Obsolete: EGG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C2 | sing | 1.43Å | 1.44Å | |
| O1 | C10 | sing | 1.36Å | 1.38Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | C11 | sing | 1.51Å | 1.49Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C3 | O17 | sing | 1.45Å | 1.43Å | |
| C4 | C5 | sing | 1.51Å | 1.51Å | |
| C5 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C5 | C10 | sing | 1.38Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | O18 | sing | 1.36Å | 1.37Å | |
| C7 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | C9 | sing | 1.39Å | 1.40Å | Aromatic |
| C8 | O19 | sing | 1.36Å | 1.36Å | |
| C9 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C12 | C13 | sing | 1.39Å | 1.39Å | Aromatic |
| C13 | C14 | doub | 1.39Å | 1.39Å | Aromatic |
| C13 | O20 | sing | 1.36Å | 1.36Å | |
| C14 | C15 | sing | 1.39Å | 1.39Å | Aromatic |
| C14 | O21 | sing | 1.36Å | 1.36Å | |
| C15 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | O22 | sing | 1.36Å | 1.37Å | |
| O17 | C18 | sing | 1.35Å | 1.46Å | |
| C18 | C19 | sing | 1.47Å | 1.50Å | |
| C18 | O23 | doub | 1.22Å | 1.22Å | |
| C19 | C20 | doub | 1.40Å | 1.38Å | Aromatic |
| C19 | C24 | sing | 1.40Å | 1.40Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.39Å | Aromatic |
| C21 | O24 | sing | 1.36Å | 1.36Å | |
| C22 | C23 | sing | 1.39Å | 1.39Å | Aromatic |
| C22 | O25 | sing | 1.36Å | 1.37Å | |
| C23 | C24 | doub | 1.38Å | 1.41Å | Aromatic |
| C23 | O26 | sing | 1.36Å | 1.35Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å | |
| O19 | HO19 | sing | 0.97Å | 0.95Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| O20 | HO20 | sing | 0.97Å | 0.95Å | |
| O21 | HO21 | sing | 0.97Å | 0.95Å | |
| O22 | HO22 | sing | 0.97Å | 0.95Å | |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| O24 | HO24 | sing | 0.97Å | 0.95Å | |
| O25 | HO25 | sing | 0.97Å | 0.95Å | |
| O26 | HO26 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | O1 | C10 | 121.1° | 117.9° |
| O1 | C2 | C3 | 109.4° | 108.4° |
| O1 | C2 | C11 | 111.1° | 109.7° |
| O1 | C2 | H2 | 108.3° | 109.6° |
| O1 | C10 | C5 | 120.9° | 121.8° |
| O1 | C10 | C9 | 119.3° | 118.4° |
| C3 | C2 | C11 | 109.2° | 109.7° |
| C2 | C3 | C4 | 109.7° | 108.3° |
| C2 | C3 | O17 | 107.2° | 109.7° |
| C3 | C2 | H2 | 110.2° | 109.7° |
| C2 | C3 | H3 | 110.8° | 109.7° |
| C2 | C11 | C12 | 121.2° | 119.9° |
