9O0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAC | CAH | sing | 1.43Å | 1.45Å | |
| FAA | CAD | sing | 1.40Å | 1.24Å | |
| FAI | CAD | sing | 1.40Å | 1.32Å | |
| CAH | CAD | sing | 1.53Å | 1.51Å | |
| CAH | CAG | sing | 1.51Å | 1.46Å | |
| CAD | FAB | sing | 1.40Å | 1.53Å | |
| OAF | CAG | doub | 1.21Å | 1.26Å | |
| CAG | OAE | sing | 1.34Å | 1.33Å | |
| OAE | H1 | sing | 0.97Å | 0.95Å | |
| CAH | H2 | sing | 1.09Å | 1.10Å | |
| OAC | H3 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAC | CAH | CAD | 109.8° | 109.5° |
| OAC | CAH | CAG | 114.6° | 109.4° |
| OAC | CAH | H2 | 108.9° | 109.5° |
| CAH | OAC | H3 | 109.5° | 114.0° |
| FAA | CAD | FAI | 106.6° | 109.5° |
| FAA | CAD | CAH | 108.5° | 109.5° |
| FAA | CAD | FAB | 113.9° | 109.5° |
| FAI | CAD | CAH | 111.0° | 109.4° |
| FAI | CAD | FAB | 115.0° | 109.5° |
| CAD | CAH | CAG | 106.4° | 109.5° |
| CAH | CAD | FAB | 101.8° | 109.4° |
| CAD | CAH | H2 | 108.1° | 109.5° |
| CAH | CAG | OAF | 113.7° | 120.0° |
| CAH | CAG | OAE | 121.5° | 120.0° |
| CAG | CAH | H2 | 108.7° | 109.5° |
| OAF | CAG | OAE | 124.8° | 120.0° |
| CAG | OAE | H1 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAC | CAH | CAD | FAA | 45.5° | 60.0° |
| OAC | CAH | CAD | FAI | 71.3° | 60.1° |
| OAC | CAH | CAD | CAG | 124.6° | 120.0° |
| OAC | CAH | CAD | H2 | 118.8° | 120.0° |
| OAC | CAH | CAG | H2 | 122.1° | 120.0° |
| OAC | CAH | CAD | FAB | 165.9° | 180.0° |
| OAC | CAH | CAG | OAF | 1.0° | 5.0° |
| OAC | CAH | CAG | OAE | 178.9° | 175.0° |
| FAA | CAD | FAI | CAH | 117.9° | 120.0° |
| FAA | CAD | FAI | FAB | 127.2° | 120.1° |
| FAA | CAD | CAH | FAB | 120.4° | 120.0° |
| FAA | CAD | CAH | CAG | 170.1° | 60.0° |
| FAA | CAD | CAH | H2 | 73.2° | 180.0° |
| FAI | CAD | CAH | FAB | 122.8° | 120.0° |
| FAI | CAD | CAH | CAG | 53.3° | 180.0° |
| FAI | CAD | CAH | H2 | 169.9° | 60.0° |
| CAD | CAH | CAG | H2 | 116.3° | 120.0° |
| CAD | CAH | CAG | OAF | 122.6° | 115.0° |
| CAD | CAH | CAG | OAE | 57.3° | 65.1° |
| CAD | CAH | OAC | H3 | 120.3° | 60.0° |
| CAG | CAH | CAD | FAB | 69.5° | 60.0° |
| CAH | CAG | OAF | OAE | 179.9° | 179.9° |
| CAH | CAG | OAE | H1 | 180.0° | 180.0° |
| CAG | CAH | OAC | H3 | 0.5° | 60.0° |
| FAB | CAD | CAH | H2 | 47.1° | 60.0° |
| OAF | CAG | OAE | H1 | 0.0° | 0.1° |
| OAF | CAG | CAH | H2 | 121.1° | 125.0° |
| OAE | CAG | CAH | H2 | 58.9° | 55.0° |
| H2 | CAH | OAC | H3 | 121.5° | 180.0° |
