ALU
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C5 | sing | 1.43Å | 1.43Å | |
| O3 | P1 | sing | 1.61Å | 1.60Å | |
| C3 | C2 | sing | 1.51Å | 1.51Å | |
| C2 | O5 | doub | 1.21Å | 1.23Å | |
| C2 | P1 | sing | 1.81Å | 1.73Å | |
| O1 | P1 | sing | 1.61Å | 1.50Å | |
| O2 | P1 | doub | 1.48Å | 1.51Å | |
| C5 | H5C1 | sing | 1.09Å | 1.10Å | |
| C5 | H5C2 | sing | 1.09Å | 1.10Å | |
| C5 | H5C3 | sing | 1.09Å | 1.10Å | |
| C3 | H3C1 | sing | 1.09Å | 1.10Å | |
| C3 | H3C2 | sing | 1.09Å | 1.10Å | |
| C3 | H3C3 | sing | 1.09Å | 1.10Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | O3 | P1 | 116.6° | 123.0° |
| O3 | C5 | H5C1 | 109.5° | 109.5° |
| O3 | C5 | H5C2 | 109.5° | 109.4° |
| O3 | C5 | H5C3 | 109.4° | 109.4° |
| O3 | P1 | C2 | 121.3° | 109.5° |
| O3 | P1 | O1 | 96.4° | 109.5° |
| O3 | P1 | O2 | 104.8° | 109.5° |
| C3 | C2 | O5 | 120.7° | 120.0° |
| C3 | C2 | P1 | 116.7° | 120.0° |
| C2 | C3 | H3C1 | 109.5° | 109.5° |
| C2 | C3 | H3C2 | 109.5° | 109.5° |
| C2 | C3 | H3C3 | 109.5° | 109.5° |
| O5 | C2 | P1 | 122.6° | 120.1° |
| C2 | P1 | O1 | 109.0° | 109.5° |
| C2 | P1 | O2 | 107.3° | 109.5° |
| O1 | P1 | O2 | 118.5° | 109.4° |
| P1 | O1 | H1 | 109.5° | 114.0° |
| H5C1 | C5 | H5C2 | 109.4° | 109.5° |
| H5C1 | C5 | H5C3 | 109.5° | 109.5° |
| H5C2 | C5 | H5C3 | 109.5° | 109.5° |
| H3C1 | C3 | H3C2 | 109.4° | 109.5° |
| H3C1 | C3 | H3C3 | 109.5° | 109.4° |
| H3C2 | C3 | H3C3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | O3 | P1 | C2 | 162.0° | 175.0° |
| C5 | O3 | P1 | O1 | 45.1° | 65.0° |
| C5 | O3 | P1 | O2 | 76.6° | 55.0° |
| O3 | C5 | H5C1 | H5C2 | 120.0° | 120.0° |
| O3 | C5 | H5C1 | H5C3 | 120.0° | 120.0° |
| O3 | C5 | H5C2 | H5C3 | 120.0° | 119.9° |
| O3 | P1 | C2 | C3 | 123.8° | 180.0° |
| O3 | P1 | C2 | O5 | 58.6° | 0.0° |
| O3 | P1 | C2 | O1 | 110.3° | 120.0° |
| O3 | P1 | C2 | O2 | 120.2° | 120.0° |
| O3 | P1 | O1 | O2 | 110.6° | 120.0° |
| P1 | O3 | C5 | H5C1 | 101.2° | 60.0° |
| P1 | O3 | C5 | H5C2 | 18.7° | 60.0° |
| P1 | O3 | C5 | H5C3 | 138.7° | 180.0° |
| O3 | P1 | O1 | H1 | 179.3° | 60.1° |
| C3 | C2 | O5 | P1 | 177.5° | 180.0° |
| C3 | C2 | P1 | O1 | 125.9° | 60.0° |
| C3 | C2 | P1 | O2 | 3.6° | 60.0° |
| C2 | C3 | H3C1 | H3C2 | 120.0° | 120.1° |
| C2 | C3 | H3C1 | H3C3 | 120.0° | 120.0° |
| C2 | C3 | H3C2 | H3C3 | 120.0° | 120.0° |
| O5 | C2 | P1 | O1 | 51.7° | 120.0° |
| O5 | C2 | P1 | O2 | 178.8° | 120.0° |
| O5 | C2 | C3 | H3C1 | 92.5° | 90.0° |
| O5 | C2 | C3 | H3C2 | 147.6° | 150.0° |
| O5 | C2 | C3 | H3C3 | 27.5° | 30.0° |
| C2 | P1 | O1 | O2 | 123.1° | 120.0° |
| P1 | C2 | C3 | H3C1 | 89.9° | 90.0° |
| P1 | C2 | C3 | H3C2 | 30.0° | 30.0° |
| P1 | C2 | C3 | H3C3 | 150.1° | 150.0° |
| C2 | P1 | O1 | H1 | 53.0° | 60.0° |
| O2 | P1 | O1 | H1 | 70.1° | 180.0° |
| H5C1 | C5 | H5C2 | H5C3 | 120.0° | 120.1° |
| H3C1 | C3 | H3C2 | H3C3 | 120.0° | 120.0° |
