FXK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C08 | C04 | sing | 1.51Å | 1.52Å | |
| C08 | O01 | sing | 1.43Å | 1.40Å | |
| C07 | C03 | doub | 1.40Å | 1.57Å | Aromatic |
| C07 | C10 | sing | 1.37Å | 1.50Å | Aromatic |
| C04 | C03 | sing | 1.46Å | 1.36Å | Aromatic |
| C04 | C06 | doub | 1.34Å | 1.39Å | Aromatic |
| C03 | C05 | sing | 1.41Å | 1.39Å | Aromatic |
| C10 | C11 | doub | 1.39Å | 1.48Å | Aromatic |
| C06 | N02 | sing | 1.37Å | 1.37Å | Aromatic |
| C05 | N02 | sing | 1.38Å | 1.37Å | Aromatic |
| C05 | C09 | doub | 1.39Å | 1.57Å | Aromatic |
| C11 | C09 | sing | 1.38Å | 1.50Å | Aromatic |
| C10 | H101 | sing | 1.08Å | 1.08Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C07 | H071 | sing | 1.08Å | 1.08Å | |
| C08 | H081 | sing | 1.09Å | 1.10Å | |
| C08 | H082 | sing | 1.09Å | 1.10Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.08Å | 1.08Å | |
| N02 | H021 | sing | 0.97Å | 1.00Å | |
| O01 | H011 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C04 | C08 | O01 | 108.3° | 109.5° |
| C08 | C04 | C03 | 126.3° | 126.5° |
| C08 | C04 | C06 | 125.2° | 126.5° |
| C04 | C08 | H081 | 109.8° | 109.5° |
| C04 | C08 | H082 | 109.7° | 109.5° |
| O01 | C08 | H081 | 109.7° | 109.5° |
| O01 | C08 | H082 | 109.8° | 109.4° |
| C08 | O01 | H011 | 109.5° | 114.0° |
| C03 | C07 | C10 | 119.8° | 119.8° |
| C07 | C03 | C04 | 132.3° | 134.0° |
| C07 | C03 | C05 | 120.2° | 119.9° |
| C03 | C07 | H071 | 120.1° | 120.1° |
| C07 | C10 | C11 | 120.1° | 120.5° |
| C07 | C10 | H101 | 119.9° | 119.7° |
| C10 | C07 | H071 | 120.1° | 120.1° |
| C03 | C04 | C06 | 108.5° | 107.0° |
| C04 | C03 | C05 | 107.5° | 106.0° |
| C04 | C06 | N02 | 107.7° | 110.0° |
| C04 | C06 | H061 | 126.1° | 125.1° |
| C03 | C05 | N02 | 108.1° | 107.2° |
| C03 | C05 | C09 | 120.4° | 119.3° |
| C10 | C11 | C09 | 119.5° | 120.7° |
| C11 | C10 | H101 | 120.0° | 119.8° |
| C10 | C11 | H111 | 120.2° | 119.7° |
| C06 | N02 | C05 | 108.2° | 109.8° |
| N02 | C06 | H061 | 126.2° | 125.0° |
| C06 | N02 | H021 | 125.9° | 125.1° |
| N02 | C05 | C09 | 131.4° | 133.5° |
| C05 | N02 | H021 | 125.9° | 125.0° |
| C05 | C09 | C11 | 119.9° | 119.8° |
| C05 | C09 | H091 | 120.1° | 120.1° |
| C11 | C09 | H091 | 120.0° | 120.1° |
| C09 | C11 | H111 | 120.2° | 119.6° |
| H081 | C08 | H082 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C04 | C08 | O01 | H081 | 119.8° | 120.0° |
| C04 | C08 | O01 | H082 | 119.8° | 120.0° |
| C08 | C04 | C03 | C07 | 1.3° | 0.3° |
| C08 | C04 | C03 | C06 | 179.0° | 180.0° |
