9DC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAE | CAD | sing | 1.43Å | 1.40Å | |
| SAA | CAB | sing | 1.81Å | 1.82Å | |
| CAB | CAC | sing | 1.53Å | 1.53Å | |
| CAC | CAD | sing | 1.53Å | 1.53Å | |
| CAC | SAF | sing | 1.81Å | 1.81Å | |
| OAE | H1 | sing | 0.97Å | 0.95Å | |
| CAD | H2 | sing | 1.09Å | 1.10Å | |
| CAD | H3 | sing | 1.09Å | 1.10Å | |
| CAC | H4 | sing | 1.09Å | 1.10Å | |
| SAF | H5 | sing | 1.35Å | 1.30Å | |
| CAB | H6 | sing | 1.09Å | 1.10Å | |
| CAB | H7 | sing | 1.09Å | 1.10Å | |
| SAA | H8 | sing | 1.35Å | 1.30Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAE | CAD | CAC | 106.4° | 109.5° |
| CAD | OAE | H1 | 109.5° | 114.0° |
| OAE | CAD | H2 | 110.2° | 109.4° |
| OAE | CAD | H3 | 110.2° | 109.5° |
| SAA | CAB | CAC | 114.6° | 109.5° |
| SAA | CAB | H6 | 108.2° | 109.5° |
| SAA | CAB | H7 | 108.2° | 109.5° |
| CAB | SAA | H8 | 102.0° | 103.0° |
| CAB | CAC | CAD | 108.8° | 109.5° |
| CAB | CAC | SAF | 110.4° | 109.5° |
| CAB | CAC | H4 | 110.6° | 109.4° |
| CAC | CAB | H6 | 108.2° | 109.5° |
| CAC | CAB | H7 | 108.2° | 109.5° |
| CAD | CAC | SAF | 109.3° | 109.5° |
| CAC | CAD | H2 | 110.2° | 109.5° |
| CAC | CAD | H3 | 110.3° | 109.5° |
| CAD | CAC | H4 | 110.6° | 109.5° |
| SAF | CAC | H4 | 107.2° | 109.5° |
| CAC | SAF | H5 | 102.0° | 103.0° |
| H2 | CAD | H3 | 109.5° | 109.5° |
| H6 | CAB | H7 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAE | CAD | CAC | CAB | 73.6° | 55.0° |
| OAE | CAD | CAC | H2 | 119.5° | 120.0° |
| OAE | CAD | CAC | H3 | 119.5° | 120.0° |
| OAE | CAD | CAC | SAF | 165.8° | 175.0° |
| OAE | CAD | H2 | H3 | 121.4° | 120.0° |
| OAE | CAD | CAC | H4 | 48.1° | 65.0° |
| SAA | CAB | CAC | H6 | 120.8° | 120.0° |
| SAA | CAB | CAC | H7 | 120.8° | 120.0° |
| SAA | CAB | CAC | CAD | 177.7° | 180.0° |
| SAA | CAB | CAC | SAF | 57.9° | 60.0° |
| SAA | CAB | CAC | H4 | 60.6° | 60.0° |
| SAA | CAB | H6 | H7 | 117.6° | 120.0° |
| CAB | CAC | CAD | SAF | 120.6° | 120.0° |
| CAB | CAC | CAD | H4 | 121.6° | 119.9° |
| CAB | CAC | SAF | H4 | 120.5° | 120.0° |
| CAB | CAC | CAD | H2 | 45.9° | 65.0° |
| CAB | CAC | CAD | H3 | 166.9° | 175.0° |
| CAB | CAC | SAF | H5 | 180.0° | 60.0° |
| CAC | CAB | H6 | H7 | 117.6° | 120.0° |
| CAC | CAB | SAA | H8 | 180.0° | 180.0° |
| CAD | CAC | SAF | H4 | 119.8° | 120.0° |
| CAC | CAD | OAE | H1 | 180.0° | 180.0° |
| CAC | CAD | H2 | H3 | 121.5° | 120.0° |
| CAD | CAC | SAF | H5 | 60.4° | 60.0° |
| CAD | CAC | CAB | H6 | 57.0° | 60.0° |
| CAD | CAC | CAB | H7 | 61.5° | 60.0° |
| SAF | CAC | CAD | H2 | 74.7° | 55.0° |
| SAF | CAC | CAD | H3 | 46.3° | 65.0° |
| SAF | CAC | CAB | H6 | 62.9° | 180.0° |
| SAF | CAC | CAB | H7 | 178.6° | 60.0° |
| H1 | OAE | CAD | H2 | 60.5° | 60.0° |
| H1 | OAE | CAD | H3 | 60.5° | 60.0° |
| H2 | CAD | CAC | H4 | 167.6° | 175.1° |
| H3 | CAD | CAC | H4 | 71.4° | 55.0° |
| H4 | CAC | SAF | H5 | 59.4° | 180.0° |
| H4 | CAC | CAB | H6 | 178.6° | 59.9° |
| H4 | CAC | CAB | H7 | 60.1° | 180.0° |
| H6 | CAB | SAA | H8 | 59.2° | 60.0° |
| H7 | CAB | SAA | H8 | 59.2° | 60.0° |
