MU6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| OAF | CAB | doub | 1.21Å | 1.26Å | |
| CAB | OAA | sing | 1.34Å | 1.25Å | |
| CAB | CAC | sing | 1.51Å | 1.53Å | |
| OAE | CAD | doub | 1.21Å | 1.26Å | |
| CAH | CAC | sing | 1.53Å | 1.54Å | |
| CAC | CAD | sing | 1.51Å | 1.52Å | |
| CAC | CAI | sing | 1.53Å | 1.53Å | |
| CAD | OAG | sing | 1.34Å | 1.26Å | |
| CAH | H1 | sing | 1.09Å | 1.10Å | |
| CAH | H2 | sing | 1.09Å | 1.10Å | |
| CAH | H3 | sing | 1.09Å | 1.10Å | |
| CAI | H4 | sing | 1.09Å | 1.10Å | |
| CAI | H5 | sing | 1.09Å | 1.10Å | |
| CAI | H6 | sing | 1.09Å | 1.10Å | |
| OAA | H7 | sing | 0.97Å | 0.95Å | |
| OAG | H8 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| OAF | CAB | OAA | 119.1° | 120.0° |
| OAF | CAB | CAC | 121.9° | 120.0° |
| OAA | CAB | CAC | 119.0° | 120.0° |
| CAB | OAA | H7 | 109.5° | 117.0° |
| CAB | CAC | CAH | 111.1° | 109.5° |
| CAB | CAC | CAD | 110.4° | 109.5° |
| CAB | CAC | CAI | 108.7° | 109.5° |
| OAE | CAD | CAC | 120.7° | 120.0° |
| OAE | CAD | OAG | 120.6° | 120.0° |
| CAH | CAC | CAD | 109.9° | 109.5° |
| CAH | CAC | CAI | 109.9° | 109.5° |
| CAC | CAH | H1 | 109.5° | 109.5° |
| CAC | CAH | H2 | 109.4° | 109.5° |
| CAC | CAH | H3 | 109.5° | 109.5° |
| CAD | CAC | CAI | 106.8° | 109.4° |
| CAC | CAD | OAG | 118.7° | 120.0° |
| CAC | CAI | H4 | 109.5° | 109.5° |
| CAC | CAI | H5 | 109.5° | 109.5° |
| CAC | CAI | H6 | 109.5° | 109.4° |
| CAD | OAG | H8 | 109.5° | 117.0° |
| H1 | CAH | H2 | 109.5° | 109.5° |
| H1 | CAH | H3 | 109.5° | 109.4° |
| H2 | CAH | H3 | 109.5° | 109.5° |
| H4 | CAI | H5 | 109.4° | 109.5° |
| H4 | CAI | H6 | 109.5° | 109.5° |
| H5 | CAI | H6 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| OAF | CAB | OAA | CAC | 179.0° | 179.6° |
| OAF | CAB | CAC | CAH | 70.3° | 119.7° |
| OAF | CAB | CAC | CAD | 51.9° | 0.3° |
| OAF | CAB | CAC | CAI | 168.6° | 120.3° |
| OAF | CAB | OAA | H7 | 0.0° | 0.3° |
| OAA | CAB | CAC | CAH | 108.7° | 59.9° |
| OAA | CAB | CAC | CAD | 129.2° | 180.0° |
| OAA | CAB | CAC | CAI | 12.4° | 60.1° |
| CAB | CAC | CAD | OAE | 32.3° | 0.1° |
| CAB | CAC | CAH | CAD | 122.4° | 120.0° |
| CAB | CAC | CAH | CAI | 120.3° | 120.0° |
| CAB | CAC | CAD | CAI | 117.9° | 120.0° |
| CAB | CAC | CAD | OAG | 148.5° | 180.0° |
| CAB | CAC | CAH | H1 | 180.0° | 60.0° |
| CAB | CAC | CAH | H2 | 60.0° | 180.0° |
| CAB | CAC | CAH | H3 | 60.0° | 60.0° |
| CAB | CAC | CAI | H4 | 180.0° | 60.0° |
| CAB | CAC | CAI | H5 | 60.0° | 180.0° |
| CAB | CAC | CAI | H6 | 60.0° | 60.1° |
| CAC | CAB | OAA | H7 | 179.0° | 180.0° |
| OAE | CAD | CAC | CAH | 90.6° | 120.0° |
| OAE | CAD | CAC | OAG | 179.2° | 179.9° |
| OAE | CAD | CAC | CAI | 150.2° | 120.0° |
| OAE | CAD | OAG | H8 | 0.0° | 0.1° |
| CAH | CAC | CAD | CAI | 119.2° | 120.0° |
| CAH | CAC | CAD | OAG | 88.6° | 59.9° |
| CAC | CAH | H1 | H2 | 120.0° | 120.1° |
| CAC | CAH | H1 | H3 | 120.0° | 120.0° |
| CAC | CAH | H2 | H3 | 120.0° | 120.0° |
| CAH | CAC | CAI | H4 | 58.2° | 180.0° |
| CAH | CAC | CAI | H5 | 178.2° | 59.9° |
| CAH | CAC | CAI | H6 | 61.8° | 60.0° |
| CAD | CAC | CAH | H1 | 57.6° | 180.0° |
| CAD | CAC | CAH | H2 | 177.6° | 60.0° |
| CAD | CAC | CAH | H3 | 62.5° | 60.1° |
| CAD | CAC | CAI | H4 | 60.9° | 60.0° |
| CAD | CAC | CAI | H5 | 59.0° | 60.0° |
| CAD | CAC | CAI | H6 | 179.0° | 180.0° |
| CAC | CAD | OAG | H8 | 179.2° | 180.0° |
| CAI | CAC | CAD | OAG | 30.6° | 60.0° |
| CAI | CAC | CAH | H1 | 59.7° | 60.1° |
| CAI | CAC | CAH | H2 | 60.3° | 60.0° |
| CAI | CAC | CAH | H3 | 179.7° | 180.0° |
| CAC | CAI | H4 | H5 | 120.0° | 120.1° |
| CAC | CAI | H4 | H6 | 120.0° | 120.0° |
| CAC | CAI | H5 | H6 | 120.0° | 120.0° |
| H1 | CAH | H2 | H3 | 120.0° | 119.9° |
| H4 | CAI | H5 | H6 | 120.0° | 120.0° |
