Z7G
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL2 | C6 | sing | 1.74Å | 1.74Å | |
| C9 | C6 | doub | 1.38Å | 1.38Å | Aromatic |
| C9 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C3 | sing | 1.39Å | 1.39Å | Aromatic |
| O18 | C15 | sing | 1.43Å | 1.42Å | |
| C20 | C17 | sing | 1.53Å | 1.52Å | |
| C15 | C12 | sing | 1.51Å | 1.50Å | |
| C12 | C8 | doub | 1.38Å | 1.39Å | Aromatic |
| O4 | C3 | sing | 1.36Å | 1.38Å | |
| O4 | C7 | sing | 1.36Å | 1.39Å | |
| C3 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C21 | C17 | sing | 1.53Å | 1.53Å | |
| C10 | C7 | doub | 1.39Å | 1.38Å | Aromatic |
| C10 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | C11 | sing | 1.39Å | 1.38Å | Aromatic |
| C8 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | CL1 | sing | 1.74Å | 1.74Å | |
| C17 | C13 | sing | 1.51Å | 1.52Å | |
| C13 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C14 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C16 | O19 | sing | 1.36Å | 1.37Å | |
| O19 | C22 | sing | 1.43Å | 1.43Å | |
| C8 | H1 | sing | 1.08Å | 1.08Å | |
| C9 | H2 | sing | 1.08Å | 1.08Å | |
| C10 | H3 | sing | 1.08Å | 1.08Å | |
| C11 | H4 | sing | 1.08Å | 1.08Å | |
| C14 | H5 | sing | 1.08Å | 1.08Å | |
| C15 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.09Å | 1.10Å | |
| O18 | H9 | sing | 0.97Å | 0.95Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | H13 | sing | 1.09Å | 1.10Å | |
| C21 | H14 | sing | 1.09Å | 1.10Å | |
| C21 | H15 | sing | 1.09Å | 1.10Å | |
| C22 | H16 | sing | 1.09Å | 1.10Å | |
| C22 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H18 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL2 | C6 | C9 | 119.0° | 120.0° |
| CL2 | C6 | C3 | 119.8° | 120.0° |
| C6 | C9 | C12 | 120.3° | 120.1° |
| C9 | C6 | C3 | 121.1° | 120.0° |
| C6 | C9 | H2 | 119.9° | 120.0° |
| C9 | C12 | C15 | 120.3° | 119.9° |
| C9 | C12 | C8 | 119.0° | 120.1° |
| C12 | C9 | H2 | 119.8° | 120.0° |
| C6 | C3 | O4 | 120.0° | 120.1° |
| C6 | C3 | C5 | 118.5° | 119.8° |
| O18 | C15 | C12 | 112.0° | 109.5° |
| O18 | C15 | H6 | 108.8° | 109.5° |
| O18 | C15 | H7 | 108.9° | 109.5° |
| C15 | O18 | H9 | 109.5° | 114.0° |
| C20 | C17 | C21 | 109.6° | 109.5° |
| C20 | C17 | C13 | 111.4° | 109.4° |
| C20 | C17 | H8 | 107.7° | 109.5° |
| C17 | C20 | H10 | 109.5° | 109.5° |
