A1EMQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O25 | C22 | sing | 1.36Å | 1.43Å | |
| C23 | C22 | doub | 1.39Å | 1.41Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C21 | sing | 1.39Å | 1.43Å | Aromatic |
| C24 | C19 | doub | 1.40Å | 1.45Å | Aromatic |
| C21 | C20 | doub | 1.38Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.40Å | 1.39Å | Aromatic |
| C19 | C17 | sing | 1.48Å | 1.56Å | |
| C16 | C14 | sing | 1.41Å | 1.44Å | |
| C16 | C17 | doub | 1.36Å | 1.51Å | |
| O15 | C14 | doub | 1.22Å | 1.15Å | |
| C14 | C11 | sing | 1.47Å | 1.46Å | |
| C17 | O18 | sing | 1.34Å | 1.49Å | |
| O13 | C12 | sing | 1.36Å | 1.36Å | |
| C11 | C12 | doub | 1.40Å | 1.45Å | Aromatic |
| C11 | C10 | sing | 1.41Å | 1.39Å | Aromatic |
| O18 | C10 | sing | 1.35Å | 1.50Å | |
| C12 | C07 | sing | 1.38Å | 1.42Å | Aromatic |
| C10 | C09 | doub | 1.39Å | 1.41Å | Aromatic |
| O3 | C3 | sing | 1.43Å | 1.48Å | |
| O3A | C3A | sing | 1.43Å | 1.45Å | |
| O2A | C2A | sing | 1.43Å | 1.45Å | |
| C3 | C2 | sing | 1.53Å | 1.49Å | |
| C3 | C4 | sing | 1.53Å | 1.48Å | |
| C2 | O2 | sing | 1.43Å | 1.47Å | |
| C2 | C1 | sing | 1.53Å | 1.56Å | |
| C2A | C3A | sing | 1.53Å | 1.49Å | |
| C2A | C1A | sing | 1.53Å | 1.48Å | |
| C09 | C08 | sing | 1.39Å | 1.43Å | Aromatic |
| C09 | C1 | sing | 1.51Å | 1.52Å | |
| C07 | C08 | doub | 1.39Å | 1.40Å | Aromatic |
| C07 | C1A | sing | 1.51Å | 1.50Å | |
| C3A | C4A | sing | 1.53Å | 1.50Å | |
| C08 | O37 | sing | 1.36Å | 1.38Å | |
| O4A | C4A | sing | 1.43Å | 1.42Å | |
| C1 | O5 | sing | 1.43Å | 1.50Å | |
| C1A | O5A | sing | 1.43Å | 1.51Å | |
| O4 | C4 | sing | 1.43Å | 1.45Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C4A | C5A | sing | 1.53Å | 1.51Å | |
| O5 | C5 | sing | 1.43Å | 1.50Å | |
| O5A | C5A | sing | 1.43Å | 1.49Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C6 | O6 | sing | 1.43Å | 1.46Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C5A | H52A | sing | 1.09Å | 1.10Å | |
| C5A | H51A | sing | 1.09Å | 1.10Å | |
| C4A | H4A | sing | 1.09Å | 1.10Å | |
| C3A | H3A | sing | 1.09Å | 1.10Å | |
| C2A | H2A | sing | 1.09Å | 1.10Å | |
| C1A | H1A | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H281 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H62 | sing | 1.09Å | 1.10Å | |