| C2 | C11 | C16 | 119.1° | 119.9° |
| C11 | C2 | H2 | 108.6° | 109.7° |
| C4 | C3 | O17 | 109.4° | 109.7° |
| C3 | C4 | C5 | 109.9° | 109.7° |
| C4 | C3 | H3 | 108.6° | 109.7° |
| C3 | C4 | H4 | 109.3° | 109.5° |
| C3 | C4 | H4A | 109.3° | 109.4° |
| C3 | O17 | C18 | 117.9° | 117.0° |
| O17 | C3 | H3 | 111.1° | 109.7° |
| C4 | C5 | C6 | 119.1° | 118.7° |
| C4 | C5 | C10 | 120.6° | 121.4° |
| C5 | C4 | H4 | 109.3° | 109.4° |
| C5 | C4 | H4A | 109.3° | 109.4° |
| C6 | C5 | C10 | 120.3° | 119.9° |
| C5 | C6 | C7 | 119.8° | 120.3° |
| C5 | C6 | O18 | 120.4° | 119.9° |
| C5 | C10 | C9 | 119.8° | 119.8° |
| C7 | C6 | O18 | 119.9° | 119.8° |
| C6 | C7 | C8 | 120.1° | 119.8° |
| C6 | C7 | H7 | 119.9° | 120.1° |
| C6 | O18 | HO18 | 109.5° | 114.0° |
| C7 | C8 | C9 | 120.1° | 120.0° |
| C7 | C8 | O19 | 119.7° | 120.0° |
| C8 | C7 | H7 | 119.9° | 120.1° |
| C9 | C8 | O19 | 120.3° | 120.0° |
| C8 | C9 | C10 | 119.9° | 120.2° |
| C8 | C9 | H9 | 120.1° | 119.9° |
| C8 | O19 | HO19 | 109.5° | 114.0° |
| C10 | C9 | H9 | 120.0° | 119.8° |
| C12 | C11 | C16 | 119.7° | 120.1° |
| C11 | C12 | C13 | 120.0° | 120.1° |
| C11 | C12 | H12 | 120.0° | 119.9° |
| C11 | C16 | C15 | 120.4° | 120.1° |
| C11 | C16 | H16 | 119.8° | 119.9° |
| C12 | C13 | C14 | 120.1° | 119.9° |
| C12 | C13 | O20 | 119.5° | 120.0° |
| C13 | C12 | H12 | 120.0° | 120.0° |
| C14 | C13 | O20 | 120.4° | 120.0° |
| C13 | C14 | C15 | 120.3° | 119.8° |
| C13 | C14 | O21 | 119.3° | 120.1° |
| C13 | O20 | HO20 | 109.5° | 114.0° |
| C15 | C14 | O21 | 120.5° | 120.1° |
| C14 | C15 | C16 | 119.6° | 119.9° |
| C14 | C15 | O22 | 121.4° | 120.1° |
| C14 | O21 | HO21 | 109.5° | 114.0° |
| C16 | C15 | O22 | 119.0° | 120.1° |
| C15 | C16 | H16 | 119.8° | 120.0° |
| C15 | O22 | HO22 | 109.5° | 114.0° |
| O17 | C18 | C19 | 115.4° | 120.0° |
| O17 | C18 | O23 | 122.6° | 120.0° |
| C19 | C18 | O23 | 122.0° | 120.0° |
| C18 | C19 | C20 | 116.3° | 120.1° |
| C18 | C19 | C24 | 123.0° | 120.0° |
| C20 | C19 | C24 | 120.6° | 119.9° |
| C19 | C20 | C21 | 120.5° | 119.9° |
| C19 | C20 | H20 | 119.8° | 120.0° |
| C19 | C24 | C23 | 118.7° | 119.9° |
| C19 | C24 | H24 | 120.7° | 120.0° |
| C20 | C21 | C22 | 119.9° | 120.1° |
| C20 | C21 | O24 | 119.6° | 119.9° |
| C21 | C20 | H20 | 119.8° | 120.0° |
| C22 | C21 | O24 | 120.6° | 119.9° |
| C21 | C22 | C23 | 120.3° | 120.1° |
| C21 | C22 | O25 | 119.1° | 120.0° |
