GUZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F2 | C2 | sing | 1.40Å | 1.38Å | |
| O3 | C3 | sing | 1.43Å | 1.42Å | |
| C2 | C3 | sing | 1.53Å | 1.51Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C1 | O1 | sing | 1.43Å | 1.44Å | |
| C1 | O5 | sing | 1.43Å | 1.40Å | |
| C4 | O4 | sing | 1.43Å | 1.42Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| O5 | C5 | sing | 1.43Å | 1.42Å | |
| C5 | C6 | sing | 1.51Å | 1.53Å | |
| O6A | C6 | doub | 1.21Å | 1.25Å | |
| C6 | O6B | sing | 1.34Å | 1.26Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| O6B | HO6B | sing | 0.97Å | 0.95Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F2 | C2 | C3 | 110.1° | 109.5° |
| F2 | C2 | C1 | 106.3° | 109.5° |
| F2 | C2 | H2 | 112.1° | 109.6° |
| O3 | C3 | C2 | 109.6° | 109.5° |
| O3 | C3 | C4 | 111.4° | 109.5° |
| O3 | C3 | H3 | 110.5° | 109.6° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| C3 | C2 | C1 | 108.1° | 109.2° |
| C2 | C3 | C4 | 107.1° | 109.0° |
| C3 | C2 | H2 | 110.2° | 109.5° |
| C2 | C3 | H3 | 109.2° | 109.5° |
| C2 | C1 | O1 | 127.9° | 109.5° |
| C2 | C1 | O5 | 106.5° | 109.4° |
| C2 | C1 | H1 | 103.8° | 109.5° |
| C1 | C2 | H2 | 109.9° | 109.5° |
| C3 | C4 | O4 | 111.3° | 109.5° |
| C3 | C4 | C5 | 112.6° | 109.2° |
| C4 | C3 | H3 | 109.0° | 109.5° |
| C3 | C4 | H4 | 107.6° | 109.5° |
| O1 | C1 | O5 | 106.9° | 109.4° |
| O1 | C1 | H1 | 104.7° | 109.5° |
| C1 | O1 | HO1 | 109.5° | 114.0° |
| C1 | O5 | C5 | 112.0° | 114.1° |
| O5 | C1 | H1 | 105.1° | 109.5° |
| O4 | C4 | C5 | 108.6° | 109.5° |
| O4 | C4 | H4 | 109.0° | 109.5° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| C4 | C5 | O5 | 111.2° | 109.4° |
| C4 | C5 | C6 | 110.6° | 109.5° |
| C5 | C4 | H4 | 107.5° | 109.6° |
| C4 | C5 | H5 | 108.2° | 109.5° |
| O5 | C5 | C6 | 109.0° | 109.5° |
| O5 | C5 | H5 | 109.6° | 109.5° |
| C5 | C6 | O6A | 117.7° | 120.0° |
| C5 | C6 | O6B | 119.2° | 120.0° |
| C6 | C5 | H5 | 108.3° | 109.5° |
| O6A | C6 | O6B | 123.1° | 120.0° |
| C6 | O6B | HO6B | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F2 | C2 | C3 | O3 | 63.7° | 63.2° |
| F2 | C2 | C3 | C1 | 115.7° | 119.9° |
| F2 | C2 | C3 | H2 | 124.1° | 120.2° |
| F2 | C2 | C1 | H2 | 121.5° | 120.2° |
| F2 | C2 | C3 | C4 | 175.4° | 176.9° |
| F2 | C2 | C1 | O1 | 59.5° | 57.6° |
| F2 | C2 | C1 | O5 | 172.6° | 177.5° |
| F2 | C2 | C1 | H1 | 61.9° | 62.5° |
| F2 | C2 | C3 | H3 | 57.5° | 57.1° |
| O3 | C3 | C2 | C4 | 120.9° | 119.9° |
| O3 | C3 | C2 | H3 | 121.2° | 120.3° |
| O3 | C3 | C2 | C1 | 179.4° | 176.8° |
| O3 | C3 | C4 | H3 | 122.2° | 120.3° |
| O3 | C3 | C4 | O4 | 68.0° | 63.3° |
