DGU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | doub | 1.21Å | 1.24Å | |
| O2 | C2 | sing | 1.43Å | 1.44Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| C5 | O5 | sing | 1.43Å | 1.44Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å | |
| C6 | O6B | sing | 1.34Å | 1.25Å | |
| O6B | HO6B | sing | 0.97Å | 0.95Å | |
| C1 | C2 | sing | 1.51Å | 1.55Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | C3 | sing | 1.53Å | 1.54Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | O3 | sing | 1.43Å | 1.43Å | |
| C3 | C4 | sing | 1.53Å | 1.55Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| O4 | C4 | sing | 1.43Å | 1.43Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | C6 | sing | 1.51Å | 1.55Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| O6A | C6 | doub | 1.21Å | 1.25Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 122.5° | 120.0° |
| O1 | C1 | H1 | 118.8° | 120.0° |
| C2 | O2 | HO2 | 109.5° | 114.0° |
| O2 | C2 | C1 | 108.2° | 109.5° |
| O2 | C2 | C3 | 109.5° | 109.4° |
| O2 | C2 | H2 | 111.5° | 109.5° |
| C5 | O5 | HO5 | 109.5° | 114.0° |
| O5 | C5 | C4 | 110.9° | 109.5° |
| O5 | C5 | C6 | 113.0° | 109.5° |
| O5 | C5 | H5 | 107.0° | 109.4° |
| C6 | O6B | HO6B | 109.5° | 117.0° |
| O6B | C6 | C5 | 117.8° | 120.0° |
| O6B | C6 | O6A | 126.1° | 120.0° |
| C2 | C1 | H1 | 118.7° | 120.0° |
| C1 | C2 | C3 | 113.0° | 109.5° |
| C1 | C2 | H2 | 107.9° | 109.5° |
| C3 | C2 | H2 | 106.6° | 109.5° |
| C2 | C3 | O3 | 109.4° | 109.5° |
| C2 | C3 | C4 | 114.2° | 109.5° |
| C2 | C3 | H3 | 106.0° | 109.4° |
| O3 | C3 | C4 | 108.5° | 109.5° |
| O3 | C3 | H3 | 112.0° | 109.4° |
| C3 | O3 | HO3 | 109.5° | 113.9° |
| C4 | C3 | H3 | 106.8° | 109.5° |
| C3 | C4 | O4 | 109.2° | 109.5° |
| C3 | C4 | C5 | 114.2° | 109.5° |
| C3 | C4 | H4 | 105.6° | 109.5° |
| O4 | C4 | C5 | 107.0° | 109.5° |
| O4 | C4 | H4 | 113.0° | 109.4° |
| C4 | O4 | HO4 | 109.5° | 113.9° |
| C5 | C4 | H4 | 107.9° | 109.5° |
| C4 | C5 | C6 | 112.3° | 109.5° |
| C4 | C5 | H5 | 107.7° | 109.5° |
| C6 | C5 | H5 | 105.4° | 109.5° |
| C5 | C6 | O6A | 116.2° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | O2 | 43.5° | 0.0° |
| O1 | C1 | C2 | H1 | 180.0° | 179.9° |
| O1 | C1 | C2 | C3 | 165.0° | 119.9° |
| O1 | C1 | C2 | H2 | 77.3° | 120.0° |
| O2 | C2 | C1 | C3 | 121.5° | 120.0° |
| O2 | C2 | C1 | H2 | 120.9° | 120.0° |
| O2 | C2 | C1 | H1 | 136.4° | 180.0° |
| O2 | C2 | C3 | H2 | 120.8° | 120.0° |
| O2 | C2 | C3 | O3 | 69.9° | 65.0° |