| C21 | O24 | HO24 | 109.5° | 114.0° |
| C23 | C22 | O25 | 120.7° | 120.0° |
| C22 | C23 | C24 | 120.1° | 120.1° |
| C22 | C23 | O26 | 119.9° | 119.9° |
| C22 | O25 | HO25 | 109.5° | 114.0° |
| C24 | C23 | O26 | 120.0° | 120.0° |
| C23 | C24 | H24 | 120.7° | 120.0° |
| C23 | O26 | HO26 | 109.5° | 114.0° |
| H4 | C4 | H4A | 109.6° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C2 | C3 | C11 | 121.7° | 119.7° |
| O1 | C2 | C3 | H2 | 119.0° | 119.7° |
| O1 | C2 | C11 | H2 | 119.0° | 120.5° |
| O1 | C2 | C3 | C4 | 59.6° | 64.7° |
| O1 | C2 | C3 | O17 | 59.1° | 55.0° |
| C2 | O1 | C10 | C5 | 7.9° | 17.0° |
| C2 | O1 | C10 | C9 | 172.4° | 163.0° |
| O1 | C2 | C11 | C12 | 23.7° | 145.0° |
| O1 | C2 | C11 | C16 | 156.3° | 35.3° |
| O1 | C2 | C3 | H3 | 179.5° | 175.5° |
| C10 | O1 | C2 | C3 | 37.8° | 49.1° |
| C10 | O1 | C2 | C11 | 158.4° | 168.9° |
| O1 | C10 | C5 | C4 | 0.0° | 0.3° |
| O1 | C10 | C5 | C6 | 179.8° | 179.7° |
| O1 | C10 | C5 | C9 | 179.7° | 180.0° |
| O1 | C10 | C9 | C8 | 180.0° | 179.8° |
| C10 | O1 | C2 | H2 | 82.4° | 70.6° |
| O1 | C10 | C9 | H9 | 0.0° | 0.1° |
| C3 | C2 | C11 | H2 | 120.2° | 120.6° |
| C2 | C3 | C4 | O17 | 117.3° | 119.7° |
| C2 | C3 | C4 | H3 | 121.3° | 119.7° |
| C2 | C3 | O17 | H3 | 121.2° | 120.5° |
| C2 | C3 | C4 | C5 | 52.0° | 48.2° |
| C3 | C2 | C11 | C12 | 97.0° | 96.1° |
| C3 | C2 | C11 | C16 | 83.0° | 83.7° |
| C2 | C3 | O17 | C18 | 156.4° | 150.0° |
| C2 | C3 | C4 | H4 | 172.0° | 168.3° |
| C2 | C3 | C4 | H4A | 68.0° | 71.9° |
| C11 | C2 | C3 | C4 | 178.7° | 175.5° |
| C11 | C2 | C3 | O17 | 62.6° | 64.8° |
| C2 | C11 | C12 | C16 | 180.0° | 179.8° |
| C2 | C11 | C12 | C13 | 179.9° | 180.0° |
| C2 | C11 | C16 | C15 | 179.9° | 179.7° |
| C11 | C2 | C3 | H3 | 58.7° | 55.8° |
| C2 | C11 | C12 | H12 | 0.1° | 0.0° |
| C2 | C11 | C16 | H16 | 0.1° | 0.0° |
| C4 | C3 | O17 | H3 | 119.9° | 120.6° |
| C3 | C4 | C5 | H4 | 120.0° | 120.1° |
| C3 | C4 | C5 | H4A | 120.0° | 120.0° |
| C3 | C4 | C5 | C6 | 157.1° | 162.3° |
| C3 | C4 | C5 | C10 | 23.1° | 17.7° |
| C4 | C3 | O17 | C18 | 84.7° | 91.1° |
| C4 | C3 | C2 | H2 | 59.4° | 55.0° |
| C3 | C4 | H4 | H4A | 119.8° | 119.9° |
| O17 | C3 | C4 | C5 | 65.3° | 71.5° |
| C3 | O17 | C18 | C19 | 164.7° | 180.0° |
| C3 | O17 | C18 | O23 | 15.5° | 0.0° |
| O17 | C3 | C2 | H2 | 178.1° | 174.7° |
| O17 | C3 | C4 | H4 | 54.7° | 48.6° |