| C17 | C20 | H11 | 109.5° | 109.4° |
| C17 | C20 | H12 | 109.5° | 109.5° |
| C15 | C12 | C8 | 120.7° | 119.9° |
| C12 | C15 | H6 | 108.8° | 109.5° |
| C12 | C15 | H7 | 108.8° | 109.5° |
| C12 | C8 | C5 | 120.3° | 120.1° |
| C12 | C8 | H1 | 119.9° | 120.0° |
| C3 | O4 | C7 | 118.5° | 118.0° |
| O4 | C3 | C5 | 121.5° | 120.0° |
| O4 | C7 | C10 | 119.1° | 120.0° |
| O4 | C7 | C11 | 120.3° | 120.0° |
| C3 | C5 | C8 | 120.8° | 119.9° |
| C3 | C5 | CL1 | 119.9° | 120.1° |
| C21 | C17 | C13 | 112.5° | 109.5° |
| C21 | C17 | H8 | 107.7° | 109.5° |
| C17 | C21 | H13 | 109.5° | 109.5° |
| C17 | C21 | H14 | 109.5° | 109.5° |
| C17 | C21 | H15 | 109.5° | 109.5° |
| C7 | C10 | C13 | 120.4° | 120.0° |
| C10 | C7 | C11 | 120.5° | 120.0° |
| C7 | C10 | H3 | 119.8° | 120.0° |
| C10 | C13 | C17 | 120.4° | 120.0° |
| C10 | C13 | C16 | 118.4° | 120.0° |
| C13 | C10 | H3 | 119.8° | 120.0° |
| C7 | C11 | C14 | 119.7° | 120.0° |
| C7 | C11 | H4 | 120.2° | 120.0° |
| C8 | C5 | CL1 | 119.3° | 120.0° |
| C5 | C8 | H1 | 119.8° | 119.9° |
| C17 | C13 | C16 | 121.0° | 120.0° |
| C13 | C17 | H8 | 107.7° | 109.5° |
| C13 | C16 | C14 | 120.9° | 120.0° |
| C13 | C16 | O19 | 115.3° | 120.0° |
| C11 | C14 | C16 | 120.0° | 120.0° |
| C14 | C11 | H4 | 120.1° | 120.0° |
| C11 | C14 | H5 | 120.0° | 120.0° |
| C14 | C16 | O19 | 123.8° | 120.0° |
| C16 | C14 | H5 | 120.1° | 120.0° |
| C16 | O19 | C22 | 118.0° | 117.0° |
| O19 | C22 | H16 | 109.5° | 109.5° |
| O19 | C22 | H17 | 109.4° | 109.5° |
| O19 | C22 | H18 | 109.5° | 109.5° |
| H6 | C15 | H7 | 109.5° | 109.5° |
| H10 | C20 | H11 | 109.5° | 109.5° |
| H10 | C20 | H12 | 109.5° | 109.5° |
| H11 | C20 | H12 | 109.4° | 109.5° |
| H13 | C21 | H14 | 109.4° | 109.5° |
| H13 | C21 | H15 | 109.5° | 109.4° |
| H14 | C21 | H15 | 109.5° | 109.5° |
| H16 | C22 | H17 | 109.5° | 109.4° |
| H16 | C22 | H18 | 109.4° | 109.5° |
| H17 | C22 | H18 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL2 | C6 | C9 | C3 | 175.3° | 179.9° |
| CL2 | C6 | C9 | C12 | 174.3° | 179.4° |
| CL2 | C6 | C3 | O4 | 6.9° | 0.2° |
| CL2 | C6 | C3 | C5 | 173.4° | 180.0° |
| CL2 | C6 | C9 | H2 | 5.7° | 0.1° |
| C6 | C9 | C12 | H2 | 180.0° | 179.3° |
| C6 | C9 | C12 | C15 | 178.9° | 180.0° |
| C6 | C9 | C12 | C8 | 0.3° | 0.9° |
| C9 | C6 | C3 | O4 | 177.9° | 179.7° |
| C9 | C6 | C3 | C5 | 1.8° | 0.1° |
