G9W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C18 | C19 | doub | 1.37Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | C5 | sing | 1.40Å | 1.40Å | Aromatic |
| C17 | C15 | doub | 1.38Å | 1.41Å | Aromatic |
| O4 | C3 | doub | 1.22Å | 1.24Å | |
| C5 | C3 | sing | 1.47Å | 1.49Å | |
| C5 | C6 | doub | 1.42Å | 1.44Å | Aromatic |
| C3 | N2 | sing | 1.34Å | 1.37Å | |
| C15 | C6 | sing | 1.39Å | 1.48Å | Aromatic |
| C15 | C16 | sing | 1.51Å | 1.50Å | |
| C6 | C7 | sing | 1.47Å | 1.53Å | |
| N2 | C1 | sing | 1.37Å | 1.37Å | |
| C7 | C1 | doub | 1.35Å | 1.38Å | |
| C7 | C8 | sing | 1.51Å | 1.50Å | |
| C1 | C14 | sing | 1.51Å | 1.52Å | |
| C8 | O9 | sing | 1.43Å | 1.42Å | |
| C14 | C10 | sing | 1.53Å | 1.55Å | |
| O9 | C10 | sing | 1.43Å | 1.44Å | |
| C10 | C11 | sing | 1.53Å | 1.53Å | |
| C11 | C13 | sing | 1.53Å | 1.52Å | |
| C11 | C12 | sing | 1.53Å | 1.52Å | |
| C8 | H2 | sing | 1.09Å | 1.10Å | |
| C8 | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C12 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| N2 | H20 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C18 | C17 | 120.2° | 119.8° |
| C18 | C19 | C5 | 120.3° | 119.5° |
| C19 | C18 | H18 | 119.9° | 120.0° |
| C18 | C19 | H19 | 119.8° | 120.4° |
| C18 | C17 | C15 | 121.6° | 121.8° |
| C18 | C17 | H17 | 119.2° | 119.7° |
| C17 | C18 | H18 | 119.9° | 120.2° |
| C19 | C5 | C3 | 116.5° | 120.0° |
| C19 | C5 | C6 | 122.5° | 121.0° |
| C5 | C19 | H19 | 119.9° | 120.1° |
| C17 | C15 | C6 | 119.9° | 119.9° |
| C17 | C15 | C16 | 119.5° | 115.9° |
| C15 | C17 | H17 | 119.2° | 118.5° |
| O4 | C3 | C5 | 120.2° | 120.4° |
| O4 | C3 | N2 | 123.4° | 120.7° |
| C3 | C5 | C6 | 121.0° | 118.9° |
| C5 | C3 | N2 | 116.4° | 118.9° |
| C5 | C6 | C15 | 115.5° | 117.5° |
| C5 | C6 | C7 | 116.8° | 117.2° |
| C3 | N2 | C1 | 125.5° | 122.5° |
| C3 | N2 | H20 | 117.2° | 119.0° |
| C6 | C15 | C16 | 120.6° | 124.2° |
| C15 | C6 | C7 | 127.7° | 125.3° |
| C15 | C16 | H14 | 109.5° | 109.4° |
| C15 | C16 | H15 | 109.5° | 109.5° |
| C15 | C16 | H16 | 109.5° | 109.5° |
| C6 | C7 | C1 | 118.3° | 119.7° |
| C6 | C7 | C8 | 122.6° | 120.3° |
| N2 | C1 | C7 | 122.0° | 121.8° |
| N2 | C1 | C14 | 116.0° | 115.6° |
| C1 | N2 | H20 | 117.3° | 118.5° |
| C1 | C7 | C8 | 119.1° | 119.9° |
| C7 | C1 | C14 | 122.0° | 122.6° |
| C7 | C8 | O9 | 109.4° | 111.2° |
| C7 | C8 | H2 | 109.5° | 109.7° |
| C7 | C8 | H3 | 109.5° | 109.5° |
