9O3
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAI | CAH | sing | 1.43Å | 1.43Å | |
| FAE | CAA | sing | 1.40Å | 1.33Å | |
| FAG | CAA | sing | 1.40Å | 1.29Å | |
| CAA | CAH | sing | 1.53Å | 1.51Å | |
| CAA | FAF | sing | 1.40Å | 1.32Å | |
| CAH | OAJ | sing | 1.43Å | 1.43Å | |
| CAH | CAB | sing | 1.51Å | 1.55Å | |
| OAD | CAB | doub | 1.21Å | 1.27Å | |
| CAB | OAC | sing | 1.34Å | 1.28Å | |
| OAC | H1 | sing | 0.97Å | 0.95Å | |
| OAI | H2 | sing | 0.97Å | 0.95Å | |
| OAJ | H3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAI | CAH | CAA | 109.2° | 109.5° |
| OAI | CAH | OAJ | 108.3° | 109.5° |
| OAI | CAH | CAB | 109.9° | 109.5° |
| CAH | OAI | H2 | 109.5° | 114.0° |
| FAE | CAA | FAG | 108.6° | 109.4° |
| FAE | CAA | CAH | 109.1° | 109.5° |
| FAE | CAA | FAF | 110.4° | 109.5° |
| FAG | CAA | CAH | 111.1° | 109.5° |
| FAG | CAA | FAF | 110.5° | 109.5° |
| CAH | CAA | FAF | 107.1° | 109.5° |
| CAA | CAH | OAJ | 106.8° | 109.5° |
| CAA | CAH | CAB | 112.3° | 109.5° |
| OAJ | CAH | CAB | 110.2° | 109.4° |
| CAH | OAJ | H3 | 109.5° | 113.9° |
| CAH | CAB | OAD | 118.1° | 120.0° |
| CAH | CAB | OAC | 119.2° | 120.0° |
| OAD | CAB | OAC | 122.5° | 120.0° |
| CAB | OAC | H1 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAI | CAH | CAA | FAE | 56.3° | 180.0° |
| OAI | CAH | CAA | FAG | 63.4° | 60.0° |
| OAI | CAH | CAA | OAJ | 116.9° | 120.0° |
| OAI | CAH | CAA | CAB | 122.2° | 120.0° |
| OAI | CAH | CAA | FAF | 175.8° | 60.0° |
| OAI | CAH | OAJ | CAB | 120.3° | 120.0° |
| OAI | CAH | CAB | OAD | 20.1° | 5.0° |
| OAI | CAH | CAB | OAC | 165.1° | 175.0° |
| OAI | CAH | OAJ | H3 | 180.0° | 180.0° |
| FAE | CAA | FAG | CAH | 120.0° | 120.1° |
| FAE | CAA | FAG | FAF | 121.2° | 119.9° |
| FAE | CAA | CAH | FAF | 119.5° | 120.0° |
| FAE | CAA | CAH | OAJ | 60.7° | 60.0° |
| FAE | CAA | CAH | CAB | 178.4° | 60.0° |
| FAG | CAA | CAH | FAF | 120.8° | 120.0° |
| FAG | CAA | CAH | OAJ | 179.7° | 180.0° |
| FAG | CAA | CAH | CAB | 58.8° | 60.0° |
| CAA | CAH | OAJ | CAB | 122.2° | 120.0° |
| CAA | CAH | CAB | OAD | 101.6° | 125.0° |
| CAA | CAH | CAB | OAC | 73.2° | 55.0° |
| CAA | CAH | OAI | H2 | 114.3° | 60.0° |
| CAA | CAH | OAJ | H3 | 62.5° | 59.9° |
| FAF | CAA | CAH | OAJ | 58.9° | 60.0° |
| FAF | CAA | CAH | CAB | 62.0° | 180.0° |
| OAJ | CAH | CAB | OAD | 139.5° | 115.0° |
| OAJ | CAH | CAB | OAC | 45.7° | 65.1° |
| OAJ | CAH | OAI | H2 | 129.7° | 180.0° |
| CAH | CAB | OAD | OAC | 174.6° | 180.0° |
| CAH | CAB | OAC | H1 | 174.5° | 180.0° |
| CAB | CAH | OAI | H2 | 9.2° | 60.0° |
| CAB | CAH | OAJ | H3 | 59.7° | 60.1° |
| OAD | CAB | OAC | H1 | 0.0° | 0.0° |