| O2 | C2 | C3 | C4 | 168.3° | 55.0° |
| O2 | C2 | C3 | H3 | 51.0° | 175.0° |
| HO2 | O2 | C2 | C1 | 17.1° | 60.0° |
| HO2 | O2 | C2 | C3 | 140.8° | 60.0° |
| HO2 | O2 | C2 | H2 | 101.5° | 180.0° |
| O5 | C5 | C6 | O6B | 33.9° | 174.9° |
| O5 | C5 | C4 | C3 | 51.1° | 55.0° |
| O5 | C5 | C4 | O4 | 69.9° | 65.1° |
| O5 | C5 | C4 | C6 | 127.6° | 120.0° |
| O5 | C5 | C4 | H5 | 116.8° | 120.0° |
| O5 | C5 | C4 | H4 | 168.2° | 175.0° |
| O5 | C5 | C6 | H5 | 116.5° | 120.0° |
| O5 | C5 | C6 | O6A | 146.5° | 5.0° |
| HO5 | O5 | C5 | C4 | 180.0° | 60.1° |
| HO5 | O5 | C5 | C6 | 52.9° | 60.0° |
| HO5 | O5 | C5 | H5 | 62.7° | 180.0° |
| O6B | C6 | C5 | C4 | 160.4° | 65.0° |
| O6B | C6 | C5 | O6A | 179.5° | 179.9° |
| O6B | C6 | C5 | H5 | 82.6° | 55.0° |
| HO6B | O6B | C6 | C5 | 179.5° | 180.0° |
| HO6B | O6B | C6 | O6A | 0.0° | 0.1° |
| C1 | C2 | C3 | H2 | 118.4° | 120.1° |
| C1 | C2 | C3 | O3 | 169.4° | 54.9° |
| C1 | C2 | C3 | C4 | 47.5° | 175.0° |
| C1 | C2 | C3 | H3 | 69.8° | 65.0° |
| H1 | C1 | C2 | C3 | 14.9° | 60.0° |
| H1 | C1 | C2 | H2 | 102.7° | 60.0° |
| C2 | C3 | O3 | C4 | 125.2° | 120.0° |
| C2 | C3 | O3 | H3 | 117.1° | 119.9° |
| C2 | C3 | C4 | H3 | 116.8° | 120.0° |
| C2 | C3 | C4 | O4 | 54.1° | 60.0° |
| C2 | C3 | C4 | C5 | 173.8° | 180.0° |
| C2 | C3 | C4 | H4 | 67.8° | 60.0° |
| C2 | C3 | O3 | HO3 | 180.0° | 60.0° |
| H2 | C2 | C3 | O3 | 50.9° | 175.0° |
| H2 | C2 | C3 | C4 | 70.9° | 65.0° |
| H2 | C2 | C3 | H3 | 171.8° | 55.1° |
| O3 | C3 | C4 | H3 | 120.9° | 120.0° |
| O3 | C3 | C4 | O4 | 176.4° | 180.0° |
| O3 | C3 | C4 | C5 | 63.9° | 60.0° |
| O3 | C3 | C4 | H4 | 54.5° | 60.0° |
| C3 | C4 | O4 | C5 | 124.0° | 120.0° |
| C3 | C4 | O4 | H4 | 117.3° | 120.0° |
| C3 | C4 | C5 | H4 | 117.1° | 120.0° |
| C3 | C4 | C5 | C6 | 178.6° | 175.0° |
| C3 | C4 | C5 | H5 | 65.7° | 65.0° |
| C4 | C3 | O3 | HO3 | 54.8° | 60.0° |
| C3 | C4 | O4 | HO4 | 178.3° | 60.0° |
| H3 | C3 | C4 | O4 | 62.7° | 60.0° |
| H3 | C3 | C4 | C5 | 57.0° | 60.0° |
| H3 | C3 | C4 | H4 | 175.4° | 180.0° |
| H3 | C3 | O3 | HO3 | 62.9° | 179.9° |
| O4 | C4 | C5 | H4 | 121.9° | 119.9° |
| O4 | C4 | C5 | C6 | 57.7° | 55.0° |
| O4 | C4 | C5 | H5 | 173.3° | 175.0° |
| C4 | C5 | C6 | H5 | 117.1° | 120.0° |
| C4 | C5 | C6 | O6A | 20.1° | 115.0° |
| C5 | C4 | O4 | HO4 | 54.3° | 60.0° |
| H4 | C4 | C5 | C6 | 64.3° | 65.0° |
| H4 | C4 | C5 | H5 | 51.4° | 55.1° |
| H4 | C4 | O4 | HO4 | 64.4° | 179.9° |
| H5 | C5 | C6 | O6A | 97.0° | 125.0° |
