GQ7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C10 | sing | 1.43Å | 1.44Å | |
| C10 | C9 | sing | 1.51Å | 1.51Å | |
| C9 | C8 | doub | 1.35Å | 1.39Å | Aromatic |
| C9 | O | sing | 1.34Å | 1.39Å | Aromatic |
| C8 | C7 | sing | 1.41Å | 1.42Å | Aromatic |
| O | C6 | sing | 1.35Å | 1.37Å | Aromatic |
| C7 | C6 | doub | 1.36Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.48Å | 1.48Å | |
| C5 | C4 | doub | 1.40Å | 1.42Å | Aromatic |
| C5 | C | sing | 1.40Å | 1.40Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| C3 | C2 | doub | 1.39Å | 1.40Å | Aromatic |
| C | C1 | doub | 1.38Å | 1.41Å | Aromatic |
| C2 | C1 | sing | 1.39Å | 1.42Å | Aromatic |
| C2 | N | sing | 1.40Å | 1.38Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H2 | sing | 1.08Å | 1.08Å | |
| C8 | H3 | sing | 1.08Å | 1.08Å | |
| C10 | H4 | sing | 1.09Å | 1.10Å | |
| C10 | H5 | sing | 1.09Å | 1.10Å | |
| N | H6 | sing | 0.97Å | 1.00Å | |
| N | H7 | sing | 0.97Å | 1.00Å | |
| C | H8 | sing | 1.08Å | 1.08Å | |
| C1 | H9 | sing | 1.08Å | 1.08Å | |
| C3 | H10 | sing | 1.08Å | 1.08Å | |
| O1 | H11 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C10 | C9 | 111.3° | 109.5° |
| O1 | C10 | H4 | 109.0° | 109.5° |
| O1 | C10 | H5 | 109.0° | 109.5° |
| C10 | O1 | H11 | 109.5° | 114.0° |
| C10 | C9 | C8 | 131.7° | 125.7° |
| C10 | C9 | O | 118.4° | 125.7° |
| C9 | C10 | H4 | 109.0° | 109.5° |
| C9 | C10 | H5 | 109.0° | 109.5° |
| C8 | C9 | O | 109.7° | 108.7° |
| C9 | C8 | C7 | 106.2° | 107.0° |
| C9 | C8 | H3 | 126.9° | 126.5° |
| C9 | O | C6 | 107.7° | 109.4° |
| C8 | C7 | C6 | 107.9° | 106.7° |
| C8 | C7 | H2 | 126.0° | 126.6° |
| C7 | C8 | H3 | 126.9° | 126.5° |
| O | C6 | C7 | 108.5° | 108.2° |
| O | C6 | C5 | 118.5° | 125.9° |
| C7 | C6 | C5 | 132.9° | 125.9° |
| C6 | C7 | H2 | 126.1° | 126.7° |
| C6 | C5 | C4 | 122.0° | 120.0° |
| C6 | C5 | C | 119.9° | 120.1° |
| C4 | C5 | C | 118.1° | 119.9° |
| C5 | C4 | C3 | 121.7° | 119.9° |
| C5 | C4 | H1 | 119.2° | 120.1° |
| C5 | C | C1 | 120.8° | 119.9° |
| C5 | C | H8 | 119.6° | 120.0° |
| C4 | C3 | C2 | 120.2° | 120.1° |
| C3 | C4 | H1 | 119.1° | 120.0° |
| C4 | C3 | H10 | 119.9° | 120.0° |
| C3 | C2 | C1 | 119.4° | 120.1° |
| C3 | C2 | N | 119.0° | 120.0° |
| C2 | C3 | H10 | 119.9° | 119.9° |
| C | C1 | C2 | 119.9° | 120.1° |
| C1 | C | H8 | 119.6° | 120.1° |
| C | C1 | H9 | 120.0° | 119.9° |
| C1 | C2 | N | 121.6° | 119.9° |
| C2 | C1 | H9 | 120.1° | 120.0° |
| C2 | N | H6 | 109.5° | 120.0° |
| C2 | N | H7 | 109.4° | 120.0° |
| H4 | C10 | H5 | 109.4° | 109.5° |
| H6 | N | H7 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C10 | C9 | H4 | 120.3° | 120.0° |
| O1 | C10 | C9 | H5 | 120.3° | 120.0° |
