DO6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C12 | O11 | sing | 1.43Å | 1.44Å | |
| O11 | C6 | sing | 1.36Å | 1.37Å | |
| C9 | O7 | sing | 1.43Å | 1.43Å | |
| O7 | C1 | sing | 1.36Å | 1.37Å | |
| C6 | C1 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C1 | C2 | sing | 1.39Å | 1.40Å | Aromatic |
| C5 | C4 | doub | 1.40Å | 1.39Å | Aromatic |
| C2 | O8 | sing | 1.36Å | 1.36Å | |
| C2 | C3 | doub | 1.38Å | 1.37Å | Aromatic |
| C4 | C3 | sing | 1.40Å | 1.39Å | Aromatic |
| C4 | C13 | sing | 1.48Å | 1.48Å | |
| O8 | C10 | sing | 1.43Å | 1.43Å | |
| O14 | C13 | doub | 1.22Å | 1.23Å | |
| C13 | C15 | sing | 1.47Å | 1.51Å | |
| C15 | C16 | sing | 1.48Å | 1.46Å | Aromatic |
| C15 | C19 | doub | 1.36Å | 1.36Å | Aromatic |
| C20 | C16 | doub | 1.39Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
| C16 | C17 | sing | 1.40Å | 1.39Å | Aromatic |
| C27 | C19 | sing | 1.51Å | 1.48Å | |
| C19 | O18 | sing | 1.34Å | 1.37Å | Aromatic |
| C21 | C22 | doub | 1.39Å | 1.39Å | Aromatic |
| C17 | O18 | sing | 1.35Å | 1.38Å | Aromatic |
| C17 | C23 | doub | 1.39Å | 1.38Å | Aromatic |
| C22 | C23 | sing | 1.39Å | 1.40Å | Aromatic |
| C22 | O24 | sing | 1.36Å | 1.37Å | |
| C23 | O26 | sing | 1.36Å | 1.35Å | |
| C25 | O24 | sing | 1.43Å | 1.42Å | |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C10 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.08Å | 1.08Å | |
| C21 | H13 | sing | 1.08Å | 1.08Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C25 | H15 | sing | 1.09Å | 1.10Å | |
| C25 | H16 | sing | 1.09Å | 1.10Å | |
| O26 | H17 | sing | 0.97Å | 0.95Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.09Å | 1.10Å | |
| C27 | H20 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | O11 | C6 | 117.9° | 117.0° |
| O11 | C12 | H3 | 109.5° | 109.4° |
| O11 | C12 | H4 | 109.4° | 109.5° |
| O11 | C12 | H5 | 109.5° | 109.5° |
| O11 | C6 | C1 | 115.3° | 119.9° |
| O11 | C6 | C5 | 124.7° | 120.0° |
| C9 | O7 | C1 | 113.5° | 117.0° |
| O7 | C9 | H6 | 109.5° | 109.5° |
| O7 | C9 | H7 | 109.5° | 109.5° |
| O7 | C9 | H8 | 109.5° | 109.5° |
| O7 | C1 | C6 | 119.1° | 119.9° |
| O7 | C1 | C2 | 120.6° | 120.0° |
| C1 | C6 | C5 | 120.0° | 120.1° |
| C6 | C1 | C2 | 119.8° | 120.1° |
| C6 | C5 | C4 | 119.9° | 119.9° |
| C6 | C5 | H2 | 120.1° | 120.1° |
| C1 | C2 | O8 | 116.5° | 120.0° |
| C1 | C2 | C3 | 120.2° | 120.1° |
| C5 | C4 | C3 | 120.4° | 119.9° |
| C5 | C4 | C13 | 118.4° | 120.1° |
| C4 | C5 | H2 | 120.1° | 120.0° |
| O8 | C2 | C3 | 123.3° | 120.0° |
| C2 | O8 | C10 | 117.0° | 117.0° |