| C6 | H61 | sing | 1.09Å | 1.10Å | |
| O13 | H131 | sing | 0.97Å | 0.95Å | |
| O25 | H251 | sing | 0.97Å | 0.95Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| O37 | H371 | sing | 0.97Å | 0.95Å | |
| O2A | HO2A | sing | 0.97Å | 0.95Å | |
| O3A | HO3A | sing | 0.97Å | 0.95Å | |
| O4A | HO4A | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O25 | C22 | C23 | 120.9° | 119.9° |
| O25 | C22 | C21 | 118.7° | 119.9° |
| C22 | O25 | H251 | 109.5° | 114.0° |
| C22 | C23 | C24 | 120.2° | 120.1° |
| C23 | C22 | C21 | 120.4° | 120.2° |
| C22 | C23 | H231 | 119.9° | 120.0° |
| C23 | C24 | C19 | 118.9° | 119.9° |
| C24 | C23 | H231 | 119.9° | 120.0° |
| C23 | C24 | H241 | 120.5° | 120.0° |
| C22 | C21 | C20 | 119.5° | 120.1° |
| C22 | C21 | H211 | 120.3° | 120.0° |
| C24 | C19 | C20 | 120.9° | 119.8° |
| C24 | C19 | C17 | 123.0° | 120.1° |
| C19 | C24 | H241 | 120.5° | 120.0° |
| C21 | C20 | C19 | 120.1° | 119.9° |
| C21 | C20 | H201 | 120.0° | 120.1° |
| C20 | C21 | H211 | 120.2° | 119.9° |
| C20 | C19 | C17 | 116.0° | 120.1° |
| C19 | C20 | H201 | 119.9° | 120.0° |
| C19 | C17 | C16 | 127.6° | 118.7° |
| C19 | C17 | O18 | 111.7° | 118.8° |
| C14 | C16 | C17 | 118.4° | 119.5° |
| C16 | C14 | O15 | 120.4° | 121.3° |
| C16 | C14 | C11 | 120.5° | 117.4° |
| C14 | C16 | H161 | 120.8° | 120.2° |
| C16 | C17 | O18 | 120.7° | 122.5° |
| C17 | C16 | H161 | 120.8° | 120.2° |
| O15 | C14 | C11 | 119.1° | 121.3° |
| C14 | C11 | C12 | 120.4° | 121.3° |
| C14 | C11 | C10 | 120.9° | 118.4° |
| C17 | O18 | C10 | 115.1° | 122.3° |
| O13 | C12 | C11 | 118.8° | 120.3° |
| O13 | C12 | C07 | 122.1° | 120.2° |
| C12 | O13 | H131 | 109.5° | 114.0° |
| C12 | C11 | C10 | 118.7° | 120.3° |
| C11 | C12 | C07 | 119.1° | 119.5° |
| C11 | C10 | O18 | 123.4° | 119.8° |
| C11 | C10 | C09 | 122.7° | 119.4° |
| O18 | C10 | C09 | 113.9° | 120.8° |
| C12 | C07 | C08 | 120.8° | 120.1° |
| C12 | C07 | C1A | 123.7° | 119.9° |
| C10 | C09 | C08 | 118.2° | 120.0° |
| C10 | C09 | C1 | 120.4° | 119.9° |
| O3 | C3 | C2 | 101.9° | 109.6° |
| O3 | C3 | C4 | 118.6° | 109.5° |
| O3 | C3 | H281 | 110.0° | 109.6° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| O3A | C3A | C2A | 111.2° | 109.5° |
| O3A | C3A | C4A | 101.8° | 109.6° |
| O3A | C3A | H3A | 108.2° | 109.6° |
