | 119.9° | 120.0° |
| C10 | C11 | C12 | 120.0° | 120.0° |
| C10 | C11 | F02 | 119.8° | 120.0° |
| C11 | C10 | H10 | 119.8° | 120.0° |
| C12 | C11 | F02 | 120.2° | 120.0° |
| C11 | C12 | C13 | 119.8° | 119.9° |
| C11 | C12 | H11 | 120.1° | 120.0° |
| C12 | C13 | C14 | 120.2° | 120.0° |
| C12 | C13 | F01 | 120.1° | 120.0° |
| C13 | C12 | H11 | 120.1° | 120.1° |
| C14 | C13 | F01 | 119.7° | 120.0° |
| C13 | C14 | H12 | 120.0° | 120.0° |
| C15 | C16 | C17 | 119.9° | 120.1° |
| C16 | C15 | H13 | 119.7° | 120.1° |
| C15 | C16 | H14 | 120.0° | 119.9° |
| C16 | C17 | C18 | 120.3° | 120.3° |
| C16 | C17 | CL01 | 119.4° | 119.9° |
| C17 | C16 | H14 | 120.0° | 120.0° |
| C18 | C17 | CL01 | 120.3° | 119.9° |
| C17 | C18 | C19 | 119.5° | 120.1° |
| C17 | C18 | H15 | 120.2° | 119.9° |
| C19 | C18 | H15 | 120.2° | 120.0° |
| C18 | C19 | H16 | 119.6° | 120.0° |
| C21 | C20 | O01 | 119.9° | 120.0° |
| C20 | C21 | C22 | 109.3° | 109.5° |
| C20 | C21 | H17 | 109.5° | 109.5° |
| C20 | C21 | H18 | 109.5° | 109.4° |
| C21 | C22 | C23 | 127.5° | 126.5° |
| C21 | C22 | C25 | 127.3° | 126.5° |
| C22 | C21 | H17 | 109.5° | 109.5° |
| C22 | C21 | H18 | 109.5° | 109.4° |
| C23 | C22 | C25 | 105.2° | 107.1° |
| C22 | C23 | N03 | 110.5° | 110.0° |
| C22 | C23 | H19 | 124.7° | 125.1° |
| C22 | C25 | C24 | 107.9° | 106.0° |
| C22 | C25 | C29 | 133.6° | 134.0° |
| C23 | N03 | C24 | 109.9° | 109.8° |
| N03 | C23 | H19 | 124.7° | 125.0° |
| C23 | N03 | H01 | 125.1° | 125.1° |
| N03 | C24 | C25 | 106.4° | 107.1° |
| N03 | C24 | C26 | 131.1° | 133.4° |
| C24 | N03 | H01 | 125.1° | 125.0° |
| C25 | C24 | C26 | 122.4° | 119.5° |
| C24 | C25 | C29 | 118.5° | 120.0° |
| C24 | C26 | C27 | 117.0° | 120.0° |
| C24 | C26 | H20 | 121.5° | 120.0° |
| C25 | C29 | C28 | 119.3° | 119.6° |
| C25 | C29 | H22 | 120.4° | 120.2° |
| C26 | C27 | C28 | 121.7° | 120.6° |
| C27 | C26 | H20 | 121.5° | 120.0° |
| C26 | C27 | H21 | 119.2° | 119.7° |
| C27 | C28 | C29 | 121.1° | 120.3° |
| C27 | C28 | O02 | 119.9° | 119.9° |
| C28 | C27 | H21 | 119.2° | 119.7° |
| C29 | C28 | O02 | 119.0° | 119.9° |
| C28 | C29 | H22 | 120.4° | 120.2° |
| C28 | O02 | H03 | 109.5° | 114.0° |
| H17 | C21 | H18 | 109.5° | 109.5° |
| H08 | C08 | H09 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C01 | C05 | H04 | 180.0° | 179.8° |
| C01 | C02 | C03 | H05 | 180.0° | 180.0° |
| C01 | C02 | C03 | C04 | 0.2° | 0.0° |
| C01 | C02 | C03 | C06 | 179.8° | 180.0° |
| C02 | C01 | C05 | N01 | 0.1° | 0.0° |
| C02 | C01 | C05 | H06 | 179.8° | 180.0° |
| C05 | C01 | C02 | C03 | 0.2° | 0.0° |
| C01 | C05 | N01 | C04 | 0.0° | 0.0° |
| C01 | C05 | N01 | H06 | 180.0° | 179.9° |
| C05 | C01 | C02 | H05 | 179.8° | 180.0° |
