61G
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CAA | CAD | doub | 1.33Å | 1.49Å | |
| CAC | CAE | sing | 1.51Å | 1.52Å | |
| CAD | CAE | sing | 1.47Å | 1.48Å | |
| CAE | CAB | doub | 1.33Å | 1.51Å | |
| CAC | H1 | sing | 1.09Å | 1.10Å | |
| CAC | H2 | sing | 1.09Å | 1.10Å | |
| CAC | H3 | sing | 1.09Å | 1.10Å | |
| CAB | H5 | sing | 1.08Å | 1.08Å | |
| CAB | H6 | sing | 1.08Å | 1.08Å | |
| CAD | H8 | sing | 1.08Å | 1.08Å | |
| CAA | H10 | sing | 1.08Å | 1.08Å | |
| CAA | H11 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CAA | CAD | CAE | 113.9° | 120.0° |
| CAA | CAD | H8 | 123.0° | 120.0° |
| CAD | CAA | H10 | 120.0° | 120.0° |
| CAD | CAA | H11 | 120.0° | 120.0° |
| CAC | CAE | CAD | 119.9° | 120.0° |
| CAC | CAE | CAB | 121.4° | 120.0° |
| CAE | CAC | H1 | 109.5° | 109.5° |
| CAE | CAC | H2 | 109.4° | 109.5° |
| CAE | CAC | H3 | 109.5° | 109.5° |
| CAD | CAE | CAB | 118.7° | 120.1° |
| CAE | CAD | H8 | 123.0° | 119.9° |
| CAE | CAB | H5 | 120.0° | 120.0° |
| CAE | CAB | H6 | 120.0° | 120.0° |
| H1 | CAC | H2 | 109.5° | 109.5° |
| H1 | CAC | H3 | 109.5° | 109.5° |
| H2 | CAC | H3 | 109.5° | 109.5° |
| H5 | CAB | H6 | 119.9° | 120.0° |
| H10 | CAA | H11 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CAA | CAD | CAE | CAC | 0.1° | 0.0° |
| CAA | CAD | CAE | H8 | 180.0° | 180.0° |
| CAA | CAD | CAE | CAB | 179.8° | 180.0° |
| CAD | CAA | H10 | H11 | 180.0° | 180.0° |
| CAC | CAE | CAD | CAB | 179.7° | 180.0° |
| CAE | CAC | H1 | H2 | 120.0° | 120.0° |
| CAE | CAC | H1 | H3 | 120.0° | 120.0° |
| CAE | CAC | H2 | H3 | 120.0° | 120.0° |
| CAC | CAE | CAB | H5 | 179.7° | 180.0° |
| CAC | CAE | CAB | H6 | 0.3° | 0.0° |
| CAC | CAE | CAD | H8 | 179.9° | 180.0° |
| CAD | CAE | CAC | H1 | 180.0° | 180.0° |
| CAD | CAE | CAC | H2 | 60.0° | 60.0° |
| CAD | CAE | CAC | H3 | 60.0° | 60.0° |
| CAD | CAE | CAB | H5 | 0.0° | 0.0° |
| CAD | CAE | CAB | H6 | 180.0° | 180.0° |
| CAE | CAD | CAA | H10 | 180.0° | 0.0° |
| CAE | CAD | CAA | H11 | 0.0° | 180.0° |
| CAB | CAE | CAC | H1 | 0.3° | 0.0° |
| CAB | CAE | CAC | H2 | 119.7° | 120.0° |
| CAB | CAE | CAC | H3 | 120.3° | 120.0° |
| CAE | CAB | H5 | H6 | 180.0° | 180.0° |
| CAB | CAE | CAD | H8 | 0.2° | 0.0° |
| H1 | CAC | H2 | H3 | 120.0° | 120.0° |
| H8 | CAD | CAA | H10 | 0.0° | 180.0° |
| H8 | CAD | CAA | H11 | 180.0° | 0.0° |