| C3A | O3A | HO3A | 109.5° | 114.0° |
| O2A | C2A | C3A | 104.7° | 109.5° |
| O2A | C2A | C1A | 99.4° | 109.5° |
| O2A | C2A | H2A | 113.9° | 109.5° |
| C2A | O2A | HO2A | 109.5° | 114.0° |
| C2 | C3 | C4 | 106.0° | 109.0° |
| C3 | C2 | O2 | 113.4° | 109.5° |
| C3 | C2 | C1 | 110.3° | 109.2° |
| C3 | C2 | H2 | 110.4° | 109.6° |
| C2 | C3 | H281 | 109.8° | 109.6° |
| C3 | C4 | O4 | 105.5° | 109.5° |
| C3 | C4 | C5 | 107.1° | 109.2° |
| C4 | C3 | H281 | 109.9° | 109.5° |
| C3 | C4 | H4 | 107.9° | 109.5° |
| O2 | C2 | C1 | 102.4° | 109.5° |
| O2 | C2 | H2 | 110.6° | 109.5° |
| C2 | O2 | HO2 | 109.5° | 113.9° |
| C2 | C1 | C09 | 120.9° | 109.5° |
| C2 | C1 | O5 | 106.5° | 109.4° |
| C2 | C1 | H12 | 104.5° | 109.5° |
| C1 | C2 | H2 | 109.4° | 109.5° |
| C3A | C2A | C1A | 111.2° | 109.2° |
| C2A | C3A | C4A | 119.7° | 109.0° |
| C2A | C3A | H3A | 107.8° | 109.5° |
| C3A | C2A | H2A | 113.3° | 109.5° |
| C2A | C1A | C07 | 113.2° | 109.5° |
| C2A | C1A | O5A | 116.6° | 109.4° |
| C1A | C2A | H2A | 113.3° | 109.5° |
| C2A | C1A | H1A | 107.8° | 109.5° |
| C08 | C09 | C1 | 121.0° | 120.0° |
| C09 | C08 | C07 | 120.3° | 120.7° |
| C09 | C08 | O37 | 120.1° | 119.7° |
| C09 | C1 | O5 | 113.4° | 109.4° |
| C09 | C1 | H12 | 105.0° | 109.5° |
| C08 | C07 | C1A | 115.3° | 119.9° |
| C07 | C08 | O37 | 119.6° | 119.7° |
| C07 | C1A | O5A | 103.8° | 109.5° |
| C07 | C1A | H1A | 107.6° | 109.5° |
| C3A | C4A | O4A | 113.1° | 109.6° |
| C3A | C4A | C5A | 111.8° | 109.1° |
| C3A | C4A | H4A | 107.5° | 109.5° |
| C4A | C3A | H3A | 107.6° | 109.6° |
| C08 | O37 | H371 | 109.5° | 114.0° |
| O4A | C4A | C5A | 108.2° | 109.5° |
| O4A | C4A | H4A | 108.6° | 109.6° |
| C4A | O4A | HO4A | 109.5° | 114.0° |
| C1 | O5 | C5 | 109.2° | 114.1° |
| O5 | C1 | H12 | 105.1° | 109.5° |
| C1A | O5A | C5A | 116.1° | 114.1° |
| O5A | C1A | H1A | 107.4° | 109.5° |
| O4 | C4 | C5 | 120.3° | 109.5° |
| O4 | C4 | H4 | 108.2° | 109.6° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| C4 | C5 | O5 | 112.0° | 109.4° |
| C4 | C5 | C6 | 99.4° | 109.5° |
| C5 | C4 | H4 | 107.2° | 109.5° |
| C4 | C5 | H5 | 108.0° | 109.5° |
| C4A | C5A | O5A | 109.7° | 109.4° |
| C4A | C5A | H52A | 109.4° | 109.5° |
| C4A | C5A | H51A | 109.4° | 109.5° |
| C5A | C4A | H4A | 107.5° | 109.5° |