| C02 | C03 | C04 | C06 | 179.6° | 180.0° |
| C02 | C03 | C04 | N01 | 0.0° | 0.0° |
| C02 | C03 | C04 | C07 | 179.2° | 180.0° |
| C02 | C03 | C06 | C15 | 78.5° | 56.5° |
| C02 | C03 | C06 | C19 | 102.1° | 123.4° |
| C03 | C02 | C01 | H04 | 179.7° | 179.7° |
| C03 | C04 | N01 | C07 | 179.2° | 179.9° |
| C03 | C04 | N01 | C05 | 0.1° | 0.0° |
| C04 | C03 | C06 | C15 | 101.1° | 123.5° |
| C04 | C03 | C06 | C19 | 78.3° | 56.6° |
| C03 | C04 | C07 | N02 | 142.4° | 130.6° |
| C03 | C04 | C07 | C08 | 91.1° | 109.4° |
| C04 | C03 | C02 | H05 | 179.9° | 180.0° |
| C03 | C04 | C07 | H07 | 24.9° | 10.7° |
| C06 | C03 | C04 | N01 | 179.6° | 180.0° |
| C06 | C03 | C04 | C07 | 0.4° | 0.0° |
| C03 | C06 | C15 | C19 | 179.4° | 179.9° |
| C03 | C06 | C15 | C16 | 179.5° | 180.0° |
| C03 | C06 | C19 | C18 | 179.5° | 179.9° |
| C03 | C06 | C15 | H13 | 0.5° | 0.1° |
| C06 | C03 | C02 | H05 | 0.2° | 0.0° |
| C03 | C06 | C19 | H16 | 0.5° | 0.1° |
| N01 | C04 | C07 | N02 | 38.4° | 49.4° |
| N01 | C04 | C07 | C08 | 88.1° | 70.6° |
| C04 | N01 | C05 | H06 | 180.0° | 180.0° |
| N01 | C04 | C07 | H07 | 156.0° | 169.4° |
| C07 | C04 | N01 | C05 | 179.3° | 179.9° |
| C04 | C07 | N02 | C08 | 127.1° | 120.0° |
| C04 | C07 | N02 | H07 | 117.1° | 120.0° |
| C04 | C07 | C08 | H07 | 116.1° | 120.0° |
| C04 | C07 | N02 | C20 | 107.1° | 154.9° |
| C04 | C07 | C08 | C09 | 161.2° | 175.0° |
| C04 | C07 | C08 | H08 | 78.1° | 65.0° |
| C04 | C07 | C08 | H09 | 40.6° | 55.0° |
| C04 | C07 | N02 | H02 | 72.9° | 25.0° |
| N01 | C05 | C01 | H04 | 179.8° | 179.7° |
| C06 | C15 | C16 | H13 | 180.0° | 179.9° |
| C06 | C15 | C16 | C17 | 0.0° | 0.1° |
| C15 | C06 | C19 | C18 | 0.2° | 0.0° |
| C06 | C15 | C16 | H14 | 180.0° | 179.8° |
| C15 | C06 | C19 | H16 | 179.8° | 180.0° |
| C19 | C06 | C15 | C16 | 0.2° | 0.1° |
| C06 | C19 | C18 | C17 | 0.0° | 0.3° |
| C06 | C19 | C18 | H16 | 180.0° | 180.0° |
| C19 | C06 | C15 | H13 | 179.8° | 179.8° |
| C06 | C19 | C18 | H15 | 180.0° | 179.8° |
| N02 | C07 | C08 | H07 | 116.5° | 120.0° |
| C07 | N02 | C20 | H02 | 180.0° | 179.9° |
| N02 | C07 | C08 | C09 | 71.3° | 65.0° |
| C07 | N02 | C20 | C21 | 178.7° | 180.0° |
| C07 | N02 | C20 | O01 | 1.8° | 0.0° |
| N02 | C07 | C08 | H08 | 49.3° | 55.0° |
| N02 | C07 | C08 | H09 | 168.0° | 175.0° |
| C08 | C07 | N02 | C20 | 125.8° | 85.0° |
| C07 | C08 | C09 | H08 | 120.6° | 120.0° |
| C07 | C08 | C09 | H09 | 120.6° | 120.0° |
| C07 | C08 | C09 | C10 | 97.0° | 90.0° |
| C07 | C08 | C09 | C14 | 82.6° | 90.0° |
| C07 | C08 | H08 | H09 | 118.0° | 120.0° |
| C08 | C07 | N02 | H02 | 54.2° | 95.1° |
| N02 | C20 | C21 | O01 | 179.6° | 180.0° |
| N02 | C20 | C21 | C22 | 128.9° | 180.0° |