| C1 | C14 | C10 | 110.4° | 110.5° |
| C1 | C14 | H12 | 109.2° | 109.3° |
| C1 | C14 | H13 | 109.2° | 109.2° |
| C8 | O9 | C10 | 108.3° | 111.8° |
| O9 | C8 | H2 | 109.5° | 108.2° |
| O9 | C8 | H3 | 109.5° | 107.2° |
| C14 | C10 | O9 | 108.9° | 107.1° |
| C14 | C10 | C11 | 111.7° | 109.9° |
| C14 | C10 | H4 | 108.6° | 110.0° |
| C10 | C14 | H12 | 109.3° | 109.3° |
| C10 | C14 | H13 | 109.3° | 109.4° |
| O9 | C10 | C11 | 108.6° | 109.8° |
| O9 | C10 | H4 | 110.2° | 110.0° |
| C10 | C11 | C13 | 111.1° | 109.5° |
| C10 | C11 | C12 | 109.2° | 109.5° |
| C11 | C10 | H4 | 108.8° | 110.0° |
| C10 | C11 | H5 | 109.1° | 109.5° |
| C13 | C11 | C12 | 108.7° | 109.4° |
| C13 | C11 | H5 | 109.3° | 109.5° |
| C11 | C13 | H9 | 109.5° | 109.5° |
| C11 | C13 | H10 | 109.5° | 109.5° |
| C11 | C13 | H11 | 109.5° | 109.5° |
| C12 | C11 | H5 | 109.3° | 109.4° |
| C11 | C12 | H6 | 109.5° | 109.5° |
| C11 | C12 | H7 | 109.5° | 109.5° |
| C11 | C12 | H8 | 109.5° | 109.4° |
| H2 | C8 | H3 | 109.5° | 111.0° |
| H6 | C12 | H7 | 109.5° | 109.5° |
| H6 | C12 | H8 | 109.4° | 109.4° |
| H7 | C12 | H8 | 109.5° | 109.5° |
| H9 | C13 | H10 | 109.4° | 109.5° |
| H9 | C13 | H11 | 109.5° | 109.5° |
| H10 | C13 | H11 | 109.5° | 109.5° |
| H12 | C14 | H13 | 109.5° | 109.1° |
| H14 | C16 | H15 | 109.4° | 109.5° |
| H14 | C16 | H16 | 109.5° | 109.5° |
| H15 | C16 | H16 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C18 | C17 | H18 | 180.0° | 179.9° |
| C18 | C19 | C5 | H19 | 180.0° | 180.0° |
| C19 | C18 | C17 | C15 | 0.3° | 1.1° |
| C18 | C19 | C5 | C3 | 179.9° | 177.3° |
| C18 | C19 | C5 | C6 | 0.3° | 2.9° |
| C19 | C18 | C17 | H17 | 179.7° | 177.8° |
| C17 | C18 | C19 | C5 | 0.2° | 1.2° |
| C18 | C17 | C15 | H17 | 180.0° | 179.0° |
| C18 | C17 | C15 | C6 | 0.1° | 3.0° |
| C18 | C17 | C15 | C16 | 179.9° | 177.7° |
| C17 | C18 | C19 | H19 | 179.8° | 178.8° |
| C19 | C5 | C3 | O4 | 0.5° | 1.1° |
| C19 | C5 | C3 | C6 | 179.8° | 179.8° |
| C19 | C5 | C3 | N2 | 179.6° | 178.1° |
| C19 | C5 | C6 | C15 | 0.6° | 6.8° |
| C19 | C5 | C6 | C7 | 179.5° | 173.3° |
| C5 | C19 | C18 | H18 | 179.8° | 178.9° |
| C17 | C15 | C6 | C5 | 0.5° | 6.8° |
| C17 | C15 | C6 | C16 | 180.0° | 179.2° |
| C17 | C15 | C6 | C7 | 179.6° | 173.3° |
| C17 | C15 | C16 | H14 | 90.0° | 97.3° |
| C17 | C15 | C16 | H15 | 150.0° | 22.7° |
| C17 | C15 | C16 | H16 | 30.0° | 142.7° |
| C15 | C17 | C18 | H18 | 179.7° | 179.0° |
| O4 | C3 | C5 | N2 | 179.9° | 179.3° |