| O17 | C3 | C4 | H4A | 174.7° | 168.5° |
| C4 | C5 | C6 | C10 | 179.8° | 180.0° |
| C4 | C5 | C6 | C7 | 179.8° | 179.8° |
| C4 | C5 | C6 | O18 | 0.2° | 0.1° |
| C4 | C5 | C10 | C9 | 179.7° | 179.8° |
| C5 | C4 | C3 | H3 | 173.3° | 167.9° |
| C5 | C4 | H4 | H4A | 119.8° | 119.9° |
| C5 | C6 | C7 | O18 | 179.6° | 180.0° |
| C5 | C6 | C7 | C8 | 0.1° | 0.0° |
| C6 | C5 | C10 | C9 | 0.5° | 0.2° |
| C6 | C5 | C4 | H4 | 37.1° | 42.3° |
| C6 | C5 | C4 | H4A | 82.9° | 77.6° |
| C5 | C6 | C7 | H7 | 179.9° | 180.0° |
| C5 | C6 | O18 | HO18 | 180.0° | 90.0° |
| C10 | C5 | C6 | C7 | 0.4° | 0.2° |
| C10 | C5 | C6 | O18 | 179.9° | 179.9° |
| C5 | C10 | C9 | C8 | 0.3° | 0.1° |
| C10 | C5 | C4 | H4 | 143.1° | 137.8° |
| C10 | C5 | C4 | H4A | 96.9° | 102.3° |
| C5 | C10 | C9 | H9 | 179.7° | 179.9° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 0.2° | 0.1° |
| C6 | C7 | C8 | O19 | 179.8° | 180.0° |
| C7 | C6 | O18 | HO18 | 0.4° | 90.0° |
| O18 | C6 | C7 | C8 | 179.7° | 180.0° |
| O18 | C6 | C7 | H7 | 0.3° | 0.1° |
| C7 | C8 | C9 | O19 | 180.0° | 179.9° |
| C7 | C8 | C9 | C10 | 0.1° | 0.0° |
| C7 | C8 | C9 | H9 | 179.9° | 179.9° |
| C7 | C8 | O19 | HO19 | 180.0° | 90.0° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C9 | C8 | C7 | H7 | 179.8° | 179.9° |
| C9 | C8 | O19 | HO19 | 0.1° | 90.1° |
| O19 | C8 | C9 | C10 | 179.9° | 179.9° |
| O19 | C8 | C7 | H7 | 0.2° | 0.1° |
| O19 | C8 | C9 | H9 | 0.1° | 0.0° |
| C11 | C12 | C13 | H12 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.1° | 0.0° |
| C11 | C12 | C13 | O20 | 179.7° | 180.0° |
| C12 | C11 | C16 | C15 | 0.1° | 0.5° |
| C12 | C11 | C2 | H2 | 142.8° | 24.5° |
| C12 | C11 | C16 | H16 | 179.9° | 179.8° |
| C16 | C11 | C12 | C13 | 0.1° | 0.3° |
| C11 | C16 | C15 | C14 | 0.1° | 0.5° |
| C11 | C16 | C15 | H16 | 180.0° | 179.7° |
| C11 | C16 | C15 | O22 | 179.9° | 179.7° |
| C16 | C11 | C2 | H2 | 37.2° | 155.7° |
| C16 | C11 | C12 | H12 | 179.9° | 179.7° |
| C12 | C13 | C14 | O20 | 179.5° | 180.0° |
| C12 | C13 | C14 | C15 | 0.1° | 0.1° |
| C12 | C13 | C14 | O21 | 180.0° | 180.0° |
| C12 | C13 | O20 | HO20 | 180.0° | 90.0° |
| C13 | C14 | C15 | O21 | 179.8° | 179.9° |
| C13 | C14 | C15 | C16 | 0.1° | 0.3° |
| C13 | C14 | C15 | O22 | 179.9° | 180.0° |
| C14 | C13 | C12 | H12 | 179.9° | 180.0° |
| C14 | C13 | O20 | HO20 | 0.5° | 90.0° |
| C13 | C14 | O21 | HO21 | 180.0° | 90.0° |