| O5 | C5 | C6 | 120.1° | 109.5° |
| O5 | C5 | H5 | 108.4° | 109.5° |
| O5A | C5A | H52A | 109.4° | 109.5° |
| O5A | C5A | H51A | 109.4° | 109.4° |
| C5 | C6 | O6 | 107.5° | 109.5° |
| C6 | C5 | H5 | 108.1° | 109.5° |
| C5 | C6 | H62 | 109.9° | 109.5° |
| C5 | C6 | H61 | 110.0° | 109.5° |
| O6 | C6 | H62 | 110.0° | 109.5° |
| O6 | C6 | H61 | 109.9° | 109.5° |
| C6 | O6 | HO6 | 109.5° | 114.0° |
| H52A | C5A | H51A | 109.5° | 109.5° |
| H62 | C6 | H61 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O25 | C22 | C23 | C21 | 180.0° | 179.9° |
| O25 | C22 | C23 | C24 | 179.9° | 180.0° |
| O25 | C22 | C21 | C20 | 180.0° | 179.9° |
| O25 | C22 | C21 | H211 | 0.0° | 0.0° |
| O25 | C22 | C23 | H231 | 0.1° | 0.1° |
| C22 | C23 | C24 | H231 | 180.0° | 180.0° |
| C22 | C23 | C24 | C19 | 0.3° | 0.3° |
| C23 | C22 | C21 | C20 | 0.0° | 0.0° |
| C23 | C22 | C21 | H211 | 179.9° | 180.0° |
| C22 | C23 | C24 | H241 | 179.7° | 179.9° |
| C23 | C22 | O25 | H251 | 180.0° | 90.0° |
| C24 | C23 | C22 | C21 | 0.1° | 0.0° |
| C23 | C24 | C19 | H241 | 180.0° | 179.8° |
| C23 | C24 | C19 | C20 | 0.8° | 0.5° |
| C23 | C24 | C19 | C17 | 179.3° | 180.0° |
| C22 | C21 | C20 | H211 | 180.0° | 180.0° |
| C22 | C21 | C20 | C19 | 0.5° | 0.3° |
| C22 | C21 | C20 | H201 | 179.5° | 180.0° |
| C21 | C22 | C23 | H231 | 180.0° | 180.0° |
| C21 | C22 | O25 | H251 | 0.0° | 90.0° |
| C24 | C19 | C20 | C21 | 0.9° | 0.5° |
| C24 | C19 | C20 | C17 | 178.6° | 179.4° |
| C24 | C19 | C17 | C16 | 29.5° | 179.7° |
| C24 | C19 | C17 | O18 | 150.9° | 0.0° |
| C24 | C19 | C20 | H201 | 179.1° | 179.7° |
| C19 | C24 | C23 | H231 | 179.7° | 179.7° |
| C21 | C20 | C19 | H201 | 180.0° | 179.7° |
| C21 | C20 | C19 | C17 | 179.5° | 180.0° |
| C20 | C19 | C17 | C16 | 151.9° | 0.8° |
| C20 | C19 | C17 | O18 | 27.7° | 179.5° |
| C19 | C20 | C21 | H211 | 179.5° | 179.7° |
| C20 | C19 | C24 | H241 | 179.2° | 179.7° |
| C19 | C17 | C16 | C14 | 167.0° | 180.0° |
| C19 | C17 | C16 | O18 | 179.5° | 179.7° |
| C19 | C17 | O18 | C10 | 168.9° | 180.0° |
| C19 | C17 | C16 | H161 | 13.0° | 0.0° |
| C17 | C19 | C20 | H201 | 0.5° | 0.3° |
| C17 | C19 | C24 | H241 | 0.7° | 0.2° |
| C14 | C16 | C17 | H161 | 180.0° | 180.0° |
| C16 | C14 | O15 | C11 | 179.1° | 179.9° |
| C14 | C16 | C17 | O18 | 12.5° | 0.4° |
