WLP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C07 | C08 | doub | 1.38Å | 1.39Å | Aromatic |
| C07 | C06 | sing | 1.39Å | 1.39Å | Aromatic |
| C08 | C09 | sing | 1.38Å | 1.39Å | Aromatic |
| S03 | C06 | sing | 1.76Å | 1.81Å | |
| C06 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
| C09 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C11 | CL1 | sing | 1.74Å | 1.78Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C07 | H2 | sing | 1.08Å | 1.08Å | |
| C08 | H3 | sing | 1.08Å | 1.08Å | |
| C09 | H4 | sing | 1.08Å | 1.08Å | |
| S03 | H5 | sing | 1.34Å | 1.30Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C08 | C07 | C06 | 119.8° | 120.0° |
| C07 | C08 | C09 | 119.5° | 120.1° |
| C08 | C07 | H2 | 120.1° | 120.0° |
| C07 | C08 | H3 | 120.3° | 119.9° |
| C07 | C06 | S03 | 121.5° | 120.1° |
| C07 | C06 | C11 | 120.3° | 119.8° |
| C06 | C07 | H2 | 120.1° | 120.0° |
| C08 | C09 | C10 | 120.4° | 120.2° |
| C09 | C08 | H3 | 120.2° | 120.0° |
| C08 | C09 | H4 | 119.8° | 119.9° |
| S03 | C06 | C11 | 118.3° | 120.1° |
| C06 | S03 | H5 | 102.0° | 103.0° |
| C06 | C11 | C10 | 120.3° | 120.0° |
| C06 | C11 | CL1 | 118.3° | 120.0° |
| C09 | C10 | C11 | 119.6° | 120.0° |
| C09 | C10 | H1 | 120.2° | 120.0° |
| C10 | C09 | H4 | 119.8° | 119.9° |
| C10 | C11 | CL1 | 121.4° | 120.0° |
| C11 | C10 | H1 | 120.2° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C08 | C07 | C06 | H2 | 180.0° | 179.8° |
| C07 | C08 | C09 | H3 | 180.0° | 179.9° |
| C08 | C07 | C06 | S03 | 179.6° | 179.8° |
| C08 | C07 | C06 | C11 | 0.3° | 0.3° |
| C07 | C08 | C09 | C10 | 0.2° | 0.1° |
| C07 | C08 | C09 | H4 | 179.8° | 180.0° |
| C06 | C07 | C08 | C09 | 0.1° | 0.2° |
| C07 | C06 | S03 | C11 | 179.9° | 179.9° |
| C07 | C06 | C11 | C10 | 0.5° | 0.1° |
| C07 | C06 | C11 | CL1 | 180.0° | 180.0° |
| C06 | C07 | C08 | H3 | 179.9° | 179.9° |
| C07 | C06 | S03 | H5 | 180.0° | 90.0° |
| C08 | C09 | C10 | H4 | 180.0° | 179.9° |
| C08 | C09 | C10 | C11 | 0.0° | 0.3° |
| C08 | C09 | C10 | H1 | 179.9° | 180.0° |
| C09 | C08 | C07 | H2 | 180.0° | 180.0° |
| S03 | C06 | C11 | C10 | 179.4° | 180.0° |
| S03 | C06 | C11 | CL1 | 0.1° | 0.1° |
| S03 | C06 | C07 | H2 | 0.5° | 0.0° |
| C06 | C11 | C10 | C09 | 0.3° | 0.2° |
| C06 | C11 | C10 | CL1 | 179.5° | 179.9° |
| C06 | C11 | C10 | H1 | 179.7° | 179.9° |
| C11 | C06 | C07 | H2 | 179.7° | 179.9° |
| C11 | C06 | S03 | H5 | 0.1° | 90.0° |
| C09 | C10 | C11 | H1 | 180.0° | 179.8° |
| C09 | C10 | C11 | CL1 | 179.8° | 179.7° |
| C10 | C09 | C08 | H3 | 179.8° | 179.8° |
| C11 | C10 | C09 | H4 | 180.0° | 179.8° |
| CL1 | C11 | C10 | H1 | 0.2° | 0.0° |
| H1 | C10 | C09 | H4 | 0.0° | 0.0° |
| H2 | C07 | C08 | H3 | 0.0° | 0.1° |
| H3 | C08 | C09 | H4 | 0.2° | 0.1° |