| O20 | C13 | C14 | C15 | 179.7° | 180.0° |
| O20 | C13 | C14 | O21 | 0.5° | 0.0° |
| O20 | C13 | C12 | H12 | 0.3° | 0.0° |
| C14 | C15 | C16 | O22 | 180.0° | 179.7° |
| C14 | C15 | C16 | H16 | 179.9° | 179.8° |
| C15 | C14 | O21 | HO21 | 0.1° | 90.1° |
| C14 | C15 | O22 | HO22 | 180.0° | 90.0° |
| O21 | C14 | C15 | C16 | 179.9° | 179.8° |
| O21 | C14 | C15 | O22 | 0.1° | 0.0° |
| C16 | C15 | O22 | HO22 | 0.0° | 89.7° |
| O22 | C15 | C16 | H16 | 0.1° | 0.0° |
| O17 | C18 | C19 | O23 | 179.8° | 180.0° |
| O17 | C18 | C19 | C20 | 8.5° | 179.9° |
| O17 | C18 | C19 | C24 | 171.4° | 0.3° |
| C18 | O17 | C3 | H3 | 35.2° | 29.5° |
| C18 | C19 | C20 | C24 | 179.9° | 179.8° |
| C18 | C19 | C20 | C21 | 179.9° | 180.0° |
| C18 | C19 | C24 | C23 | 180.0° | 179.8° |
| C18 | C19 | C20 | H20 | 0.1° | 0.0° |
| C18 | C19 | C24 | H24 | 0.0° | 0.0° |
| O23 | C18 | C19 | C20 | 171.7° | 0.1° |
| O23 | C18 | C19 | C24 | 8.4° | 179.7° |
| C19 | C20 | C21 | H20 | 180.0° | 179.9° |
| C19 | C20 | C21 | C22 | 0.0° | 0.1° |
| C19 | C20 | C21 | O24 | 179.8° | 179.9° |
| C20 | C19 | C24 | C23 | 0.1° | 0.4° |
| C20 | C19 | C24 | H24 | 179.9° | 179.8° |
| C24 | C19 | C20 | C21 | 0.2° | 0.2° |
| C19 | C24 | C23 | C22 | 0.3° | 0.5° |
| C19 | C24 | C23 | H24 | 180.0° | 179.8° |
| C19 | C24 | C23 | O26 | 179.2° | 179.7° |
| C24 | C19 | C20 | H20 | 179.8° | 179.8° |
| C20 | C21 | C22 | O24 | 179.8° | 180.0° |
| C20 | C21 | C22 | C23 | 0.3° | 0.0° |
| C20 | C21 | C22 | O25 | 179.5° | 180.0° |
| C20 | C21 | O24 | HO24 | 180.0° | 90.0° |
| C21 | C22 | C23 | O25 | 179.2° | 180.0° |
| C21 | C22 | C23 | C24 | 0.5° | 0.2° |
| C21 | C22 | C23 | O26 | 179.0° | 179.9° |
| C22 | C21 | C20 | H20 | 180.0° | 180.0° |
| C22 | C21 | O24 | HO24 | 0.2° | 90.0° |
| C21 | C22 | O25 | HO25 | 180.0° | 90.0° |
| O24 | C21 | C22 | C23 | 179.5° | 180.0° |
| O24 | C21 | C22 | O25 | 0.3° | 0.1° |
| O24 | C21 | C20 | H20 | 0.2° | 0.0° |
| C22 | C23 | C24 | O26 | 179.4° | 179.8° |
| C22 | C23 | C24 | H24 | 179.7° | 179.7° |
| C23 | C22 | O25 | HO25 | 0.8° | 90.0° |
| C22 | C23 | O26 | HO26 | 180.0° | 90.0° |
| O25 | C22 | C23 | C24 | 179.6° | 179.8° |
| O25 | C22 | C23 | O26 | 0.2° | 0.0° |
| C24 | C23 | O26 | HO26 | 0.6° | 89.8° |
| O26 | C23 | C24 | H24 | 0.8° | 0.1° |
| H2 | C2 | C3 | H3 | 60.5° | 64.8° |
| H3 | C3 | C4 | H4 | 66.7° | 72.0° |
| H3 | C3 | C4 | H4A | 53.2° | 47.9° |