| C16 | C14 | C11 | C12 | 178.1° | 180.0° |
| C16 | C14 | C11 | C10 | 2.4° | 0.2° |
| C17 | C16 | C14 | O15 | 171.1° | 180.0° |
| C17 | C16 | C14 | C11 | 8.0° | 0.1° |
| C16 | C17 | O18 | C10 | 10.7° | 0.3° |
| O15 | C14 | C11 | C12 | 2.8° | 0.0° |
| O15 | C14 | C11 | C10 | 176.8° | 179.8° |
| O15 | C14 | C16 | H161 | 8.9° | 0.0° |
| C14 | C11 | C12 | O13 | 0.3° | 0.0° |
| C14 | C11 | C12 | C10 | 179.5° | 179.8° |
| C14 | C11 | C10 | O18 | 0.9° | 0.2° |
| C14 | C11 | C12 | C07 | 179.0° | 179.8° |
| C14 | C11 | C10 | C09 | 177.5° | 179.7° |
| C11 | C14 | C16 | H161 | 172.0° | 179.9° |
| C17 | O18 | C10 | C11 | 5.0° | 0.1° |
| C17 | O18 | C10 | C09 | 173.4° | 180.0° |
| O18 | C17 | C16 | H161 | 167.5° | 179.7° |
| O13 | C12 | C11 | C07 | 179.3° | 179.7° |
| O13 | C12 | C11 | C10 | 179.8° | 179.8° |
| O13 | C12 | C07 | C08 | 179.1° | 179.7° |
| O13 | C12 | C07 | C1A | 3.4° | 0.3° |
| C12 | C11 | C10 | O18 | 179.6° | 180.0° |
| C12 | C11 | C10 | C09 | 2.1° | 0.1° |
| C11 | C12 | C07 | C08 | 1.6° | 0.0° |
| C11 | C12 | C07 | C1A | 177.4° | 180.0° |
| C11 | C12 | O13 | H131 | 1.4° | 89.9° |
| C11 | C10 | O18 | C09 | 178.5° | 179.9° |
| C10 | C11 | C12 | C07 | 0.5° | 0.0° |
| C11 | C10 | C09 | C08 | 4.5° | 0.0° |
| C11 | C10 | C09 | C1 | 177.5° | 179.9° |
| O18 | C10 | C09 | C08 | 177.1° | 180.0° |
| O18 | C10 | C09 | C1 | 4.1° | 0.0° |
| C12 | C07 | C1A | C2A | 44.9° | 75.0° |
| C12 | C07 | C08 | C09 | 4.1° | 0.0° |
| C12 | C07 | C08 | C1A | 176.1° | 180.0° |
| C12 | C07 | C08 | O37 | 179.7° | 180.0° |
| C12 | C07 | C1A | O5A | 82.4° | 45.0° |
| C12 | C07 | C1A | H1A | 163.9° | 165.0° |
| C07 | C12 | O13 | H131 | 177.9° | 90.4° |
| C10 | C09 | C1 | C2 | 36.4° | 105.1° |
| C10 | C09 | C08 | C1 | 173.0° | 180.0° |
| C10 | C09 | C08 | C07 | 5.4° | 0.0° |
| C10 | C09 | C08 | O37 | 178.4° | 180.0° |
| C10 | C09 | C1 | O5 | 164.6° | 135.0° |
| C10 | C09 | C1 | H12 | 81.2° | 15.0° |
| O3 | C3 | C2 | C4 | 124.7° | 119.9° |
| O3 | C3 | C2 | H281 | 116.6° | 120.3° |
| O3 | C3 | C4 | H281 | 127.7° | 120.3° |
| O3 | C3 | C2 | O2 | 164.4° | 63.3° |
| O3 | C3 | C2 | C1 | 50.2° | 176.9° |
| O3 | C3 | C4 | O4 | 171.8° | 63.3° |
| O3 | C3 | C4 | C5 | 58.8° | 176.9° |
| O3 | C3 | C2 | H2 | 70.9° | 56.9° |
| O3 | C3 | C4 | H4 | 56.3° | 56.9° |