| C2 | C3 | C4 | 119.7° | 119.9° |
| C2 | C3 | H1 | 120.2° | 120.1° |
| C3 | C4 | C13 | 121.2° | 120.0° |
| C4 | C3 | H1 | 120.2° | 120.0° |
| C4 | C13 | O14 | 117.7° | 120.0° |
| C4 | C13 | C15 | 121.0° | 119.9° |
| O8 | C10 | H9 | 109.5° | 109.5° |
| O8 | C10 | H10 | 109.5° | 109.5° |
| O8 | C10 | H11 | 109.5° | 109.4° |
| O14 | C13 | C15 | 121.3° | 120.0° |
| C13 | C15 | C16 | 128.7° | 127.1° |
| C13 | C15 | C19 | 124.9° | 127.2° |
| C16 | C15 | C19 | 106.3° | 105.7° |
| C15 | C16 | C20 | 136.3° | 134.2° |
| C15 | C16 | C17 | 105.3° | 105.4° |
| C15 | C19 | C27 | 134.0° | 125.1° |
| C15 | C19 | O18 | 110.9° | 109.8° |
| C16 | C20 | C21 | 120.6° | 119.8° |
| C20 | C16 | C17 | 118.3° | 120.4° |
| C16 | C20 | H12 | 119.7° | 120.1° |
| C20 | C21 | C22 | 120.0° | 120.2° |
| C21 | C20 | H12 | 119.7° | 120.1° |
| C20 | C21 | H13 | 120.0° | 119.9° |
| C16 | C17 | O18 | 110.4° | 107.7° |
| C16 | C17 | C23 | 122.1° | 119.3° |
| C27 | C19 | O18 | 115.1° | 125.1° |
| C19 | C27 | H18 | 109.5° | 109.5° |
| C19 | C27 | H19 | 109.5° | 109.5° |
| C19 | C27 | H20 | 109.4° | 109.5° |
| C19 | O18 | C17 | 107.1° | 111.4° |
| C21 | C22 | C23 | 119.8° | 120.5° |
| C21 | C22 | O24 | 125.5° | 119.7° |
| C22 | C21 | H13 | 120.0° | 119.9° |
| O18 | C17 | C23 | 127.4° | 133.1° |
| C17 | C23 | C22 | 119.1° | 119.8° |
| C17 | C23 | O26 | 121.1° | 120.1° |
| C23 | C22 | O24 | 114.7° | 119.8° |
| C22 | C23 | O26 | 119.7° | 120.1° |
| C22 | O24 | C25 | 117.2° | 117.0° |
| C23 | O26 | H17 | 109.5° | 114.0° |
| O24 | C25 | H14 | 109.5° | 109.5° |
| O24 | C25 | H15 | 109.4° | 109.5° |
| O24 | C25 | H16 | 109.5° | 109.5° |
| H3 | C12 | H4 | 109.4° | 109.5° |
| H3 | C12 | H5 | 109.5° | 109.4° |
| H4 | C12 | H5 | 109.5° | 109.5° |
| H6 | C9 | H7 | 109.5° | 109.5° |
| H6 | C9 | H8 | 109.5° | 109.4° |
| H7 | C9 | H8 | 109.4° | 109.5° |
| H9 | C10 | H10 | 109.5° | 109.5° |
| H9 | C10 | H11 | 109.5° | 109.5° |
| H10 | C10 | H11 | 109.5° | 109.5° |
| H14 | C25 | H15 | 109.5° | 109.5° |
| H14 | C25 | H16 | 109.5° | 109.4° |
| H15 | C25 | H16 | 109.5° | 109.5° |
| H18 | C27 | H19 | 109.4° | 109.4° |
| H18 | C27 | H20 | 109.5° | 109.5° |
| H19 | C27 | H20 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | O11 | C6 | C1 | 172.2° | 177.7° |
| C12 | O11 | C6 | C5 | 6.3° | 2.5° |
| O11 | C12 | H3 | H4 | 120.0° | 120.0° |
| O11 | C12 | H3 | H5 | 120.0° | 120.0° |
| O11 | C12 | H4 | H5 | 120.0° | 120.1° |
| O11 | C6 | C1 | O7 | 9.4° | 0.0° |
| O11 | C6 | C1 | C5 | 178.6° | 179.7° |
| O11 | C6 | C1 | C2 | 178.6° | 179.9° |
| O11 | C6 | C5 | C4 | 178.2° | 180.0° |
