FU2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.42Å | 1.45Å | |
| C1 | OXT | doub | 1.25Å | 53.78Å | |
| C1 | H1 | sing | 1.13Å | 1.10Å | |
| C2 | O3 | sing | 1.36Å | 1.35Å | Aromatic |
| C2 | C6 | doub | 1.38Å | 1.33Å | Aromatic |
| O3 | C4 | sing | 1.36Å | 1.34Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.35Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.10Å | |
| C5 | C6 | sing | 1.42Å | 1.48Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.10Å | |
| C6 | H6 | sing | 1.08Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | OXT | 104.9° | 124.3° |
| C2 | C1 | H1 | 76.6° | 118.8° |
| C1 | C2 | O3 | 119.5° | 117.9° |
| C1 | C2 | C6 | 122.9° | 131.5° |
| OXT | C1 | H1 | 178.5° | 116.9° |
| O3 | C2 | C6 | 117.6° | 110.6° |
| C2 | O3 | C4 | 100.1° | 106.6° |
| C2 | C6 | C5 | 102.4° | 106.1° |
| C2 | C6 | H6 | 125.1° | 126.5° |
| O3 | C4 | C5 | 117.0° | 110.6° |
| O3 | C4 | H4 | 121.3° | 115.6° |
| C5 | C4 | H4 | 121.8° | 133.8° |
| C4 | C5 | C6 | 102.9° | 106.1° |
| C4 | C5 | H5 | 125.2° | 126.3° |
| C6 | C5 | H5 | 132.0° | 127.6° |
| C5 | C6 | H6 | 132.5° | 127.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | OXT | H1 | 179.4° | 180.0° |
| C1 | C2 | O3 | C6 | 179.8° | 180.0° |
| C1 | C2 | O3 | C4 | 179.9° | 179.9° |
| C1 | C2 | C6 | C5 | 179.8° | 180.0° |
| C1 | C2 | C6 | H6 | 0.2° | 0.1° |
| OXT | C1 | C2 | O3 | 4.8° | 180.0° |
| OXT | C1 | C2 | C6 | 175.4° | 0.0° |
| H1 | C1 | C2 | O3 | 175.2° | 0.0° |
| H1 | C1 | C2 | C6 | 4.6° | 180.0° |
| C2 | O3 | C4 | C5 | 0.1° | 0.1° |
| C2 | O3 | C4 | H4 | 179.8° | 180.0° |
| O3 | C2 | C6 | C5 | 0.0° | 0.0° |
| O3 | C2 | C6 | H6 | 180.0° | 179.9° |
| C6 | C2 | O3 | C4 | 0.1° | 0.1° |
| C2 | C6 | C5 | C4 | 0.1° | 0.0° |
| C2 | C6 | C5 | H6 | 180.0° | 179.9° |
| C2 | C6 | C5 | H5 | 179.9° | 180.0° |
| O3 | C4 | C5 | H4 | 180.0° | 179.9° |
| O3 | C4 | C5 | C6 | 0.2° | 0.0° |
| O3 | C4 | C5 | H5 | 179.8° | 180.0° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | H6 | 179.9° | 179.9° |
| H4 | C4 | C5 | C6 | 179.8° | 179.9° |
| H4 | C4 | C5 | H5 | 0.2° | 0.1° |
| H5 | C5 | C6 | H6 | 0.1° | 0.1° |
