4SM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| S1 | MO1 | sing | 2.27Å | 2.21Å | |
| MO1 | S3 | doub | 2.27Å | 2.22Å | |
| MO1 | S4 | doub | 2.27Å | 2.18Å | |
| S2 | MO1 | sing | 2.27Å | 2.22Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| S1 | MO1 | S3 | 106.8° | 109.5° |
| S1 | MO1 | S4 | 111.9° | 109.5° |
| S1 | MO1 | S2 | 108.3° | 109.5° |
| S3 | MO1 | S4 | 110.3° | 109.5° |
| S3 | MO1 | S2 | 107.5° | 109.5° |
| S4 | MO1 | S2 | 111.8° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| S1 | MO1 | S3 | S4 | 121.9° | 120.0° |
| S1 | MO1 | S3 | S2 | 116.0° | 120.0° |
| S1 | MO1 | S4 | S2 | 121.7° | 120.0° |
| S3 | MO1 | S4 | S2 | 119.5° | 120.0° |