| O4 | C3 | C5 | C6 | 179.7° | 178.7° |
| O4 | C3 | N2 | C1 | 179.9° | 172.8° |
| O4 | C3 | N2 | H20 | 0.1° | 6.1° |
| C3 | C5 | C6 | C15 | 179.6° | 173.4° |
| C3 | C5 | C6 | C7 | 0.3° | 6.5° |
| C5 | C3 | N2 | C1 | 0.1° | 8.0° |
| C3 | C5 | C19 | H19 | 0.1° | 2.7° |
| C5 | C3 | N2 | H20 | 179.9° | 173.2° |
| C6 | C5 | C3 | N2 | 0.2° | 2.1° |
| C5 | C6 | C15 | C7 | 179.8° | 179.9° |
| C5 | C6 | C15 | C16 | 179.5° | 174.0° |
| C5 | C6 | C7 | C1 | 0.0° | 10.0° |
| C5 | C6 | C7 | C8 | 179.5° | 167.5° |
| C6 | C5 | C19 | H19 | 179.7° | 177.1° |
| C3 | N2 | C1 | H20 | 180.0° | 178.9° |
| C3 | N2 | C1 | C7 | 0.4° | 4.6° |
| C3 | N2 | C1 | C14 | 179.6° | 173.6° |
| C15 | C6 | C7 | C1 | 179.8° | 170.0° |
| C15 | C6 | C7 | C8 | 0.6° | 12.6° |
| C6 | C15 | C16 | H14 | 90.0° | 83.5° |
| C6 | C15 | C16 | H15 | 30.0° | 156.5° |
| C6 | C15 | C16 | H16 | 150.0° | 36.5° |
| C6 | C15 | C17 | H17 | 179.9° | 178.0° |
| C16 | C15 | C6 | C7 | 0.4° | 5.9° |
| C15 | C16 | H14 | H15 | 120.0° | 120.0° |
| C15 | C16 | H14 | H16 | 120.0° | 120.0° |
| C15 | C16 | H15 | H16 | 120.0° | 120.0° |
| C16 | C15 | C17 | H17 | 0.1° | 1.3° |
| C6 | C7 | C1 | N2 | 0.3° | 4.7° |
| C6 | C7 | C1 | C8 | 179.6° | 177.4° |
| C6 | C7 | C1 | C14 | 179.7° | 177.2° |
| C6 | C7 | C8 | O9 | 150.6° | 163.2° |
| C6 | C7 | C8 | H2 | 89.4° | 77.1° |
| C6 | C7 | C8 | H3 | 30.6° | 45.0° |
| N2 | C1 | C7 | C14 | 180.0° | 178.1° |
| N2 | C1 | C7 | C8 | 179.9° | 172.7° |
| N2 | C1 | C14 | C10 | 174.6° | 170.1° |
| N2 | C1 | C14 | H12 | 65.3° | 69.6° |
| N2 | C1 | C14 | H13 | 54.4° | 49.8° |
| C1 | C7 | C8 | O9 | 29.0° | 14.2° |
| C7 | C1 | C14 | C10 | 5.5° | 11.7° |
| C1 | C7 | C8 | H2 | 91.0° | 105.5° |
| C1 | C7 | C8 | H3 | 149.0° | 132.5° |
| C7 | C1 | C14 | H12 | 114.7° | 108.6° |
| C7 | C1 | C14 | H13 | 125.6° | 132.0° |
| C7 | C1 | N2 | H20 | 179.6° | 176.5° |
| C8 | C7 | C1 | C14 | 0.1° | 5.4° |
| C7 | C8 | O9 | H2 | 120.0° | 120.6° |
| C7 | C8 | O9 | H3 | 120.0° | 119.6° |
| C7 | C8 | O9 | C10 | 65.9° | 53.7° |
| C7 | C8 | H2 | H3 | 120.0° | 121.1° |
| C1 | C14 | C10 | H12 | 120.1° | 120.3° |
| C1 | C14 | C10 | H13 | 120.1° | 120.3° |
| C1 | C14 | C10 | O9 | 40.0° | 47.3° |
| C1 | C14 | C10 | C11 | 160.0° | 166.5° |
| C1 | C14 | C10 | H4 | 80.0° | 72.2° |
| C1 | C14 | H12 | H13 | 119.6° | 119.4° |
| C14 | C1 | N2 | H20 | 0.4° | 5.3° |
| C8 | O9 | C10 | C14 | 72.8° | 71.3° |
| C8 | O9 | C10 | C11 | 165.3° | 169.3° |
