L7T
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F1 | C2 | sing | 1.35Å | 1.35Å | |
| F2 | C3 | sing | 1.35Å | 1.35Å | |
| C2 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C2 | C1 | sing | 1.39Å | 1.37Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.37Å | Aromatic |
| F | C1 | sing | 1.35Å | 1.35Å | |
| C1 | C | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | F3 | sing | 1.35Å | 1.35Å | |
| C4 | C5 | doub | 1.39Å | 1.37Å | Aromatic |
| C | C5 | sing | 1.38Å | 1.39Å | Aromatic |
| C | S | sing | 1.76Å | 1.78Å | |
| C5 | F4 | sing | 1.35Å | 1.34Å | |
| N | S | sing | 1.66Å | 1.57Å | |
| O1 | S | doub | 1.42Å | 1.45Å | |
| S | O | doub | 1.42Å | 1.43Å | |
| N | H1 | sing | 0.97Å | 1.00Å | |
| N | H2 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F1 | C2 | C3 | 120.6° | 120.0° |
| F1 | C2 | C1 | 119.4° | 120.0° |
| F2 | C3 | C2 | 120.7° | 120.0° |
| F2 | C3 | C4 | 119.1° | 120.0° |
| C3 | C2 | C1 | 120.1° | 120.0° |
| C2 | C3 | C4 | 120.2° | 120.0° |
| C2 | C1 | F | 117.7° | 120.0° |
| C2 | C1 | C | 120.5° | 120.0° |
| C3 | C4 | F3 | 121.0° | 120.0° |
| C3 | C4 | C5 | 120.0° | 120.0° |
| F | C1 | C | 121.9° | 120.0° |
| C1 | C | C5 | 118.5° | 120.1° |
| C1 | C | S | 123.6° | 120.0° |
| F3 | C4 | C5 | 119.0° | 120.0° |
| C4 | C5 | C | 120.7° | 120.0° |
| C4 | C5 | F4 | 117.8° | 120.0° |
| C5 | C | S | 117.9° | 120.0° |
| C | C5 | F4 | 121.5° | 120.0° |
| C | S | N | 109.2° | 107.2° |
| C | S | O1 | 102.5° | 106.4° |
| C | S | O | 105.9° | 106.4° |
| N | S | O1 | 108.8° | 106.4° |
| N | S | O | 111.4° | 106.4° |
| S | N | H1 | 109.5° | 120.0° |
| S | N | H2 | 109.5° | 120.0° |
| O1 | S | O | 118.3° | 123.2° |
| H1 | N | H2 | 109.4° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F1 | C2 | C3 | F2 | 0.8° | 0.5° |
| F1 | C2 | C3 | C1 | 179.7° | 179.4° |
| F1 | C2 | C3 | C4 | 179.7° | 180.0° |
| F1 | C2 | C1 | F | 2.6° | 0.3° |
| F1 | C2 | C1 | C | 178.5° | 179.7° |
| F2 | C3 | C2 | C4 | 179.6° | 179.5° |
| F2 | C3 | C2 | C1 | 178.9° | 180.0° |
| F2 | C3 | C4 | F3 | 4.3° | 0.3° |
| F2 | C3 | C4 | C5 | 178.0° | 180.0° |
| C3 | C2 | C1 | F | 177.7° | 179.7° |
| C3 | C2 | C1 | C | 1.3° | 0.3° |
| C2 | C3 | C4 | F3 | 176.2° | 179.7° |
| C2 | C3 | C4 | C5 | 1.6° | 0.6° |
| C1 | C2 | C3 | C4 | 0.6° | 0.6° |
| C2 | C1 | F | C | 179.0° | 180.0° |
| C2 | C1 | C | C5 | 2.1° | 0.0° |
| C2 | C1 | C | S | 178.3° | 179.9° |
| C3 | C4 | F3 | C5 | 177.8° | 179.7° |
| C3 | C4 | C5 | C | 0.6° | 0.3° |
| C3 | C4 | C5 | F4 | 179.0° | 179.7° |
| F | C1 | C | C5 | 176.8° | 180.0° |
| F | C1 | C | S | 2.8° | 0.1° |
| C1 | C | C5 | C4 | 1.2° | 0.0° |
| C1 | C | C5 | S | 179.6° | 179.9° |
| C1 | C | C5 | F4 | 177.1° | 180.0° |
| C1 | C | S | N | 4.2° | 90.0° |
| C1 | C | S | O1 | 119.4° | 23.5° |
| C1 | C | S | O | 115.9° | 156.4° |
| F3 | C4 | C5 | C | 177.2° | 180.0° |
| F3 | C4 | C5 | F4 | 1.2° | 0.0° |
| C4 | C5 | C | F4 | 178.3° | 180.0° |
| C4 | C5 | C | S | 179.2° | 179.9° |
| C5 | C | S | N | 175.4° | 90.0° |
| C5 | C | S | O1 | 60.2° | 156.5° |
| C5 | C | S | O | 64.5° | 23.5° |
| S | C | C5 | F4 | 2.5° | 0.1° |
| C | S | N | O1 | 111.2° | 113.5° |
| C | S | N | O | 116.6° | 113.5° |
| C | S | O1 | O | 116.0° | 123.0° |
| C | S | N | H1 | 180.0° | 0.0° |
| C | S | N | H2 | 60.0° | 180.0° |
| N | S | O1 | O | 128.4° | 123.0° |
| S | N | H1 | H2 | 120.0° | 180.0° |
| O1 | S | N | H1 | 68.8° | 113.6° |
| O1 | S | N | H2 | 51.2° | 66.5° |
| O | S | N | H1 | 63.4° | 113.5° |
| O | S | N | H2 | 176.7° | 66.5° |