| O3 | C3 | C4 | C5 | 169.7° | 176.8° |
| O3 | C3 | C2 | H2 | 60.4° | 56.9° |
| O3 | C3 | C4 | H4 | 51.4° | 56.9° |
| C3 | C2 | C1 | H2 | 120.3° | 119.9° |
| C2 | C3 | C4 | H3 | 118.1° | 119.8° |
| C3 | C2 | C1 | O1 | 58.6° | 62.4° |
| C3 | C2 | C1 | O5 | 69.3° | 57.5° |
| C2 | C3 | C4 | O4 | 172.2° | 176.9° |
| C2 | C3 | C4 | C5 | 49.9° | 56.9° |
| C3 | C2 | C1 | H1 | 179.9° | 177.6° |
| C2 | C3 | O3 | HO3 | 180.0° | 60.0° |
| C2 | C3 | C4 | H4 | 68.4° | 63.0° |
| C1 | C2 | C3 | C4 | 59.7° | 56.9° |
| C2 | C1 | O1 | O5 | 127.8° | 119.9° |
| C2 | C1 | O1 | H1 | 121.1° | 120.1° |
| C2 | C1 | O5 | H1 | 109.7° | 120.0° |
| C2 | C1 | O5 | C5 | 68.0° | 61.1° |
| C1 | C2 | C3 | H3 | 58.2° | 62.9° |
| C2 | C1 | O1 | HO1 | 180.0° | 180.0° |
| C3 | C4 | O4 | C5 | 124.6° | 119.7° |
| C3 | C4 | O4 | H4 | 118.6° | 120.1° |
| C3 | C4 | C5 | H4 | 118.3° | 119.9° |
| C3 | C4 | C5 | O5 | 48.3° | 57.6° |
| C3 | C4 | C5 | C6 | 169.5° | 177.6° |
| C4 | C3 | C2 | H2 | 60.5° | 62.9° |
| C4 | C3 | O3 | HO3 | 61.7° | 179.6° |
| C3 | C4 | O4 | HO4 | 180.0° | 180.0° |
| C3 | C4 | C5 | H5 | 72.1° | 62.4° |
| O1 | C1 | O5 | H1 | 110.8° | 120.0° |
| O1 | C1 | O5 | C5 | 71.5° | 58.8° |
| O1 | C1 | C2 | H2 | 179.0° | 177.8° |
| C1 | O5 | C5 | C4 | 57.9° | 61.1° |
| C1 | O5 | C5 | C6 | 180.0° | 178.9° |
| O5 | C1 | C2 | H2 | 51.0° | 62.3° |
| C1 | O5 | C5 | H5 | 61.7° | 58.8° |
| O5 | C1 | O1 | HO1 | 52.2° | 60.1° |
| O4 | C4 | C5 | H4 | 117.9° | 120.2° |
| O4 | C4 | C5 | O5 | 172.1° | 177.5° |
| O4 | C4 | C5 | C6 | 66.7° | 62.5° |
| O4 | C4 | C3 | H3 | 54.2° | 57.0° |
| O4 | C4 | C5 | H5 | 51.7° | 57.5° |
| C4 | C5 | O5 | C6 | 122.1° | 120.0° |
| C4 | C5 | O5 | H5 | 119.6° | 120.0° |
| C4 | C5 | C6 | H5 | 118.3° | 120.0° |
| C4 | C5 | C6 | O6A | 87.3° | 115.0° |
| C4 | C5 | C6 | O6B | 92.0° | 65.0° |
| C5 | C4 | C3 | H3 | 68.1° | 62.9° |
| C5 | C4 | O4 | HO4 | 55.5° | 60.3° |
| O5 | C5 | C6 | H5 | 119.2° | 120.0° |
| O5 | C5 | C6 | O6A | 35.2° | 5.0° |
| O5 | C5 | C6 | O6B | 145.5° | 175.1° |
| C5 | O5 | C1 | H1 | 177.7° | 178.9° |
| O5 | C5 | C4 | H4 | 70.0° | 62.4° |
| C5 | C6 | O6A | O6B | 179.3° | 180.0° |
| C6 | C5 | C4 | H4 | 51.2° | 57.7° |
| C5 | C6 | O6B | HO6B | 179.3° | 180.0° |
| O6A | C6 | C5 | H5 | 154.4° | 125.0° |
| O6A | C6 | O6B | HO6B | 0.0° | 0.1° |
| O6B | C6 | C5 | H5 | 26.3° | 55.0° |
| H1 | C1 | C2 | H2 | 59.6° | 57.7° |
| H1 | C1 | O1 | HO1 | 58.9° | 60.0° |
| H2 | C2 | C3 | H3 | 178.4° | 177.2° |
| H3 | C3 | O3 | HO3 | 59.6° | 60.2° |
| H3 | C3 | C4 | H4 | 173.6° | 177.1° |
| H4 | C4 | O4 | HO4 | 61.4° | 59.9° |
| H4 | C4 | C5 | H5 | 169.6° | 177.7° |