| O1 | C10 | C9 | C8 | 127.8° | 90.0° |
| O1 | C10 | C9 | O | 57.6° | 89.7° |
| O1 | C10 | H4 | H5 | 119.2° | 120.0° |
| C10 | C9 | C8 | O | 175.0° | 179.7° |
| C10 | C9 | C8 | C7 | 173.6° | 180.0° |
| C10 | C9 | O | C6 | 174.3° | 179.8° |
| C10 | C9 | C8 | H3 | 6.4° | 0.0° |
| C9 | C10 | H4 | H5 | 119.2° | 120.0° |
| C9 | C10 | O1 | H11 | 180.0° | 180.0° |
| C9 | C8 | C7 | H3 | 180.0° | 180.0° |
| C8 | C9 | O | C6 | 1.4° | 0.4° |
| C9 | C8 | C7 | C6 | 0.8° | 0.0° |
| C9 | C8 | C7 | H2 | 179.2° | 180.0° |
| C8 | C9 | C10 | H4 | 7.5° | 150.0° |
| C8 | C9 | C10 | H5 | 111.9° | 30.0° |
| O | C9 | C8 | C7 | 1.4° | 0.3° |
| C9 | O | C6 | C7 | 0.9° | 0.4° |
| C9 | O | C6 | C5 | 176.4° | 179.8° |
| O | C9 | C8 | H3 | 178.6° | 179.7° |
| O | C9 | C10 | H4 | 177.9° | 30.3° |
| O | C9 | C10 | H5 | 62.7° | 150.4° |
| C8 | C7 | C6 | O | 0.1° | 0.3° |
| C8 | C7 | C6 | H2 | 180.0° | 180.0° |
| C8 | C7 | C6 | C5 | 176.7° | 180.0° |
| O | C6 | C7 | C5 | 176.8° | 179.7° |
| O | C6 | C5 | C4 | 14.4° | 0.3° |
| O | C6 | C5 | C | 167.2° | 179.7° |
| O | C6 | C7 | H2 | 179.9° | 179.7° |
| C7 | C6 | C5 | C4 | 169.1° | 180.0° |
| C7 | C6 | C5 | C | 9.3° | 0.0° |
| C6 | C7 | C8 | H3 | 179.2° | 180.0° |
| C6 | C5 | C4 | C | 178.5° | 180.0° |
| C6 | C5 | C4 | C3 | 177.9° | 180.0° |
| C6 | C5 | C | C1 | 177.6° | 180.0° |
| C6 | C5 | C4 | H1 | 2.1° | 0.2° |
| C5 | C6 | C7 | H2 | 3.3° | 0.0° |
| C6 | C5 | C | H8 | 2.4° | 0.1° |
| C5 | C4 | C3 | H1 | 180.0° | 179.7° |
| C5 | C4 | C3 | C2 | 0.4° | 0.0° |
| C4 | C5 | C | C1 | 0.9° | 0.0° |
| C4 | C5 | C | H8 | 179.1° | 179.9° |
| C5 | C4 | C3 | H10 | 179.6° | 179.7° |
| C | C5 | C4 | C3 | 0.6° | 0.0° |
| C5 | C | C1 | H8 | 180.0° | 179.9° |
| C5 | C | C1 | C2 | 0.3° | 0.0° |
| C | C5 | C4 | H1 | 179.4° | 179.7° |
| C5 | C | C1 | H9 | 179.7° | 180.0° |
| C4 | C3 | C2 | H10 | 180.0° | 179.7° |
| C4 | C3 | C2 | C1 | 1.0° | 0.1° |
| C4 | C3 | C2 | N | 178.5° | 180.0° |
| C3 | C2 | C1 | C | 0.6° | 0.1° |
| C3 | C2 | C1 | N | 179.4° | 179.9° |
| C2 | C3 | C4 | H1 | 179.6° | 179.8° |
| C3 | C2 | N | H6 | 180.0° | 180.0° |
| C3 | C2 | N | H7 | 60.0° | 0.1° |
| C3 | C2 | C1 | H9 | 179.4° | 180.0° |
| C | C1 | C2 | H9 | 180.0° | 179.9° |
| C | C1 | C2 | N | 178.8° | 180.0° |
| C1 | C2 | N | H6 | 0.5° | 0.1° |
| C1 | C2 | N | H7 | 120.6° | 180.0° |
| C2 | C1 | C | H8 | 179.7° | 179.9° |
| C1 | C2 | C3 | H10 | 179.0° | 179.7° |
| C2 | N | H6 | H7 | 120.0° | 179.9° |
| N | C2 | C1 | H9 | 1.2° | 0.1° |
| N | C2 | C3 | H10 | 1.6° | 0.2° |
| H1 | C4 | C3 | H10 | 0.4° | 0.0° |
| H2 | C7 | C8 | H3 | 0.8° | 0.0° |
| H4 | C10 | O1 | H11 | 59.7° | 60.0° |
| H5 | C10 | O1 | H11 | 59.7° | 60.0° |
| H8 | C | C1 | H9 | 0.4° | 0.0° |
