FJO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | sing | 1.43Å | 1.44Å | |
| C2 | O3 | sing | 1.43Å | 1.41Å | |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C | C1 | sing | 1.53Å | 1.51Å | |
| C | O1 | sing | 1.43Å | 1.43Å | |
| C | O2 | sing | 1.43Å | 1.45Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| O3 | H5 | sing | 0.97Å | 0.95Å | |
| O2 | H6 | sing | 0.97Å | 0.95Å | |
| O1 | H7 | sing | 0.97Å | 0.95Å | |
| O | H8 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | C1 | 121.8° | 109.5° |
| O | C | O1 | 119.3° | 109.5° |
| O | C | O2 | 88.2° | 109.5° |
| C | O | H8 | 109.5° | 114.0° |
| O3 | C2 | C1 | 105.1° | 109.5° |
| O3 | C2 | H3 | 110.5° | 109.4° |
| O3 | C2 | H4 | 110.6° | 109.5° |
| C2 | O3 | H5 | 109.5° | 114.1° |
| C2 | C1 | C | 106.5° | 109.5° |
| C2 | C1 | H1 | 110.2° | 109.5° |
| C2 | C1 | H2 | 110.2° | 109.5° |
| C1 | C2 | H3 | 110.5° | 109.5° |
| C1 | C2 | H4 | 110.5° | 109.5° |
| C1 | C | O1 | 118.7° | 109.5° |
| C1 | C | O2 | 84.6° | 109.4° |
| C | C1 | H1 | 110.2° | 109.4° |
| C | C1 | H2 | 110.2° | 109.5° |
| O1 | C | O2 | 92.5° | 109.4° |
| C | O1 | H7 | 109.5° | 114.0° |
| C | O2 | H6 | 109.5° | 114.0° |
| H1 | C1 | H2 | 109.5° | 109.4° |
| H3 | C2 | H4 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | C1 | C2 | 131.3° | 180.0° |
| O | C | C1 | O1 | 174.4° | 120.1° |
| O | C | C1 | O2 | 84.5° | 120.0° |
| O | C | O1 | O2 | 89.3° | 120.0° |
| O | C | C1 | H1 | 109.2° | 60.0° |
| O | C | C1 | H2 | 11.7° | 59.9° |
| O | C | O2 | H6 | 180.0° | 60.0° |
| O | C | O1 | H7 | 180.0° | 60.0° |
| O3 | C2 | C1 | H3 | 119.3° | 120.0° |
| O3 | C2 | C1 | H4 | 119.3° | 120.1° |
| O3 | C2 | C1 | C | 170.0° | 180.0° |
| O3 | C2 | C1 | H1 | 70.4° | 60.0° |
| O3 | C2 | C1 | H2 | 50.5° | 60.0° |
| O3 | C2 | H3 | H4 | 122.0° | 120.0° |
| C2 | C1 | C | H1 | 119.5° | 120.0° |
| C2 | C1 | C | H2 | 119.6° | 120.1° |
| C2 | C1 | C | O1 | 54.3° | 59.9° |
| C2 | C1 | C | O2 | 144.2° | 60.0° |
| C2 | C1 | H1 | H2 | 121.4° | 120.0° |
| C1 | C2 | H3 | H4 | 122.0° | 120.0° |
| C1 | C2 | O3 | H5 | 180.0° | 180.0° |
| C1 | C | O1 | O2 | 85.2° | 119.9° |
| C | C1 | H1 | H2 | 121.3° | 120.0° |
| C | C1 | C2 | H3 | 50.8° | 60.0° |
| C | C1 | C2 | H4 | 70.6° | 60.0° |
| C1 | C | O2 | H6 | 57.8° | 60.0° |
| C1 | C | O1 | H7 | 5.5° | 60.1° |
| C1 | C | O | H8 | 180.0° | 180.0° |
| O1 | C | C1 | H1 | 65.2° | 60.1° |
| O1 | C | C1 | H2 | 173.9° | 180.0° |
| O1 | C | O2 | H6 | 60.8° | 180.0° |
| O1 | C | O | H8 | 5.6° | 59.9° |
| O2 | C | C1 | H1 | 24.6° | 180.0° |
| O2 | C | C1 | H2 | 96.3° | 60.1° |
| O2 | C | O1 | H7 | 90.7° | 180.0° |
| O2 | C | O | H8 | 97.4° | 60.1° |
| H1 | C1 | C2 | H3 | 170.3° | 60.0° |
| H1 | C1 | C2 | H4 | 48.9° | 180.0° |
| H2 | C1 | C2 | H3 | 68.8° | 180.0° |
| H2 | C1 | C2 | H4 | 169.8° | 60.1° |
| H3 | C2 | O3 | H5 | 60.7° | 60.0° |
| H4 | C2 | O3 | H5 | 60.7° | 59.9° |
