SA9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAA | CAG | sing | 1.43Å | 1.43Å | |
| OAB | CAH | sing | 1.36Å | 1.37Å | |
| CAC | CAD | doub | 1.38Å | 1.40Å | Aromatic |
| CAC | CAE | sing | 1.38Å | 1.39Å | Aromatic |
| CAD | CAF | sing | 1.38Å | 1.39Å | Aromatic |
| CAE | CAH | doub | 1.39Å | 1.40Å | Aromatic |
| CAF | CAI | doub | 1.38Å | 1.40Å | Aromatic |
| CAG | CAI | sing | 1.51Å | 1.52Å | |
| CAH | CAI | sing | 1.39Å | 1.40Å | Aromatic |
| OAA | HOAA | sing | 0.97Å | 0.95Å | |
| OAB | HOAB | sing | 0.97Å | 0.95Å | |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CAD | HAD | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAF | HAF | sing | 1.08Å | 1.08Å | |
| CAG | HAG | sing | 1.09Å | 1.10Å | |
| CAG | HAGA | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAA | CAG | CAI | 115.7° | 109.5° |
| CAG | OAA | HOAA | 109.5° | 114.0° |
| OAA | CAG | HAG | 107.4° | 109.5° |
| OAA | CAG | HAGA | 107.4° | 109.5° |
| OAB | CAH | CAE | 118.0° | 120.1° |
| OAB | CAH | CAI | 121.1° | 120.1° |
| CAH | OAB | HOAB | 109.5° | 114.0° |
| CAD | CAC | CAE | 119.5° | 120.1° |
| CAC | CAD | CAF | 120.3° | 120.1° |
| CAD | CAC | HAC | 120.2° | 120.0° |
| CAC | CAD | HAD | 119.8° | 119.9° |
| CAC | CAE | CAH | 119.9° | 120.0° |
| CAE | CAC | HAC | 120.3° | 119.9° |
| CAC | CAE | HAE | 120.1° | 120.1° |
| CAD | CAF | CAI | 120.6° | 120.1° |
| CAF | CAD | HAD | 119.8° | 120.0° |
| CAD | CAF | HAF | 119.7° | 120.0° |
| CAE | CAH | CAI | 120.9° | 119.9° |
| CAH | CAE | HAE | 120.0° | 120.0° |
| CAF | CAI | CAG | 118.9° | 120.1° |
| CAF | CAI | CAH | 118.8° | 119.9° |
| CAI | CAF | HAF | 119.7° | 119.9° |
| CAG | CAI | CAH | 122.3° | 120.0° |
| CAI | CAG | HAG | 107.4° | 109.5° |
| CAI | CAG | HAGA | 107.5° | 109.5° |
| HAG | CAG | HAGA | 111.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAA | CAG | CAI | CAF | 84.1° | 0.0° |
| OAA | CAG | CAI | HAG | 120.0° | 120.0° |
| OAA | CAG | CAI | HAGA | 120.0° | 120.1° |
| OAA | CAG | CAI | CAH | 98.0° | 180.0° |
| OAA | CAG | HAG | HAGA | 117.4° | 120.0° |
| OAB | CAH | CAE | CAC | 179.4° | 180.0° |
| OAB | CAH | CAE | CAI | 179.3° | 180.0° |
| OAB | CAH | CAI | CAF | 179.7° | 180.0° |
| OAB | CAH | CAI | CAG | 2.4° | 0.0° |
| OAB | CAH | CAE | HAE | 0.6° | 0.0° |
| CAD | CAC | CAE | HAC | 180.0° | 179.8° |
| CAC | CAD | CAF | HAD | 180.0° | 179.9° |
| CAD | CAC | CAE | CAH | 0.5° | 0.0° |
| CAC | CAD | CAF | CAI | 0.3° | 0.0° |
| CAD | CAC | CAE | HAE | 179.6° | 180.0° |
| CAC | CAD | CAF | HAF | 179.7° | 180.0° |
| CAE | CAC | CAD | CAF | 0.7° | 0.0° |
| CAC | CAE | CAH | HAE | 180.0° | 180.0° |
| CAC | CAE | CAH | CAI | 0.1° | 0.0° |
| CAE | CAC | CAD | HAD | 179.3° | 180.0° |
| CAD | CAF | CAI | HAF | 180.0° | 180.0° |
| CAD | CAF | CAI | CAG | 178.2° | 180.0° |
| CAD | CAF | CAI | CAH | 0.2° | 0.0° |
| CAF | CAD | CAC | HAC | 179.4° | 179.8° |
| CAE | CAH | CAI | CAF | 0.4° | 0.0° |
| CAE | CAH | CAI | CAG | 178.3° | 180.0° |
| CAE | CAH | OAB | HOAB | 180.0° | 90.0° |
| CAH | CAE | CAC | HAC | 179.6° | 179.8° |
| CAF | CAI | CAG | CAH | 177.9° | 180.0° |
| CAI | CAF | CAD | HAD | 179.7° | 180.0° |
| CAF | CAI | CAG | HAG | 155.9° | 120.0° |
| CAF | CAI | CAG | HAGA | 35.9° | 120.0° |
| CAI | CAG | OAA | HOAA | 180.0° | 180.0° |
| CAG | CAI | CAF | HAF | 1.8° | 0.0° |
| CAI | CAG | HAG | HAGA | 117.5° | 120.0° |
| CAI | CAH | OAB | HOAB | 0.7° | 90.0° |
| CAI | CAH | CAE | HAE | 179.9° | 180.0° |
| CAH | CAI | CAF | HAF | 179.8° | 180.0° |
| CAH | CAI | CAG | HAG | 22.0° | 60.0° |
| CAH | CAI | CAG | HAGA | 142.0° | 60.0° |
| HOAA | OAA | CAG | HAG | 60.0° | 60.0° |
| HOAA | OAA | CAG | HAGA | 60.1° | 59.9° |
| HAC | CAC | CAD | HAD | 0.6° | 0.3° |
| HAC | CAC | CAE | HAE | 0.4° | 0.2° |
| HAD | CAD | CAF | HAF | 0.3° | 0.1° |