| O11 | C6 | C5 | H2 | 1.8° | 0.0° |
| C6 | O11 | C12 | H3 | 180.0° | 57.6° |
| C6 | O11 | C12 | H4 | 60.0° | 177.6° |
| C6 | O11 | C12 | H5 | 60.0° | 62.3° |
| C9 | O7 | C1 | C6 | 76.3° | 90.0° |
| C9 | O7 | C1 | C2 | 111.7° | 90.0° |
| O7 | C9 | H6 | H7 | 120.0° | 120.0° |
| O7 | C9 | H6 | H8 | 120.0° | 120.0° |
| O7 | C9 | H7 | H8 | 120.0° | 120.1° |
| O7 | C1 | C6 | C2 | 172.0° | 179.9° |
| O7 | C1 | C6 | C5 | 169.2° | 179.7° |
| O7 | C1 | C2 | O8 | 12.4° | 0.1° |
| O7 | C1 | C2 | C3 | 168.0° | 180.0° |
| C1 | O7 | C9 | H6 | 180.0° | 180.0° |
| C1 | O7 | C9 | H7 | 60.0° | 60.0° |
| C1 | O7 | C9 | H8 | 60.0° | 60.0° |
| C1 | C6 | C5 | C4 | 0.3° | 0.2° |
| C6 | C1 | C2 | O8 | 175.7° | 180.0° |
| C6 | C1 | C2 | C3 | 3.8° | 0.1° |
| C1 | C6 | C5 | H2 | 179.7° | 179.7° |
| C5 | C6 | C1 | C2 | 2.8° | 0.2° |
| C6 | C5 | C4 | H2 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 2.3° | 0.0° |
| C6 | C5 | C4 | C13 | 178.3° | 180.0° |
| C1 | C2 | O8 | C3 | 179.5° | 179.9° |
| C1 | C2 | C3 | C4 | 1.8° | 0.4° |
| C1 | C2 | O8 | C10 | 178.5° | 174.5° |
| C1 | C2 | C3 | H1 | 178.2° | 180.0° |
| C5 | C4 | C3 | C2 | 1.3° | 0.4° |
| C5 | C4 | C3 | C13 | 179.3° | 180.0° |
| C5 | C4 | C13 | O14 | 23.2° | 133.0° |
| C5 | C4 | C13 | C15 | 158.9° | 47.0° |
| C5 | C4 | C3 | H1 | 178.7° | 180.0° |
| O8 | C2 | C3 | C4 | 177.7° | 179.7° |
| O8 | C2 | C3 | H1 | 2.3° | 0.1° |
| C2 | O8 | C10 | H9 | 180.0° | 175.2° |
| C2 | O8 | C10 | H10 | 60.0° | 55.2° |
| C2 | O8 | C10 | H11 | 60.0° | 64.8° |
| C2 | C3 | C4 | H1 | 180.0° | 179.6° |
| C2 | C3 | C4 | C13 | 179.4° | 179.7° |
| C3 | C2 | O8 | C10 | 2.0° | 5.4° |
| C3 | C4 | C13 | O14 | 156.1° | 47.0° |
| C3 | C4 | C13 | C15 | 21.8° | 133.0° |
| C3 | C4 | C5 | H2 | 177.7° | 180.0° |
| C4 | C13 | O14 | C15 | 177.9° | 180.0° |
| C4 | C13 | C15 | C16 | 34.8° | 172.4° |
| C4 | C13 | C15 | C19 | 144.7° | 7.9° |
| C13 | C4 | C3 | H1 | 0.6° | 0.0° |
| C13 | C4 | C5 | H2 | 1.7° | 0.0° |
| O8 | C10 | H9 | H10 | 120.0° | 120.0° |
| O8 | C10 | H9 | H11 | 120.0° | 120.0° |
| O8 | C10 | H10 | H11 | 120.0° | 120.0° |
| O14 | C13 | C15 | C16 | 147.4° | 7.6° |
| O14 | C13 | C15 | C19 | 33.1° | 172.1° |
| C13 | C15 | C16 | C19 | 179.5° | 179.7° |
| C13 | C15 | C16 | C20 | 6.3° | 0.0° |
| C13 | C15 | C16 | C17 | 178.8° | 180.0° |
| C13 | C15 | C19 | C27 | 1.6° | 0.0° |
| C13 | C15 | C19 | O18 | 179.3° | 179.9° |
| C15 | C16 | C20 | C17 | 174.5° | 180.0° |
| C15 | C16 | C20 | C21 | 175.4° | 180.0° |
| C16 | C15 | C19 | C27 | 178.0° | 179.8° |
| C16 | C15 | C19 | O18 | 0.3° | 0.4° |