| C12 | C9 | C6 | C3 | 1.0° | 0.7° |
| C9 | C12 | C15 | O18 | 48.4° | 90.0° |
| C9 | C12 | C15 | C8 | 179.2° | 179.1° |
| C9 | C12 | C8 | C5 | 0.7° | 0.6° |
| C9 | C12 | C8 | H1 | 179.3° | 179.4° |
| C9 | C12 | C15 | H6 | 168.8° | 150.0° |
| C9 | C12 | C15 | H7 | 72.0° | 30.0° |
| C6 | C3 | O4 | C5 | 179.7° | 179.7° |
| C6 | C3 | O4 | C7 | 87.2° | 90.2° |
| C6 | C3 | C5 | C8 | 1.5° | 0.2° |
| C6 | C3 | C5 | CL1 | 175.9° | 179.8° |
| C3 | C6 | C9 | H2 | 179.0° | 180.0° |
| O18 | C15 | C12 | H6 | 120.4° | 120.0° |
| O18 | C15 | C12 | H7 | 120.4° | 120.0° |
| O18 | C15 | C12 | C8 | 132.4° | 90.9° |
| O18 | C15 | H6 | H7 | 118.9° | 120.0° |
| C20 | C17 | C21 | C13 | 124.6° | 120.0° |
| C20 | C17 | C21 | H8 | 116.9° | 120.0° |
| C20 | C17 | C13 | C10 | 91.3° | 60.0° |
| C20 | C17 | C13 | H8 | 117.9° | 120.0° |
| C20 | C17 | C13 | C16 | 83.1° | 120.0° |
| C17 | C20 | H10 | H11 | 120.0° | 120.0° |
| C17 | C20 | H10 | H12 | 120.0° | 120.0° |
| C17 | C20 | H11 | H12 | 120.0° | 120.0° |
| C20 | C17 | C21 | H13 | 180.0° | 180.0° |
| C20 | C17 | C21 | H14 | 60.0° | 60.0° |
| C20 | C17 | C21 | H15 | 60.0° | 60.0° |
| C15 | C12 | C8 | C5 | 178.5° | 179.7° |
| C15 | C12 | C8 | H1 | 1.5° | 0.3° |
| C15 | C12 | C9 | H2 | 1.1° | 0.6° |
| C12 | C15 | H6 | H7 | 118.8° | 120.0° |
| C12 | C15 | O18 | H9 | 180.0° | 180.0° |
| C12 | C8 | C5 | C3 | 0.2° | 0.1° |
| C12 | C8 | C5 | H1 | 180.0° | 179.9° |
| C12 | C8 | C5 | CL1 | 177.2° | 180.0° |
| C8 | C12 | C9 | H2 | 179.7° | 179.7° |
| C8 | C12 | C15 | H6 | 12.0° | 29.1° |
| C8 | C12 | C15 | H7 | 107.2° | 149.1° |
| C3 | O4 | C7 | C10 | 172.0° | 179.8° |
| C3 | O4 | C7 | C11 | 7.6° | 0.1° |
| O4 | C3 | C5 | C8 | 178.3° | 180.0° |
| O4 | C3 | C5 | CL1 | 4.3° | 0.0° |
| C7 | O4 | C3 | C5 | 93.1° | 90.0° |
| O4 | C7 | C10 | C11 | 179.6° | 179.7° |
| O4 | C7 | C10 | C13 | 175.1° | 180.0° |
| O4 | C7 | C11 | C14 | 178.2° | 180.0° |
| O4 | C7 | C10 | H3 | 4.9° | 0.1° |
| O4 | C7 | C11 | H4 | 1.8° | 0.0° |
| C3 | C5 | C8 | CL1 | 177.4° | 180.0° |
| C3 | C5 | C8 | H1 | 179.8° | 180.0° |
| C21 | C17 | C13 | C10 | 32.3° | 60.0° |
| C21 | C17 | C13 | H8 | 118.6° | 120.0° |
| C21 | C17 | C13 | C16 | 153.4° | 120.1° |
| C21 | C17 | C20 | H10 | 180.0° | 60.0° |
| C21 | C17 | C20 | H11 | 60.0° | 60.0° |
| C21 | C17 | C20 | H12 | 60.0° | 180.0° |
| C17 | C21 | H13 | H14 | 120.0° | 120.0° |