| O3A | C3A | C2A | O2A | 95.0° | 63.2° |
| O3A | C3A | C2A | C4A | 118.2° | 119.9° |
| O3A | C3A | C2A | H3A | 118.5° | 120.2° |
| O3A | C3A | C2A | C1A | 158.6° | 176.8° |
| O3A | C3A | C4A | H3A | 113.6° | 120.3° |
| O3A | C3A | C4A | O4A | 49.2° | 56.9° |
| O3A | C3A | C4A | C5A | 171.6° | 176.8° |
| O3A | C3A | C4A | H4A | 70.7° | 63.3° |
| O3A | C3A | C2A | H2A | 29.7° | 57.0° |
| O2A | C2A | C3A | C1A | 106.4° | 119.9° |
| O2A | C2A | C3A | H2A | 124.7° | 120.2° |
| O2A | C2A | C1A | H2A | 121.2° | 120.1° |
| O2A | C2A | C1A | C07 | 92.7° | 62.5° |
| O2A | C2A | C3A | C4A | 146.7° | 176.9° |
| O2A | C2A | C1A | O5A | 147.0° | 177.5° |
| O2A | C2A | C3A | H3A | 23.4° | 57.0° |
| O2A | C2A | C1A | H1A | 26.2° | 57.5° |
| C2 | C3 | C4 | H281 | 118.6° | 119.9° |
| C3 | C2 | O2 | C1 | 118.9° | 119.7° |
| C3 | C2 | O2 | H2 | 124.6° | 120.2° |
| C3 | C2 | C1 | H2 | 121.7° | 120.0° |
| C3 | C2 | C1 | C09 | 112.0° | 177.6° |
| C3 | C2 | C1 | O5 | 19.3° | 57.6° |
| C2 | C3 | C4 | O4 | 74.6° | 176.9° |
| C2 | C3 | C4 | C5 | 54.8° | 57.0° |
| C3 | C2 | C1 | H12 | 130.2° | 62.4° |
| C2 | C3 | C4 | H4 | 169.9° | 62.9° |
| C2 | C3 | O3 | HO3 | 180.0° | 180.0° |
| C3 | C2 | O2 | HO2 | 180.0° | 60.3° |
| C4 | C3 | C2 | O2 | 39.7° | 176.9° |
| C4 | C3 | C2 | C1 | 74.5° | 57.0° |
| C3 | C4 | O4 | C5 | 121.1° | 119.7° |
| C3 | C4 | O4 | H4 | 115.3° | 120.2° |
| C3 | C4 | C5 | H4 | 115.6° | 119.9° |
| C3 | C4 | C5 | O5 | 11.2° | 57.6° |
| C3 | C4 | C5 | C6 | 139.2° | 177.6° |
| C4 | C3 | C2 | H2 | 164.4° | 63.0° |
| C3 | C4 | C5 | H5 | 108.2° | 62.4° |
| C3 | C4 | O4 | HO4 | 180.0° | 60.1° |
| C4 | C3 | O3 | HO3 | 64.2° | 60.4° |
| O2 | C2 | C1 | H2 | 117.4° | 120.1° |
| O2 | C2 | C1 | C09 | 127.0° | 62.5° |
| O2 | C2 | C1 | O5 | 101.7° | 177.5° |
| O2 | C2 | C1 | H12 | 9.2° | 57.6° |
| O2 | C2 | C3 | H281 | 79.0° | 57.0° |
| C2 | C1 | C09 | C08 | 150.8° | 74.9° |
| C2 | C1 | C09 | O5 | 128.3° | 119.9° |
| C2 | C1 | C09 | H12 | 117.6° | 120.1° |
| C2 | C1 | O5 | H12 | 110.5° | 120.0° |
| C2 | C1 | O5 | C5 | 46.4° | 61.2° |
| C1 | C2 | C3 | H281 | 166.8° | 62.8° |
| C1 | C2 | O2 | HO2 | 61.1° | 180.0° |
| C3A | C2A | C1A | H2A | 128.9° | 119.9° |
| C3A | C2A | C1A | C07 | 157.4° | 177.6° |
| C2A | C3A | C4A | H3A | 123.4° | 119.9° |
| C2A | C3A | C4A | O4A | 73.8° | 62.9° |