| C08 | C04 | C03 | C05 | 179.5° | 180.0° |
| C08 | C04 | C06 | N02 | 179.3° | 180.0° |
| C08 | C04 | C06 | H061 | 0.7° | 0.0° |
| C04 | C08 | H081 | H082 | 120.5° | 120.0° |
| C04 | C08 | O01 | H011 | 180.0° | 180.0° |
| O01 | C08 | C04 | C03 | 91.6° | 179.9° |
| O01 | C08 | C04 | C06 | 87.2° | 0.1° |
| O01 | C08 | H081 | H082 | 120.6° | 120.0° |
| C03 | C07 | C10 | H071 | 180.0° | 179.9° |
| C07 | C03 | C04 | C05 | 179.2° | 179.7° |
| C07 | C03 | C04 | C06 | 179.7° | 179.7° |
| C03 | C07 | C10 | C11 | 0.2° | 0.0° |
| C07 | C03 | C05 | N02 | 179.8° | 179.8° |
| C07 | C03 | C05 | C09 | 0.1° | 0.2° |
| C03 | C07 | C10 | H101 | 179.9° | 179.7° |
| C10 | C07 | C03 | C04 | 179.4° | 179.7° |
| C10 | C07 | C03 | C05 | 0.3° | 0.0° |
| C07 | C10 | C11 | H101 | 180.0° | 179.7° |
| C07 | C10 | C11 | C09 | 0.1° | 0.2° |
| C07 | C10 | C11 | H111 | 179.9° | 179.7° |
| C03 | C04 | C06 | N02 | 0.3° | 0.0° |
| C04 | C03 | C05 | N02 | 0.5° | 0.0° |
| C04 | C03 | C05 | C09 | 179.4° | 180.0° |
| C03 | C04 | C06 | H061 | 179.7° | 180.0° |
| C04 | C03 | C07 | H071 | 0.6° | 0.4° |
| C03 | C04 | C08 | H081 | 148.6° | 60.0° |
| C03 | C04 | C08 | H082 | 28.2° | 60.0° |
| C06 | C04 | C03 | C05 | 0.5° | 0.0° |
| C04 | C06 | N02 | H061 | 180.0° | 179.9° |
| C04 | C06 | N02 | C05 | 0.0° | 0.0° |
| C06 | C04 | C08 | H081 | 32.6° | 120.0° |
| C06 | C04 | C08 | H082 | 152.9° | 120.0° |
| C04 | C06 | N02 | H021 | 180.0° | 180.0° |
| C03 | C05 | N02 | C06 | 0.3° | 0.0° |
| C03 | C05 | N02 | C09 | 179.9° | 180.0° |
| C03 | C05 | C09 | C11 | 0.2° | 0.5° |
| C05 | C03 | C07 | H071 | 179.8° | 179.9° |
| C03 | C05 | C09 | H091 | 179.8° | 180.0° |
| C03 | C05 | N02 | H021 | 179.7° | 179.9° |
| C10 | C11 | C09 | C05 | 0.3° | 0.5° |
| C10 | C11 | C09 | H111 | 180.0° | 180.0° |
| C11 | C10 | C07 | H071 | 179.9° | 179.9° |
| C10 | C11 | C09 | H091 | 179.7° | 180.0° |
| C06 | N02 | C05 | H021 | 180.0° | 179.9° |
| C06 | N02 | C05 | C09 | 179.6° | 180.0° |
| N02 | C05 | C09 | C11 | 179.9° | 179.5° |
| C05 | N02 | C06 | H061 | 180.0° | 180.0° |
| N02 | C05 | C09 | H091 | 0.1° | 0.0° |
| C05 | C09 | C11 | H091 | 180.0° | 179.5° |
| C05 | C09 | C11 | H111 | 179.7° | 179.5° |
| C09 | C05 | N02 | H021 | 0.4° | 0.1° |
| C09 | C11 | C10 | H101 | 179.9° | 180.0° |
| H101 | C10 | C07 | H071 | 0.1° | 0.3° |
| H101 | C10 | C11 | H111 | 0.2° | 0.0° |
| H061 | C06 | N02 | H021 | 0.0° | 0.1° |
| H081 | C08 | O01 | H011 | 60.2° | 60.0° |
| H082 | C08 | O01 | H011 | 60.2° | 60.0° |
| H091 | C09 | C11 | H111 | 0.3° | 0.0° |
