FFP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F1 | C6 | sing | 1.34Å | 1.33Å | |
| C6 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C1 | sing | 1.39Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.40Å | Aromatic |
| C5 | H5 | sing | 1.09Å | 1.08Å | |
| C4 | C3 | doub | 1.39Å | 1.39Å | Aromatic |
| C4 | H4 | sing | 1.09Å | 1.08Å | |
| C3 | C2 | sing | 1.40Å | 1.38Å | Aromatic |
| C3 | H3 | sing | 1.09Å | 1.08Å | |
| C2 | F2 | sing | 1.34Å | 1.30Å | |
| C2 | C1 | doub | 1.39Å | 1.40Å | Aromatic |
| C1 | O | sing | 1.36Å | 1.38Å | |
| O | HO | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F1 | C6 | C5 | 120.8° | 119.8° |
| F1 | C6 | C1 | 117.7° | 120.3° |
| C5 | C6 | C1 | 121.5° | 120.0° |
| C6 | C5 | C4 | 119.9° | 120.0° |
| C6 | C5 | H5 | 120.1° | 119.9° |
| C6 | C1 | C2 | 116.7° | 120.0° |
| C6 | C1 | O | 119.7° | 120.0° |
| C4 | C5 | H5 | 120.0° | 120.1° |
| C5 | C4 | C3 | 120.1° | 120.0° |
| C5 | C4 | H4 | 120.0° | 120.0° |
| C3 | C4 | H4 | 120.0° | 120.0° |
| C4 | C3 | C2 | 117.8° | 120.0° |
| C4 | C3 | H3 | 121.1° | 120.0° |
| C2 | C3 | H3 | 121.1° | 120.0° |
| C3 | C2 | F2 | 115.8° | 119.7° |
| C3 | C2 | C1 | 124.0° | 120.0° |
| F2 | C2 | C1 | 120.2° | 120.3° |
| C2 | C1 | O | 123.5° | 120.0° |
| C1 | O | HO | 109.5° | 110.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F1 | C6 | C5 | C1 | 179.7° | 179.9° |
| F1 | C6 | C5 | C4 | 179.4° | 179.8° |
| F1 | C6 | C5 | H5 | 0.6° | 0.1° |
| F1 | C6 | C1 | C2 | 179.5° | 179.8° |
| F1 | C6 | C1 | O | 0.6° | 0.2° |
| C6 | C5 | C4 | H5 | 180.0° | 179.9° |
| C6 | C5 | C4 | C3 | 0.7° | 0.0° |
| C6 | C5 | C4 | H4 | 179.3° | 180.0° |
| C5 | C6 | C1 | C2 | 0.8° | 0.0° |
| C5 | C6 | C1 | O | 179.6° | 180.0° |
| C1 | C6 | C5 | C4 | 0.9° | 0.0° |
| C1 | C6 | C5 | H5 | 179.1° | 179.9° |
| C6 | C1 | C2 | C3 | 0.5° | 0.0° |
| C6 | C1 | C2 | F2 | 179.5° | 179.9° |
| C6 | C1 | C2 | O | 178.8° | 180.0° |
| C6 | C1 | O | HO | 127.2° | 177.4° |
| C5 | C4 | C3 | H4 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.5° | 0.0° |
| C5 | C4 | C3 | H3 | 179.5° | 180.0° |
| H5 | C5 | C4 | C3 | 179.3° | 179.9° |
| H5 | C5 | C4 | H4 | 0.7° | 0.1° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C4 | C3 | C2 | F2 | 179.4° | 179.9° |
| C4 | C3 | C2 | C1 | 0.4° | 0.0° |
| H4 | C4 | C3 | C2 | 179.5° | 180.0° |
| H4 | C4 | C3 | H3 | 0.5° | 0.0° |
| C3 | C2 | F2 | C1 | 179.1° | 179.9° |
| C3 | C2 | C1 | O | 179.4° | 180.0° |
| H3 | C3 | C2 | F2 | 0.6° | 0.2° |
| H3 | C3 | C2 | C1 | 179.6° | 180.0° |
| F2 | C2 | C1 | O | 1.6° | 0.1° |
| C2 | C1 | O | HO | 54.0° | 2.6° |