| O9 | C8 | H2 | H3 | 120.0° | 117.3° |
| C8 | O9 | C10 | H4 | 46.2° | 48.2° |
| C14 | C10 | O9 | C11 | 121.9° | 119.3° |
| C14 | C10 | O9 | H4 | 119.0° | 119.6° |
| C14 | C10 | C11 | H4 | 119.9° | 121.3° |
| C14 | C10 | C11 | C13 | 62.3° | 177.6° |
| C14 | C10 | C11 | C12 | 177.7° | 62.4° |
| C14 | C10 | C11 | H5 | 58.3° | 57.5° |
| C10 | C14 | H12 | H13 | 119.6° | 119.6° |
| O9 | C10 | C11 | H4 | 119.9° | 121.1° |
| O9 | C10 | C11 | C13 | 177.5° | 60.0° |
| O9 | C10 | C11 | C12 | 57.6° | 180.0° |
| C10 | O9 | C8 | H2 | 54.1° | 66.9° |
| C10 | O9 | C8 | H3 | 174.2° | 173.3° |
| O9 | C10 | C11 | H5 | 61.9° | 60.1° |
| O9 | C10 | C14 | H12 | 80.1° | 73.0° |
| O9 | C10 | C14 | H13 | 160.1° | 167.6° |
| C10 | C11 | C13 | C12 | 120.2° | 120.0° |
| C10 | C11 | C13 | H5 | 120.5° | 120.1° |
| C10 | C11 | C12 | H5 | 119.3° | 120.0° |
| C10 | C11 | C12 | H6 | 180.0° | 60.0° |
| C10 | C11 | C12 | H7 | 60.0° | 180.0° |
| C10 | C11 | C12 | H8 | 60.0° | 60.0° |
| C10 | C11 | C13 | H9 | 180.0° | 60.0° |
| C10 | C11 | C13 | H10 | 60.0° | 60.0° |
| C10 | C11 | C13 | H11 | 60.0° | 180.0° |
| C11 | C10 | C14 | H12 | 39.9° | 46.2° |
| C11 | C10 | C14 | H13 | 79.9° | 73.2° |
| C13 | C11 | C12 | H5 | 119.3° | 120.0° |
| C13 | C11 | C10 | H4 | 57.5° | 61.1° |
| C13 | C11 | C12 | H6 | 58.6° | 60.0° |
| C13 | C11 | C12 | H7 | 61.4° | 60.0° |
| C13 | C11 | C12 | H8 | 178.6° | 180.0° |
| C11 | C13 | H9 | H10 | 120.0° | 120.0° |
| C11 | C13 | H9 | H11 | 120.0° | 120.0° |
| C11 | C13 | H10 | H11 | 120.0° | 120.0° |
| C12 | C11 | C10 | H4 | 62.4° | 58.9° |
| C11 | C12 | H6 | H7 | 120.0° | 120.0° |
| C11 | C12 | H6 | H8 | 120.0° | 120.0° |
| C11 | C12 | H7 | H8 | 120.0° | 120.0° |
| C12 | C11 | C13 | H9 | 59.8° | 60.0° |
| C12 | C11 | C13 | H10 | 179.8° | 180.0° |
| C12 | C11 | C13 | H11 | 60.2° | 60.0° |
| H4 | C10 | C11 | H5 | 178.2° | 178.8° |
| H4 | C10 | C14 | H12 | 159.9° | 167.5° |
| H4 | C10 | C14 | H13 | 40.1° | 48.1° |
| H5 | C11 | C12 | H6 | 60.6° | 180.0° |
| H5 | C11 | C12 | H7 | 179.3° | 60.0° |
| H5 | C11 | C12 | H8 | 59.3° | 60.0° |
| H5 | C11 | C13 | H9 | 59.4° | 180.0° |
| H5 | C11 | C13 | H10 | 60.6° | 60.0° |
| H5 | C11 | C13 | H11 | 179.5° | 59.9° |
| H6 | C12 | H7 | H8 | 119.9° | 120.0° |
| H9 | C13 | H10 | H11 | 120.0° | 120.0° |
| H14 | C16 | H15 | H16 | 120.0° | 120.0° |
| H17 | C17 | C18 | H18 | 0.3° | 2.1° |
| H18 | C18 | C19 | H19 | 0.2° | 1.1° |
