202
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| BR | O1 | sing | 1.76Å | 1.53Å | |
| BR | O2 | doub | 1.61Å | 1.60Å | |
| BR | O3 | doub | 1.61Å | 1.57Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | BR | O2 | 100.8° | 120.0° |
| O1 | BR | O3 | 100.9° | 120.0° |
| BR | O1 | H1 | 109.5° | 114.0° |
| O2 | BR | O3 | 108.6° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | BR | O2 | O3 | 105.6° | 179.7° |
| O2 | BR | O1 | H1 | 111.6° | 60.0° |
| O3 | BR | O1 | H1 | 0.0° | 120.3° |
