TMO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | NAC | sing | 1.47Å | 1.47Å | |
| CAA | HAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAA | sing | 1.09Å | 1.10Å | |
| CAA | HAAB | sing | 1.09Å | 1.10Å | |
| NAC | CAD | sing | 1.47Å | 1.47Å | |
| NAC | CAB | sing | 1.47Å | 1.47Å | |
| NAC | OAE | sing | 1.46Å | 1.46Å | |
| CAD | HAD | sing | 1.09Å | 1.10Å | |
| CAD | HADA | sing | 1.09Å | 1.10Å | |
| CAD | HADB | sing | 1.09Å | 1.10Å | |
| CAB | HAB | sing | 1.09Å | 1.10Å | |
| CAB | HABA | sing | 1.09Å | 1.10Å | |
| CAB | HABB | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| NAC | CAA | HAA | 109.5° | 109.5° |
| NAC | CAA | HAAA | 109.5° | 109.4° |
| NAC | CAA | HAAB | 109.5° | 109.5° |
| CAA | NAC | CAD | 109.5° | 109.4° |
| CAA | NAC | CAB | 109.4° | 109.5° |
| CAA | NAC | OAE | 109.4° | 109.5° |
| HAA | CAA | HAAA | 109.5° | 109.5° |
| HAA | CAA | HAAB | 109.5° | 109.5° |
| HAAA | CAA | HAAB | 109.5° | 109.5° |
| CAD | NAC | CAB | 109.4° | 109.5° |
| CAD | NAC | OAE | 109.6° | 109.5° |
| NAC | CAD | HAD | 109.5° | 109.5° |
| NAC | CAD | HADA | 109.5° | 109.5° |
| NAC | CAD | HADB | 109.5° | 109.5° |
| CAB | NAC | OAE | 109.5° | 109.5° |
| NAC | CAB | HAB | 109.5° | 109.4° |
| NAC | CAB | HABA | 109.5° | 109.4° |
| NAC | CAB | HABB | 109.5° | 109.5° |
| HAD | CAD | HADA | 109.4° | 109.5° |
| HAD | CAD | HADB | 109.4° | 109.5° |
| HADA | CAD | HADB | 109.5° | 109.4° |
| HAB | CAB | HABA | 109.5° | 109.4° |
| HAB | CAB | HABB | 109.4° | 109.5° |
| HABA | CAB | HABB | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| NAC | CAA | HAA | HAAA | 120.0° | 119.9° |
| NAC | CAA | HAA | HAAB | 120.0° | 120.0° |
| NAC | CAA | HAAA | HAAB | 120.0° | 120.0° |
| CAA | NAC | CAD | CAB | 119.9° | 120.0° |
| CAA | NAC | CAD | OAE | 120.0° | 120.0° |
| CAA | NAC | CAB | OAE | 119.9° | 120.0° |
| CAA | NAC | CAD | HAD | 180.0° | 60.0° |
| CAA | NAC | CAD | HADA | 60.0° | 180.0° |
| CAA | NAC | CAD | HADB | 60.0° | 60.0° |
| CAA | NAC | CAB | HAB | 180.0° | 60.1° |
| CAA | NAC | CAB | HABA | 60.0° | 180.0° |
| CAA | NAC | CAB | HABB | 60.0° | 60.0° |
| HAA | CAA | HAAA | HAAB | 120.0° | 120.1° |
| HAA | CAA | NAC | CAD | 180.0° | 60.0° |
| HAA | CAA | NAC | CAB | 60.1° | 180.0° |
| HAA | CAA | NAC | OAE | 59.9° | 60.0° |
| HAAA | CAA | NAC | CAD | 60.0° | 180.0° |
| HAAA | CAA | NAC | CAB | 59.9° | 60.0° |
| HAAA | CAA | NAC | OAE | 179.8° | 60.0° |
| HAAB | CAA | NAC | CAD | 60.0° | 60.0° |
| HAAB | CAA | NAC | CAB | 179.9° | 60.0° |
| HAAB | CAA | NAC | OAE | 60.2° | NaN° |
| CAD | NAC | CAB | OAE | 120.1° | 120.0° |
| NAC | CAD | HAD | HADA | 120.0° | 120.0° |
| NAC | CAD | HAD | HADB | 120.0° | 120.0° |
| NAC | CAD | HADA | HADB | 120.0° | 119.9° |
| CAD | NAC | CAB | HAB | 60.1° | 180.0° |
| CAD | NAC | CAB | HABA | 59.9° | 60.0° |
| CAD | NAC | CAB | HABB | 179.9° | 60.0° |
| CAB | NAC | CAD | HAD | 60.1° | 60.0° |
| CAB | NAC | CAD | HADA | 179.9° | 60.0° |
| CAB | NAC | CAD | HADB | 59.9° | 180.0° |
| NAC | CAB | HAB | HABA | 120.0° | 119.9° |
| NAC | CAB | HAB | HABB | 120.0° | 120.0° |
| NAC | CAB | HABA | HABB | 120.0° | 120.0° |
| OAE | NAC | CAD | HAD | 60.0° | 180.0° |
| OAE | NAC | CAD | HADA | 60.0° | 60.0° |
| OAE | NAC | CAD | HADB | 179.9° | 60.0° |
| OAE | NAC | CAB | HAB | 60.1° | 60.0° |
| OAE | NAC | CAB | HABA | 179.9° | 60.0° |
| OAE | NAC | CAB | HABB | 59.9° | 180.0° |
| HAD | CAD | HADA | HADB | 119.9° | 120.0° |
| HAB | CAB | HABA | HABB | 120.0° | 120.1° |
