QT8
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAA | CAE | doub | 1.21Å | 1.21Å | |
| CAG | CAD | sing | 1.53Å | 1.47Å | |
| CAE | CAD | sing | 1.51Å | 1.56Å | |
| CAE | CAF | sing | 1.51Å | 1.51Å | |
| OAC | CAH | doub | 1.21Å | 1.26Å | |
| CAF | CAH | sing | 1.51Å | 1.51Å | |
| CAH | OAB | sing | 1.34Å | 1.26Å | |
| OAB | H1 | sing | 0.97Å | 0.95Å | |
| CAF | H2 | sing | 1.09Å | 1.10Å | |
| CAF | H3 | sing | 1.09Å | 1.10Å | |
| CAD | H4 | sing | 1.09Å | 1.10Å | |
| CAD | H5 | sing | 1.09Å | 1.10Å | |
| CAG | H6 | sing | 1.09Å | 1.10Å | |
| CAG | H7 | sing | 1.09Å | 1.10Å | |
| CAG | H8 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAA | CAE | CAD | 122.3° | 120.0° |
| OAA | CAE | CAF | 121.1° | 120.0° |
| CAG | CAD | CAE | 108.7° | 109.5° |
| CAG | CAD | H4 | 109.7° | 109.4° |
| CAG | CAD | H5 | 109.7° | 109.4° |
| CAD | CAG | H6 | 109.5° | 109.5° |
| CAD | CAG | H7 | 109.5° | 109.5° |
| CAD | CAG | H8 | 109.5° | 109.5° |
| CAD | CAE | CAF | 116.5° | 120.0° |
| CAE | CAD | H4 | 109.7° | 109.5° |
| CAE | CAD | H5 | 109.7° | 109.5° |
| CAE | CAF | CAH | 106.4° | 109.5° |
| CAE | CAF | H2 | 110.3° | 109.5° |
| CAE | CAF | H3 | 110.2° | 109.5° |
| OAC | CAH | CAF | 117.1° | 120.0° |
| OAC | CAH | OAB | 126.5° | 120.0° |
| CAF | CAH | OAB | 115.7° | 120.0° |
| CAH | CAF | H2 | 110.2° | 109.5° |
| CAH | CAF | H3 | 110.3° | 109.5° |
| CAH | OAB | H1 | 109.5° | 117.0° |
| H2 | CAF | H3 | 109.5° | 109.4° |
| H4 | CAD | H5 | 109.5° | 109.5° |
| H6 | CAG | H7 | 109.5° | 109.4° |
| H6 | CAG | H8 | 109.5° | 109.5° |
| H7 | CAG | H8 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAA | CAE | CAD | CAG | 38.3° | 0.0° |
| OAA | CAE | CAD | CAF | 177.8° | 180.0° |
| OAA | CAE | CAF | CAH | 122.0° | 0.0° |
| OAA | CAE | CAF | H2 | 2.5° | 120.0° |
| OAA | CAE | CAF | H3 | 118.5° | 120.0° |
| OAA | CAE | CAD | H4 | 81.6° | 120.0° |
| OAA | CAE | CAD | H5 | 158.2° | 120.0° |
| CAG | CAD | CAE | H4 | 119.9° | 120.0° |
| CAG | CAD | CAE | H5 | 119.9° | 120.0° |
| CAG | CAD | CAE | CAF | 143.9° | 180.0° |
| CAG | CAD | H4 | H5 | 120.3° | 120.0° |
| CAD | CAG | H6 | H7 | 120.0° | 120.0° |
| CAD | CAG | H6 | H8 | 120.0° | 120.1° |
| CAD | CAG | H7 | H8 | 120.0° | 120.1° |
| CAD | CAE | CAF | CAH | 60.2° | 180.0° |
| CAD | CAE | CAF | H2 | 179.7° | 60.0° |
| CAD | CAE | CAF | H3 | 59.3° | 60.0° |
| CAE | CAD | H4 | H5 | 120.4° | 120.0° |
| CAE | CAD | CAG | H6 | 180.0° | 60.0° |
| CAE | CAD | CAG | H7 | 60.0° | 60.0° |
| CAE | CAD | CAG | H8 | 60.0° | 180.0° |
| CAE | CAF | CAH | OAC | 28.5° | 0.0° |
| CAE | CAF | CAH | H2 | 119.5° | 120.0° |
| CAE | CAF | CAH | H3 | 119.5° | 120.0° |
| CAE | CAF | CAH | OAB | 160.7° | 180.0° |
| CAE | CAF | H2 | H3 | 121.4° | 120.0° |
| CAF | CAE | CAD | H4 | 96.2° | 60.0° |
| CAF | CAE | CAD | H5 | 24.0° | 60.0° |
| OAC | CAH | CAF | OAB | 170.7° | 180.0° |
| OAC | CAH | OAB | H1 | 0.0° | 0.0° |
| OAC | CAH | CAF | H2 | 91.0° | 120.0° |
| OAC | CAH | CAF | H3 | 148.1° | 120.0° |
| CAF | CAH | OAB | H1 | 169.7° | 180.0° |
| CAH | CAF | H2 | H3 | 121.4° | 120.0° |
| OAB | CAH | CAF | H2 | 79.7° | 60.0° |
| OAB | CAH | CAF | H3 | 41.2° | 60.0° |
| H4 | CAD | CAG | H6 | 60.1° | 180.0° |
| H4 | CAD | CAG | H7 | 59.9° | 60.0° |
| H4 | CAD | CAG | H8 | 179.9° | 60.0° |
| H5 | CAD | CAG | H6 | 60.1° | 60.0° |
| H5 | CAD | CAG | H7 | 179.9° | 180.0° |
| H5 | CAD | CAG | H8 | 59.9° | 60.0° |
| H6 | CAG | H7 | H8 | 120.0° | 120.0° |