| C3A | C2A | C1A | O5A | 37.1° | 57.6° |
| C2A | C3A | C4A | C5A | 48.6° | 57.0° |
| C2A | C3A | C4A | H4A | 166.3° | 176.9° |
| C3A | C2A | C1A | H1A | 83.7° | 62.4° |
| C3A | C2A | O2A | HO2A | 180.0° | 60.0° |
| C2A | C3A | O3A | HO3A | 180.0° | 180.0° |
| C2A | C1A | C07 | C08 | 139.1° | 105.0° |
| C2A | C1A | C07 | O5A | 127.3° | 120.0° |
| C2A | C1A | C07 | H1A | 119.0° | 120.0° |
| C1A | C2A | C3A | C4A | 40.3° | 57.0° |
| C2A | C1A | O5A | H1A | 121.0° | 120.0° |
| C2A | C1A | O5A | C5A | 45.8° | 61.1° |
| C1A | C2A | C3A | H3A | 83.0° | 62.9° |
| C1A | C2A | O2A | HO2A | 65.0° | 179.7° |
| C09 | C08 | C07 | O37 | 176.2° | 180.0° |
| C09 | C08 | C07 | C1A | 179.8° | 180.0° |
| C08 | C09 | C1 | O5 | 22.6° | 45.0° |
| C08 | C09 | C1 | H12 | 91.6° | 165.0° |
| C09 | C08 | O37 | H371 | 180.0° | 90.0° |
| C1 | C09 | C08 | C07 | 178.4° | 180.0° |
| C1 | C09 | C08 | O37 | 5.5° | 0.0° |
| C09 | C1 | O5 | H12 | 114.1° | 120.0° |
| C09 | C1 | O5 | C5 | 178.3° | 178.8° |
| C09 | C1 | C2 | H2 | 9.6° | 57.6° |
| C08 | C07 | C1A | O5A | 93.5° | 135.0° |
| C08 | C07 | C1A | H1A | 20.1° | 15.0° |
| C07 | C08 | O37 | H371 | 3.8° | 90.0° |
| C1A | C07 | C08 | O37 | 3.6° | 0.0° |
| C07 | C1A | O5A | H1A | 113.8° | 120.0° |
| C07 | C1A | O5A | C5A | 171.0° | 178.9° |
| C07 | C1A | C2A | H2A | 28.5° | 57.7° |
| C3A | C4A | O4A | C5A | 124.5° | 119.7° |
| C3A | C4A | O4A | H4A | 119.2° | 120.2° |
| C3A | C4A | C5A | H4A | 117.7° | 119.9° |
| C3A | C4A | C5A | O5A | 50.6° | 57.6° |
| C3A | C4A | C5A | H52A | 69.4° | 177.6° |
| C3A | C4A | C5A | H51A | 170.7° | 62.4° |
| C4A | C3A | C2A | H2A | 88.6° | 62.9° |
| C4A | C3A | O3A | HO3A | 51.4° | 60.4° |
| C3A | C4A | O4A | HO4A | 180.0° | 180.0° |
| O4A | C4A | C5A | H4A | 117.1° | 120.2° |
| O4A | C4A | C5A | O5A | 74.5° | 62.3° |
| O4A | C4A | C5A | H52A | 165.5° | 57.7° |
| O4A | C4A | C5A | H51A | 45.5° | 177.7° |
| O4A | C4A | C3A | H3A | 162.8° | 177.2° |
| C1 | O5 | C5 | C4 | 65.9° | 61.2° |
| C1 | O5 | C5 | C6 | 178.0° | 178.9° |
| O5 | C1 | C2 | H2 | 140.9° | 62.4° |
| C1 | O5 | C5 | H5 | 53.1° | 58.8° |
| C1A | O5A | C5A | C4A | 51.0° | 61.1° |
| C1A | O5A | C5A | H52A | 69.0° | 178.9° |
| C1A | O5A | C5A | H51A | 171.1° | 58.9° |
| O5A | C1A | C2A | H2A | 91.8° | 62.3° |