| N02 | C20 | C21 | H17 | 111.2° | 60.0° |
| N02 | C20 | C21 | H18 | 8.9° | 60.0° |
| C20 | N02 | C07 | H07 | 10.0° | 35.0° |
| C08 | C09 | C10 | C14 | 179.5° | 179.9° |
| C08 | C09 | C10 | C11 | 179.9° | 180.0° |
| C08 | C09 | C14 | C13 | 179.8° | 179.6° |
| C08 | C09 | C10 | H10 | 0.1° | 0.2° |
| C09 | C08 | C07 | H07 | 45.1° | 55.0° |
| C09 | C08 | H08 | H09 | 118.0° | 120.0° |
| C08 | C09 | C14 | H12 | 0.2° | 0.2° |
| C09 | C10 | C11 | H10 | 180.0° | 179.8° |
| C09 | C10 | C11 | C12 | 0.3° | 0.2° |
| C09 | C10 | C11 | F02 | 179.9° | 179.7° |
| C10 | C09 | C14 | C13 | 0.3° | 0.5° |
| C10 | C09 | C08 | H08 | 142.4° | 30.0° |
| C10 | C09 | C08 | H09 | 23.7° | 150.0° |
| C10 | C09 | C14 | H12 | 179.7° | 179.8° |
| C14 | C09 | C10 | C11 | 0.4° | 0.1° |
| C09 | C14 | C13 | C12 | 0.2° | 0.7° |
| C09 | C14 | C13 | H12 | 180.0° | 179.3° |
| C09 | C14 | C13 | F01 | 179.8° | 180.0° |
| C14 | C09 | C10 | H10 | 179.7° | 179.8° |
| C14 | C09 | C08 | H08 | 38.1° | 150.0° |
| C14 | C09 | C08 | H09 | 156.8° | 30.1° |
| C10 | C11 | C12 | F02 | 179.8° | 179.9° |
| C10 | C11 | C12 | C13 | 0.2° | 0.0° |
| C10 | C11 | C12 | H11 | 179.8° | 180.0° |
| C11 | C12 | C13 | H11 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.1° | 0.5° |
| C11 | C12 | C13 | F01 | 179.9° | 179.8° |
| C12 | C11 | C10 | H10 | 179.7° | 180.0° |
| F02 | C11 | C12 | C13 | 180.0° | 180.0° |
| F02 | C11 | C10 | H10 | 0.1° | 0.1° |
| F02 | C11 | C12 | H11 | 0.0° | 0.1° |
| C12 | C13 | C14 | F01 | 180.0° | 179.3° |
| C12 | C13 | C14 | H12 | 179.8° | 180.0° |
| C14 | C13 | C12 | H11 | 179.9° | 179.5° |
| F01 | C13 | C12 | H11 | 0.1° | 0.2° |
| F01 | C13 | C14 | H12 | 0.2° | 0.7° |
| C15 | C16 | C17 | H14 | 180.0° | 179.9° |
| C15 | C16 | C17 | C18 | 0.2° | 0.4° |
| C15 | C16 | C17 | CL01 | 179.9° | 179.9° |
| C16 | C17 | C18 | CL01 | 179.9° | 179.5° |
| C16 | C17 | C18 | C19 | 0.2° | 0.5° |
| C17 | C16 | C15 | H13 | 180.0° | 180.0° |
| C16 | C17 | C18 | H15 | 179.8° | 179.5° |
| C17 | C18 | C19 | H15 | 180.0° | 180.0° |
| C18 | C17 | C16 | H14 | 179.8° | 179.5° |
| C17 | C18 | C19 | H16 | 180.0° | 179.7° |
| CL01 | C17 | C18 | C19 | 179.9° | 180.0° |
| CL01 | C17 | C16 | H14 | 0.1° | 0.0° |
| CL01 | C17 | C18 | H15 | 0.1° | 0.0° |
| C20 | C21 | C22 | H17 | 120.0° | 120.0° |
| C20 | C21 | C22 | H18 | 120.0° | 120.0° |
| C20 | C21 | C22 | C23 | 82.0° | 95.0° |
| C20 | C21 | C22 | C25 | 97.3° | 84.7° |
| C20 | C21 | H17 | H18 | 120.1° | 120.0° |
| C21 | C20 | N02 | H02 | 1.4° | 0.1° |
| O01 | C20 | C21 | C22 | 51.5° | 0.0° |
| O01 | C20 | C21 | H17 | 68.4° | 120.0° |
| O01 | C20 | C21 | H18 | 171.5° | 120.0° |
| O01 | C20 | N02 | H02 | 178.2° | 180.0° |