| C17 | C21 | H13 | H15 | 120.1° | 120.0° |
| C17 | C21 | H14 | H15 | 120.0° | 120.0° |
| C7 | C10 | C13 | H3 | 180.0° | 180.0° |
| C7 | C10 | C13 | C17 | 169.3° | 180.0° |
| C7 | C10 | C13 | C16 | 5.1° | 0.0° |
| C10 | C7 | C11 | C14 | 1.4° | 0.3° |
| C10 | C7 | C11 | H4 | 178.6° | 179.7° |
| C13 | C10 | C7 | C11 | 4.5° | 0.3° |
| C10 | C13 | C17 | C16 | 174.3° | 180.0° |
| C10 | C13 | C16 | C14 | 2.9° | 0.4° |
| C10 | C13 | C16 | O19 | 176.1° | 180.0° |
| C10 | C13 | C17 | H8 | 150.8° | 180.0° |
| C7 | C11 | C14 | H4 | 180.0° | 180.0° |
| C7 | C11 | C14 | C16 | 0.9° | 0.0° |
| C11 | C7 | C10 | H3 | 175.5° | 179.7° |
| C7 | C11 | C14 | H5 | 179.1° | 180.0° |
| CL1 | C5 | C8 | H1 | 2.8° | 0.0° |
| C17 | C13 | C16 | C14 | 171.6° | 179.7° |
| C17 | C13 | C16 | O19 | 9.5° | 0.0° |
| C17 | C13 | C10 | H3 | 10.7° | 0.0° |
| C13 | C17 | C20 | H10 | 54.8° | 60.0° |
| C13 | C17 | C20 | H11 | 174.8° | 180.0° |
| C13 | C17 | C20 | H12 | 65.2° | 60.0° |
| C13 | C17 | C21 | H13 | 55.4° | 60.0° |
| C13 | C17 | C21 | H14 | 64.6° | 180.0° |
| C13 | C17 | C21 | H15 | 175.5° | 60.0° |
| C13 | C16 | C14 | C11 | 0.2° | 0.4° |
| C13 | C16 | C14 | O19 | 178.8° | 179.7° |
| C13 | C16 | O19 | C22 | 173.8° | 180.0° |
| C16 | C13 | C10 | H3 | 174.8° | 179.9° |
| C13 | C16 | C14 | H5 | 179.8° | 179.7° |
| C16 | C13 | C17 | H8 | 34.8° | 0.0° |
| C11 | C14 | C16 | H5 | 180.0° | 179.9° |
| C11 | C14 | C16 | O19 | 179.0° | 180.0° |
| C14 | C16 | O19 | C22 | 5.1° | 0.3° |
| C16 | C14 | C11 | H4 | 179.1° | 180.0° |
| O19 | C16 | C14 | H5 | 1.0° | 0.0° |
| C16 | O19 | C22 | H16 | 180.0° | 60.0° |
| C16 | O19 | C22 | H17 | 60.0° | 180.0° |
| C16 | O19 | C22 | H18 | 60.0° | 60.0° |
| O19 | C22 | H16 | H17 | 120.0° | 120.0° |
| O19 | C22 | H16 | H18 | 120.0° | 120.1° |
| O19 | C22 | H17 | H18 | 120.0° | 120.1° |
| H4 | C11 | C14 | H5 | 0.9° | 0.0° |
| H6 | C15 | O18 | H9 | 59.6° | 60.0° |
| H7 | C15 | O18 | H9 | 59.6° | 60.0° |
| H8 | C17 | C20 | H10 | 63.1° | 180.0° |
| H8 | C17 | C20 | H11 | 56.9° | 60.0° |
| H8 | C17 | C20 | H12 | 176.8° | 60.0° |
| H8 | C17 | C21 | H13 | 63.2° | 60.0° |
| H8 | C17 | C21 | H14 | 176.9° | 60.0° |
| H8 | C17 | C21 | H15 | 56.9° | 180.0° |
| H10 | C20 | H11 | H12 | 120.0° | 120.0° |
| H13 | C21 | H14 | H15 | 120.0° | 120.0° |
| H16 | C22 | H17 | H18 | 120.0° | 119.9° |
