Q6T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAA | C10 | sing | 1.35Å | 1.28Å | |
| OAB | C10 | doub | 1.22Å | 1.28Å | |
| CAJ | CAE | doub | 1.39Å | 1.37Å | Aromatic |
| CAJ | CAC | sing | 1.38Å | 1.38Å | Aromatic |
| CAE | CAL | sing | 1.38Å | 1.38Å | Aromatic |
| CAL | OAH | sing | 1.37Å | 1.41Å | |
| CAL | CAK | doub | 1.39Å | 1.36Å | Aromatic |
| OAH | CAF | sing | 1.44Å | 1.44Å | |
| CAF | OAG | sing | 1.44Å | 1.40Å | |
| OAG | CAK | sing | 1.36Å | 1.38Å | |
| CAK | CAD | sing | 1.40Å | 1.40Å | Aromatic |
| CAD | CAC | doub | 1.40Å | 1.39Å | Aromatic |
| CAD | C10 | sing | 1.47Å | 1.49Å | |
| OAA | HAA | sing | 0.97Å | 0.95Å | |
| CAJ | HAJ | sing | 1.08Å | 1.08Å | |
| CAE | HAE | sing | 1.08Å | 1.08Å | |
| CAC | HAC | sing | 1.08Å | 1.08Å | |
| CAF | HAF1 | sing | 1.09Å | 1.10Å | |
| CAF | HAF2 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAA | C10 | OAB | 127.8° | 120.0° |
| OAA | C10 | CAD | 116.6° | 120.0° |
| C10 | OAA | HAA | 109.5° | 117.0° |
| OAB | C10 | CAD | 115.6° | 120.0° |
| CAE | CAJ | CAC | 119.5° | 120.3° |
| CAJ | CAE | CAL | 119.9° | 120.4° |
| CAE | CAJ | HAJ | 120.3° | 119.8° |
| CAJ | CAE | HAE | 120.0° | 119.8° |
| CAJ | CAC | CAD | 121.8° | 120.0° |
| CAC | CAJ | HAJ | 120.3° | 119.8° |
| CAJ | CAC | HAC | 119.1° | 120.0° |
| CAE | CAL | OAH | 126.3° | 131.5° |
| CAE | CAL | CAK | 120.6° | 120.0° |
| CAL | CAE | HAE | 120.1° | 119.8° |
| OAH | CAL | CAK | 113.1° | 108.6° |
| CAL | OAH | CAF | 99.8° | 105.4° |
| CAL | CAK | OAG | 108.4° | 108.7° |
| CAL | CAK | CAD | 120.9° | 119.7° |
| OAH | CAF | OAG | 111.9° | 103.7° |
| OAH | CAF | HAF1 | 108.8° | 110.6° |
| OAH | CAF | HAF2 | 108.9° | 110.6° |
| CAF | OAG | CAK | 104.9° | 105.6° |
| OAG | CAF | HAF1 | 108.9° | 110.6° |
| OAG | CAF | HAF2 | 108.9° | 110.6° |
| OAG | CAK | CAD | 130.7° | 131.6° |
| CAK | CAD | CAC | 117.3° | 119.7° |
| CAK | CAD | C10 | 126.5° | 120.2° |
| CAC | CAD | C10 | 116.2° | 120.2° |
| CAD | CAC | HAC | 119.1° | 120.0° |
| HAF1 | CAF | HAF2 | 109.5° | 110.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAA | C10 | OAB | CAD | 177.9° | 179.9° |
| OAA | C10 | CAD | CAK | 1.9° | 179.8° |
| OAA | C10 | CAD | CAC | 179.4° | 0.0° |
| OAB | C10 | CAD | CAK | 176.2° | 0.3° |
| OAB | C10 | CAD | CAC | 2.5° | 180.0° |
| OAB | C10 | OAA | HAA | 0.0° | 0.0° |
| CAE | CAJ | CAC | HAJ | 180.0° | 180.0° |
| CAJ | CAE | CAL | HAE | 180.0° | 180.0° |
| CAJ | CAE | CAL | OAH | 178.3° | 180.0° |
| CAJ | CAE | CAL | CAK | 0.1° | 0.0° |
| CAE | CAJ | CAC | CAD | 1.0° | 0.0° |
| CAE | CAJ | CAC | HAC | 179.0° | 179.7° |
| CAC | CAJ | CAE | CAL | 1.0° | 0.0° |
| CAJ | CAC | CAD | CAK | 0.1° | 0.0° |
| CAJ | CAC | CAD | HAC | 180.0° | 179.7° |
| CAJ | CAC | CAD | C10 | 178.8° | 179.7° |
| CAC | CAJ | CAE | HAE | 179.0° | 180.0° |
| CAE | CAL | OAH | CAK | 178.3° | 180.0° |
| CAE | CAL | OAH | CAF | 171.4° | 162.7° |
| CAE | CAL | CAK | OAG | 179.6° | 180.0° |
| CAE | CAL | CAK | CAD | 0.9° | 0.0° |
| CAL | CAE | CAJ | HAJ | 179.0° | 180.0° |
| CAL | OAH | CAF | OAG | 12.8° | 27.1° |
| OAH | CAL | CAK | OAG | 1.1° | 0.0° |
| OAH | CAL | CAK | CAD | 177.6° | 180.0° |
| OAH | CAL | CAE | HAE | 1.7° | 0.0° |
| CAL | OAH | CAF | HAF1 | 133.2° | 91.5° |
| CAL | OAH | CAF | HAF2 | 107.5° | 145.6° |
| CAK | CAL | OAH | CAF | 7.0° | 17.3° |
| CAL | CAK | OAG | CAF | 9.0° | 17.3° |
| CAL | CAK | OAG | CAD | 178.5° | 180.0° |
| CAL | CAK | CAD | CAC | 0.9° | 0.0° |
| CAL | CAK | CAD | C10 | 179.6° | 179.7° |
| CAK | CAL | CAE | HAE | 179.9° | 180.0° |
| OAH | CAF | OAG | HAF1 | 120.4° | 118.5° |
| OAH | CAF | OAG | HAF2 | 120.4° | 118.6° |
| OAH | CAF | OAG | CAK | 14.1° | 27.1° |
| OAH | CAF | HAF1 | HAF2 | 118.9° | 122.9° |
| CAF | OAG | CAK | CAD | 169.5° | 162.7° |
| OAG | CAF | HAF1 | HAF2 | 118.9° | 122.9° |
| OAG | CAK | CAD | CAC | 179.2° | 180.0° |
| OAG | CAK | CAD | C10 | 2.0° | 0.2° |
| CAK | OAG | CAF | HAF1 | 134.5° | 91.4° |
| CAK | OAG | CAF | HAF2 | 106.2° | 145.7° |
| CAK | CAD | CAC | C10 | 178.9° | 179.7° |
| CAK | CAD | CAC | HAC | 179.9° | 179.7° |
| CAD | CAC | CAJ | HAJ | 179.0° | 180.0° |
| CAD | C10 | OAA | HAA | 177.9° | 180.0° |
| C10 | CAD | CAC | HAC | 1.2° | 0.0° |
| HAJ | CAJ | CAE | HAE | 1.0° | 0.0° |
| HAJ | CAJ | CAC | HAC | 1.0° | 0.2° |
