MAC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| HG | O1 | sing | 1.37Å | 2.62Å | |
| C1 | O1 | sing | 1.34Å | 1.33Å | |
| C1 | O2 | doub | 1.21Å | 1.20Å | |
| C1 | C2 | sing | 1.51Å | 1.47Å | |
| C2 | H21 | sing | 1.09Å | 1.12Å | |
| C2 | H22 | sing | 1.09Å | 1.11Å | |
| C2 | H23 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| HG | O1 | C1 | 93.7° | 109.2° |
| O1 | C1 | O2 | 118.9° | 119.9° |
| O1 | C1 | C2 | 114.8° | 120.1° |
| O2 | C1 | C2 | 126.2° | 120.0° |
| C1 | C2 | H21 | 114.8° | 109.5° |
| C1 | C2 | H22 | 110.3° | 109.5° |
| C1 | C2 | H23 | 110.2° | 109.5° |
| H21 | C2 | H22 | 110.3° | 109.5° |
| H21 | C2 | H23 | 110.2° | 109.5° |
| H22 | C2 | H23 | 100.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| HG | O1 | C1 | O2 | 1.7° | 0.0° |
| HG | O1 | C1 | C2 | 176.4° | 180.0° |
| O1 | C1 | O2 | C2 | 177.9° | 180.0° |
| O1 | C1 | C2 | H21 | 179.9° | 90.0° |
| O1 | C1 | C2 | H22 | 54.7° | 30.0° |
| O1 | C1 | C2 | H23 | 54.8° | 150.0° |
| O2 | C1 | C2 | H21 | 2.1° | 90.0° |
| O2 | C1 | C2 | H22 | 123.3° | 150.0° |
| O2 | C1 | C2 | H23 | 127.3° | 30.0° |
| C1 | C2 | H21 | H22 | 125.3° | 120.0° |
| C1 | C2 | H21 | H23 | 125.2° | 120.0° |
| C1 | C2 | H22 | H23 | 116.1° | 120.0° |
| H21 | C2 | H22 | H23 | 116.0° | 120.0° |
