Obsolete: OCL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CO | O1 | sing | 1.72Å | 2.28Å | |
| O1 | HO11 | sing | 0.97Å | 0.95Å | |
| O1 | HO12 | sing | 1.33Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CO | O1 | HO11 | 15.3° | 106.9° |
| CO | O1 | HO12 | 165.0° | 0.5° |
| HO11 | O1 | HO12 | 165.0° | 106.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CO | O1 | HO11 | HO12 | 120.0° | 0.0° |