| C15 | C16 | C17 | O18 | 1.0° | 0.0° |
| C15 | C16 | C17 | C23 | 178.4° | 180.0° |
| C15 | C16 | C20 | H12 | 4.6° | 0.0° |
| C19 | C15 | C16 | C20 | 174.2° | 179.8° |
| C19 | C15 | C16 | C17 | 0.8° | 0.2° |
| C15 | C19 | C27 | O18 | 177.6° | 179.8° |
| C15 | C19 | O18 | C17 | 0.3° | 0.4° |
| C15 | C19 | C27 | H18 | 177.7° | 88.0° |
| C15 | C19 | C27 | H19 | 62.4° | 152.0° |
| C15 | C19 | C27 | H20 | 57.6° | 32.1° |
| C16 | C20 | C21 | H12 | 180.0° | 180.0° |
| C16 | C20 | C21 | C22 | 1.3° | 0.0° |
| C20 | C16 | C17 | O18 | 175.0° | 180.0° |
| C20 | C16 | C17 | C23 | 2.4° | 0.0° |
| C16 | C20 | C21 | H13 | 178.6° | 180.0° |
| C21 | C20 | C16 | C17 | 0.9° | 0.0° |
| C20 | C21 | C22 | H13 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 2.2° | 0.0° |
| C20 | C21 | C22 | O24 | 178.0° | 180.0° |
| C16 | C17 | O18 | C19 | 0.9° | 0.2° |
| C16 | C17 | O18 | C23 | 177.2° | 179.9° |
| C16 | C17 | C23 | C22 | 1.5° | 0.1° |
| C16 | C17 | C23 | O26 | 179.0° | 179.9° |
| C17 | C16 | C20 | H12 | 179.1° | 180.0° |
| C27 | C19 | O18 | C17 | 177.8° | 179.8° |
| C19 | C27 | H18 | H19 | 120.0° | 120.0° |
| C19 | C27 | H18 | H20 | 120.0° | 120.1° |
| C19 | C27 | H19 | H20 | 120.0° | 120.0° |
| C19 | O18 | C17 | C23 | 178.1° | 179.7° |
| O18 | C19 | C27 | H18 | 0.0° | 91.8° |
| O18 | C19 | C27 | H19 | 120.0° | 28.1° |
| O18 | C19 | C27 | H20 | 120.0° | 148.1° |
| C21 | C22 | C23 | C17 | 0.9° | 0.1° |
| C21 | C22 | C23 | O24 | 179.7° | 180.0° |
| C21 | C22 | C23 | O26 | 176.7° | 179.9° |
| C21 | C22 | O24 | C25 | 0.8° | 0.0° |
| C22 | C21 | C20 | H12 | 178.7° | 180.0° |
| O18 | C17 | C23 | C22 | 175.4° | 180.0° |
| O18 | C17 | C23 | O26 | 2.1° | 0.0° |
| C17 | C23 | C22 | O26 | 177.6° | 180.0° |
| C17 | C23 | C22 | O24 | 179.4° | 180.0° |
| C17 | C23 | O26 | H17 | 180.0° | 90.0° |
| C23 | C22 | O24 | C25 | 179.5° | 179.9° |
| C23 | C22 | C21 | H13 | 177.7° | 179.9° |
| C22 | C23 | O26 | H17 | 2.4° | 90.0° |
| O24 | C22 | C23 | O26 | 3.0° | 0.0° |
| O24 | C22 | C21 | H13 | 2.0° | 0.0° |
| C22 | O24 | C25 | H14 | 180.0° | 60.0° |
| C22 | O24 | C25 | H15 | 60.0° | 180.0° |
| C22 | O24 | C25 | H16 | 60.0° | 60.0° |
| O24 | C25 | H14 | H15 | 120.0° | 120.0° |
| O24 | C25 | H14 | H16 | 120.0° | 119.9° |
| O24 | C25 | H15 | H16 | 120.0° | 120.0° |
| H3 | C12 | H4 | H5 | 120.0° | 120.0° |
| H6 | C9 | H7 | H8 | 120.0° | 120.0° |
| H9 | C10 | H10 | H11 | 120.0° | 120.0° |
| H12 | C20 | C21 | H13 | 1.4° | 0.0° |
| H14 | C25 | H15 | H16 | 120.0° | 120.0° |
| H18 | C27 | H19 | H20 | 120.0° | 120.0° |