| O4 | C4 | C5 | H4 | 124.1° | 120.2° |
| O4 | C4 | C5 | O5 | 131.5° | 177.5° |
| O4 | C4 | C5 | C6 | 100.4° | 62.5° |
| O4 | C4 | C3 | H281 | 44.1° | 57.0° |
| O4 | C4 | C5 | H5 | 12.2° | 57.5° |
| C4 | C5 | O5 | C6 | 116.1° | 120.0° |
| C4 | C5 | O5 | H5 | 119.1° | 120.0° |
| C4 | C5 | C6 | H5 | 112.5° | 120.0° |
| C4 | C5 | C6 | O6 | 86.1° | 175.0° |
| C5 | C4 | C3 | H281 | 173.4° | 62.9° |
| C4 | C5 | C6 | H62 | 33.6° | 65.0° |
| C4 | C5 | C6 | H61 | 154.2° | 55.0° |
| C5 | C4 | O4 | HO4 | 58.8° | 179.7° |
| C4A | C5A | O5A | H52A | 120.0° | 120.0° |
| C4A | C5A | O5A | H51A | 120.0° | 120.0° |
| C4A | C5A | H52A | H51A | 119.9° | 120.0° |
| C5A | C4A | C3A | H3A | 74.8° | 62.9° |
| C5A | C4A | O4A | HO4A | 55.5° | 60.3° |
| O5 | C5 | C6 | H5 | 125.0° | 120.0° |
| O5 | C5 | C6 | O6 | 151.5° | 65.1° |
| C5 | O5 | C1 | H12 | 64.1° | 58.9° |
| O5 | C5 | C4 | H4 | 104.4° | 62.3° |
| O5 | C5 | C6 | H62 | 88.8° | 54.9° |
| O5 | C5 | C6 | H61 | 31.8° | 174.9° |
| O5A | C5A | H52A | H51A | 119.9° | 120.0° |
| O5A | C5A | C4A | H4A | 168.4° | 177.5° |
| C5A | O5A | C1A | H1A | 75.2° | 58.9° |
| C5 | C6 | O6 | H62 | 119.7° | 120.0° |
| C5 | C6 | O6 | H61 | 119.7° | 120.0° |
| C6 | C5 | C4 | H4 | 23.7° | 57.7° |
| C5 | C6 | H62 | H61 | 120.9° | 120.0° |
| C5 | C6 | O6 | HO6 | 180.0° | 180.0° |
| O6 | C6 | C5 | H5 | 26.5° | 55.0° |
| O6 | C6 | H62 | H61 | 120.9° | 120.0° |
| H201 | C20 | C21 | H211 | 0.5° | 0.0° |
| H231 | C23 | C24 | H241 | 0.3° | 0.0° |
| H52A | C5A | C4A | H4A | 48.4° | 62.5° |
| H51A | C5A | C4A | H4A | 71.6° | 57.5° |
| H4A | C4A | C3A | H3A | 43.0° | 57.0° |
| H4A | C4A | O4A | HO4A | 60.8° | 59.9° |
| H3A | C3A | C2A | H2A | 148.1° | 177.2° |
| H3A | C3A | O3A | HO3A | 61.8° | 59.8° |
| H2A | C2A | C1A | H1A | 147.4° | 177.7° |
| H2A | C2A | O2A | HO2A | 55.7° | 60.2° |
| H12 | C1 | C2 | H2 | 108.1° | 177.6° |
| H2 | C2 | C3 | H281 | 45.7° | 177.2° |
| H2 | C2 | O2 | HO2 | 55.4° | 59.9° |
| H281 | C3 | C4 | H4 | 71.4° | 177.2° |
| H281 | C3 | O3 | HO3 | 63.5° | 59.8° |
| H4 | C4 | C5 | H5 | 136.3° | 177.7° |
| H4 | C4 | O4 | HO4 | 64.7° | 60.1° |
| H5 | C5 | C6 | H62 | 146.2° | 175.0° |
| H5 | C5 | C6 | H61 | 93.2° | 65.0° |
| H62 | C6 | O6 | HO6 | 60.3° | 60.0° |
| H61 | C6 | O6 | HO6 | 60.3° | 59.9° |