| C21 | C22 | C23 | C25 | 179.4° | 179.8° |
| C21 | C22 | C23 | N03 | 179.7° | 180.0° |
| C21 | C22 | C25 | C24 | 179.7° | 180.0° |
| C21 | C22 | C25 | C29 | 0.5° | 0.0° |
| C22 | C21 | H17 | H18 | 120.1° | 120.0° |
| C21 | C22 | C23 | H19 | 0.3° | 0.0° |
| C22 | C23 | N03 | H19 | 180.0° | 180.0° |
| C22 | C23 | N03 | C24 | 0.2° | 0.1° |
| C23 | C22 | C25 | C24 | 0.3° | 0.2° |
| C23 | C22 | C25 | C29 | 179.9° | 179.7° |
| C23 | C22 | C21 | H17 | 158.1° | 145.0° |
| C23 | C22 | C21 | H18 | 38.0° | 25.0° |
| C22 | C23 | N03 | H01 | 179.7° | 180.0° |
| C25 | C22 | C23 | N03 | 0.3° | 0.2° |
| C22 | C25 | C24 | N03 | 0.2° | 0.1° |
| C22 | C25 | C24 | C29 | 179.8° | 180.0° |
| C22 | C25 | C24 | C26 | 179.7° | 180.0° |
| C22 | C25 | C29 | C28 | 179.7° | 180.0° |
| C25 | C22 | C21 | H17 | 22.7° | 35.3° |
| C25 | C22 | C21 | H18 | 142.8° | 155.3° |
| C25 | C22 | C23 | H19 | 179.7° | 179.8° |
| C22 | C25 | C29 | H22 | 0.4° | 0.1° |
| C23 | N03 | C24 | H01 | 180.0° | 179.9° |
| C23 | N03 | C24 | C25 | 0.0° | 0.0° |
| C23 | N03 | C24 | C26 | 179.9° | 179.9° |
| N03 | C24 | C25 | C26 | 179.9° | 179.9° |
| N03 | C24 | C25 | C29 | 180.0° | 179.8° |
| N03 | C24 | C26 | C27 | 179.9° | 179.8° |
| N03 | C24 | C26 | H20 | 0.1° | 0.2° |
| C24 | N03 | C23 | H19 | 179.8° | 179.8° |
| C25 | C24 | C26 | C27 | 0.0° | 0.1° |
| C24 | C25 | C29 | C28 | 0.1° | 0.1° |
| C25 | C24 | C26 | H20 | 180.0° | 180.0° |
| C24 | C25 | C29 | H22 | 179.9° | 180.0° |
| C25 | C24 | N03 | H01 | 180.0° | 179.9° |
| C26 | C24 | C25 | C29 | 0.1° | 0.1° |
| C24 | C26 | C27 | H20 | 180.0° | 180.0° |
| C24 | C26 | C27 | C28 | 0.0° | 0.1° |
| C24 | C26 | C27 | H21 | 179.9° | 180.0° |
| C26 | C24 | N03 | H01 | 0.0° | 0.0° |
| C25 | C29 | C28 | C27 | 0.0° | 0.1° |
| C25 | C29 | C28 | H22 | 180.0° | 179.9° |
| C25 | C29 | C28 | O02 | 179.9° | 180.0° |
| C26 | C27 | C28 | H21 | 180.0° | 179.9° |
| C26 | C27 | C28 | C29 | 0.0° | 0.1° |
| C26 | C27 | C28 | O02 | 180.0° | 180.0° |
| C27 | C28 | C29 | O02 | 179.9° | 179.9° |
| C28 | C27 | C26 | H20 | 179.9° | 179.9° |
| C27 | C28 | C29 | H22 | 179.9° | 180.0° |
| C27 | C28 | O02 | H03 | 180.0° | 90.1° |
| C29 | C28 | C27 | H21 | 179.9° | 180.0° |
| C29 | C28 | O02 | H03 | 0.0° | 90.0° |
| O02 | C28 | C27 | H21 | 0.0° | 0.1° |
| O02 | C28 | C29 | H22 | 0.1° | 0.1° |
| H13 | C15 | C16 | H14 | 0.0° | 0.1° |
| H20 | C26 | C27 | H21 | 0.1° | 0.0° |
| H04 | C01 | C02 | H05 | 0.2° | 0.3° |
| H04 | C01 | C05 | H06 | 0.2° | 0.2° |
| H07 | C07 | C08 | H08 | 165.8° | 175.0° |
| H07 | C07 | C08 | H09 | 75.5° | 65.1° |
| H07 | C07 | N02 | H02 | 170.0° | 145.0° |
| H15 | C18 | C19 | H16 | 0.0° | 0.2° |
| H19 | C23 | N03 | H01 | 0.2° | 0.0° |
