PSL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| S1 | O1 | sing | 1.45Å | 1.45Å | |
| S1 | O2 | doub | 1.45Å | 1.47Å | |
| S1 | O3 | doub | 1.45Å | 1.46Å | |
| S1 | O5 | sing | 1.52Å | 1.56Å | |
| S2 | O4 | doub | 1.45Å | 1.46Å | |
| S2 | O5 | sing | 1.52Å | 1.55Å | |
| S2 | O6 | doub | 1.45Å | 1.45Å | |
| S2 | O7 | sing | 1.45Å | 1.49Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | S1 | O2 | 104.8° | 112.3° |
| O1 | S1 | O3 | 102.1° | 112.3° |
| O1 | S1 | O5 | 108.0° | 106.4° |
| O2 | S1 | O3 | 107.5° | 112.4° |
| O2 | S1 | O5 | 108.7° | 106.4° |
| O3 | S1 | O5 | 124.1° | 106.4° |
| S1 | O5 | S2 | 146.3° | 106.8° |
| O4 | S2 | O5 | 109.1° | 106.4° |
| O4 | S2 | O6 | 102.7° | 112.3° |
| O4 | S2 | O7 | 104.8° | 112.4° |
| O5 | S2 | O6 | 111.6° | 106.4° |
| O5 | S2 | O7 | 121.4° | 106.4° |
| O6 | S2 | O7 | 105.5° | 112.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | S1 | O2 | O3 | 108.1° | 127.8° |
| O1 | S1 | O2 | O5 | 115.3° | 116.1° |
| O1 | S1 | O3 | O5 | 121.8° | 116.1° |
| O1 | S1 | O5 | S2 | 26.1° | 165.0° |
| O2 | S1 | O3 | O5 | 128.2° | 116.1° |
| O2 | S1 | O5 | S2 | 139.3° | 75.0° |
| O3 | S1 | O5 | S2 | 93.0° | 45.0° |
| S1 | O5 | S2 | O4 | 98.6° | 75.0° |
| S1 | O5 | S2 | O6 | 14.2° | 165.0° |
| S1 | O5 | S2 | O7 | 139.5° | 45.0° |
| O4 | S2 | O5 | O6 | 112.8° | 120.0° |
| O4 | S2 | O5 | O7 | 121.9° | 120.0° |
| O4 | S2 | O6 | O7 | 109.5° | 127.8° |
| O5 | S2 | O6 | O7 | 133.7° | 116.1° |
