010
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | sing | 1.43Å | 1.47Å | |
| C | C6 | sing | 1.51Å | 1.53Å | |
| C | H | sing | 1.09Å | 1.10Å | |
| C | HA | sing | 1.09Å | 1.10Å | |
| O | HO | sing | 0.97Å | 0.95Å | |
| C6 | C1 | doub | 1.38Å | 1.47Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.46Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | C3 | doub | 1.38Å | 1.47Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C4 | C3 | sing | 1.38Å | 1.47Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | C4 | doub | 1.38Å | 1.47Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | C5 | sing | 1.38Å | 1.47Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | C6 | 111.9° | 109.5° |
| O | C | H | 108.6° | 109.5° |
| O | C | HA | 108.7° | 109.5° |
| C | O | HO | 109.5° | 114.0° |
| C6 | C | H | 108.7° | 109.4° |
| C6 | C | HA | 108.7° | 109.5° |
| C | C6 | C1 | 119.8° | 120.0° |
| C | C6 | C5 | 120.5° | 120.0° |
| H | C | HA | 110.3° | 109.5° |
| C6 | C1 | C2 | 120.2° | 120.0° |
| C6 | C1 | H1 | 119.9° | 120.0° |
| C1 | C6 | C5 | 119.6° | 120.0° |
| C2 | C1 | H1 | 119.9° | 120.0° |
| C1 | C2 | C3 | 120.3° | 120.0° |
| C1 | C2 | H2 | 119.8° | 120.0° |
| C3 | C2 | H2 | 119.8° | 120.0° |
| C2 | C3 | C4 | 119.8° | 120.0° |
| C2 | C3 | H3 | 120.1° | 120.0° |
| C4 | C3 | H3 | 120.1° | 120.0° |
| C3 | C4 | C5 | 119.9° | 120.0° |
| C3 | C4 | H4 | 120.1° | 120.0° |
| C5 | C4 | H4 | 120.1° | 120.0° |
| C4 | C5 | C6 | 120.2° | 120.0° |
| C4 | C5 | H5 | 119.9° | 120.0° |
| C6 | C5 | H5 | 119.9° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | C6 | H | 120.0° | 120.0° |
| O | C | C6 | HA | 120.0° | 120.0° |
| O | C | H | HA | 119.0° | 120.0° |
| O | C | C6 | C1 | 133.0° | 90.0° |
| O | C | C6 | C5 | 47.4° | 89.4° |
| C6 | C | H | HA | 119.0° | 120.0° |
| C6 | C | O | HO | 180.0° | 180.0° |
| C | C6 | C1 | C5 | 179.6° | 179.5° |
| C | C6 | C1 | C2 | 179.5° | 180.0° |
| C | C6 | C1 | H1 | 0.4° | 0.2° |
| C | C6 | C5 | C4 | 179.6° | 180.0° |
| C | C6 | C5 | H5 | 0.4° | 0.3° |
| H | C | O | HO | 60.0° | 60.0° |
| H | C | C6 | C1 | 107.0° | 30.0° |
| H | C | C6 | C5 | 72.6° | 150.5° |
| HA | C | O | HO | 60.0° | 60.0° |
| HA | C | C6 | C1 | 13.0° | 150.0° |
| HA | C | C6 | C5 | 167.4° | 30.5° |
| C6 | C1 | C2 | H1 | 180.0° | 179.7° |
| C6 | C1 | C2 | C3 | 0.0° | 0.3° |
| C6 | C1 | C2 | H2 | 180.0° | 179.8° |
| C1 | C6 | C5 | C4 | 0.0° | 0.5° |
| C1 | C6 | C5 | H5 | 180.0° | 179.7° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 0.1° | 0.1° |
| C1 | C2 | C3 | H3 | 179.9° | 180.0° |
| C2 | C1 | C6 | C5 | 0.1° | 0.5° |
| H1 | C1 | C2 | C3 | 180.0° | 180.0° |
| H1 | C1 | C2 | H2 | 0.0° | 0.1° |
| H1 | C1 | C6 | C5 | 180.0° | 179.7° |
| C2 | C3 | C4 | H3 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 0.2° | 0.1° |
| C2 | C3 | C4 | H4 | 179.8° | 180.0° |
| H2 | C2 | C3 | C4 | 179.9° | 180.0° |
| H2 | C2 | C3 | H3 | 0.1° | 0.1° |
| C3 | C4 | C5 | H4 | 180.0° | 179.9° |
| C3 | C4 | C5 | C6 | 0.1° | 0.3° |
| C3 | C4 | C5 | H5 | 179.9° | 180.0° |
| H3 | C3 | C4 | C5 | 179.9° | 180.0° |
| H3 | C3 | C4 | H4 | 0.2° | 0.1° |
| C4 | C5 | C6 | H5 | 180.0° | 179.7° |
| H4 | C4 | C5 | C6 | 179.9° | 179.8° |
| H4 | C4 | C5 | H5 | 0.2° | 0.1° |
