TSE
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C3P | O4P | sing | 1.36Å | 1.25Å | |
| C3P | O5P | doub | 1.22Å | 1.25Å | |
| C3P | C2P | sing | 1.50Å | 1.50Å | |
| O4P | H4P | sing | 0.98Å | 0.95Å | |
| P | S1P | doub | 1.93Å | 2.00Å | |
| P | C2P | sing | 1.80Å | 1.68Å | |
| P | O3P | sing | 1.62Å | 169.93Å | |
| P | O2P | sing | 1.62Å | 169.93Å | |
| C2P | H2P1 | sing | 1.09Å | 1.10Å | |
| C2P | H2P2 | sing | 1.09Å | 1.10Å | |
| O3P | HOP3 | sing | 0.98Å | 0.00Å | |
| O2P | HOP2 | sing | 0.98Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4P | C3P | O5P | 123.3° | 123.3° |
| O4P | C3P | C2P | 118.9° | 112.7° |
| C3P | O4P | H4P | 109.5° | 115.3° |
| O5P | C3P | C2P | 117.8° | 124.0° |
| C3P | C2P | P | 113.9° | 114.5° |
| C3P | C2P | H2P1 | 108.0° | 108.3° |
| C3P | C2P | H2P2 | 107.0° | 108.5° |
| S1P | P | C2P | 113.6° | 117.0° |
| S1P | P | O3P | 149.7° | 116.4° |
| S1P | P | O2P | 149.7° | 116.5° |
| C2P | P | O3P | 45.0° | 101.2° |
| C2P | P | O2P | 45.0° | 101.2° |
| P | C2P | H2P1 | 108.0° | 107.7° |
| P | C2P | H2P2 | 107.0° | 109.9° |
| O3P | P | O2P | 0.0° | 101.9° |
| P | O3P | HOP3 | 90.0° | 118.5° |
| P | O2P | HOP2 | 90.0° | 118.5° |
| H2P1 | C2P | H2P2 | 113.0° | 107.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4P | C3P | O5P | C2P | 177.9° | 178.0° |
| O4P | C3P | C2P | P | 60.4° | 178.3° |
| O4P | C3P | C2P | H2P1 | 179.6° | 58.2° |
| O4P | C3P | C2P | H2P2 | 57.6° | 58.5° |
| O5P | C3P | O4P | H4P | 0.0° | 0.0° |
| O5P | C3P | C2P | P | 121.6° | 0.2° |
| O5P | C3P | C2P | H2P1 | 1.6° | 120.0° |
| O5P | C3P | C2P | H2P2 | 120.4° | 123.4° |
| C2P | C3P | O4P | H4P | 177.9° | 178.2° |
| C3P | C2P | P | S1P | 4.6° | 67.7° |
| C3P | C2P | P | H2P1 | 120.0° | 120.5° |
| C3P | C2P | P | H2P2 | 118.0° | 122.4° |
| C3P | C2P | P | O3P | 158.3° | 59.9° |
| C3P | C2P | P | O2P | 158.3° | 164.7° |
| C3P | C2P | H2P1 | H2P2 | 118.2° | 117.2° |
| S1P | P | C2P | O3P | 153.6° | 127.6° |
| S1P | P | C2P | O2P | 153.6° | 127.7° |
| S1P | P | O3P | O2P | 90.0° | 127.8° |
| S1P | P | C2P | H2P1 | 124.7° | 52.8° |
| S1P | P | C2P | H2P2 | 113.4° | 169.9° |
| S1P | P | O3P | HOP3 | 90.0° | 50.6° |
| S1P | P | O2P | HOP2 | 90.0° | 50.5° |
| C2P | P | O3P | O2P | 90.0° | 104.2° |
| P | C2P | H2P1 | H2P2 | 118.2° | 118.5° |
| C2P | P | O3P | HOP3 | 90.0° | 178.6° |
| C2P | P | O2P | HOP2 | 90.0° | 178.5° |
| O3P | P | C2P | H2P1 | 81.7° | 179.6° |
| O3P | P | C2P | H2P2 | 40.3° | 62.5° |
| O3P | P | O2P | HOP2 | 90.0° | 77.3° |
| O2P | P | C2P | H2P1 | 81.7° | 74.9° |
| O2P | P | C2P | H2P2 | 40.3° | 42.2° |
| O2P | P | O3P | HOP3 | 90.0° | 77.2° |
