W0H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F | C8 | sing | 1.35Å | 1.27Å | |
| C8 | C9 | doub | 1.39Å | 1.36Å | Aromatic |
| C8 | C7 | sing | 1.38Å | 1.36Å | Aromatic |
| C9 | C10 | sing | 1.38Å | 1.34Å | Aromatic |
| C7 | C6 | doub | 1.38Å | 1.34Å | Aromatic |
| C10 | C5 | doub | 1.39Å | 1.38Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.34Å | Aromatic |
| C5 | O2 | sing | 1.36Å | 1.31Å | |
| O2 | C4 | sing | 1.43Å | 1.41Å | |
| C4 | C3 | sing | 1.51Å | 1.51Å | |
| O1 | C3 | doub | 1.21Å | 1.17Å | |
| C3 | N | sing | 1.35Å | 1.39Å | |
| N | C2 | sing | 1.47Å | 1.47Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C1 | O | sing | 1.43Å | 1.38Å | |
| C | O | sing | 1.43Å | 1.40Å | |
| C7 | H1 | sing | 1.08Å | 1.08Å | |
| C9 | H2 | sing | 1.08Å | 1.08Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C6 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C2 | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| N | H11 | sing | 0.97Å | 1.00Å | |
| C | H12 | sing | 1.09Å | 1.10Å | |
| C | H13 | sing | 1.09Å | 1.10Å | |
| C | H14 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F | C8 | C9 | 118.4° | 119.9° |
| F | C8 | C7 | 118.8° | 120.0° |
| C9 | C8 | C7 | 122.7° | 120.0° |
| C8 | C9 | C10 | 118.8° | 120.0° |
| C8 | C9 | H2 | 120.6° | 120.0° |
| C8 | C7 | C6 | 118.6° | 120.1° |
| C8 | C7 | H1 | 120.7° | 119.9° |
| C9 | C10 | C5 | 117.8° | 120.0° |
| C10 | C9 | H2 | 120.6° | 120.0° |
| C9 | C10 | H10 | 121.1° | 120.0° |
| C7 | C6 | C5 | 118.6° | 120.0° |
| C6 | C7 | H1 | 120.7° | 120.0° |
| C7 | C6 | H5 | 120.7° | 120.0° |
| C10 | C5 | C6 | 123.5° | 119.9° |
| C10 | C5 | O2 | 118.9° | 120.0° |
| C5 | C10 | H10 | 121.1° | 120.0° |
| C6 | C5 | O2 | 117.5° | 120.0° |
| C5 | C6 | H5 | 120.7° | 120.0° |
| C5 | O2 | C4 | 118.1° | 117.0° |
| O2 | C4 | C3 | 102.4° | 109.5° |
| O2 | C4 | H6 | 111.2° | 109.5° |
| O2 | C4 | H7 | 111.2° | 109.5° |
| C4 | C3 | O1 | 114.5° | 120.0° |
| C4 | C3 | N | 124.5° | 120.0° |
| C3 | C4 | H6 | 111.2° | 109.4° |
| C3 | C4 | H7 | 111.2° | 109.5° |
| O1 | C3 | N | 121.0° | 120.0° |
| C3 | N | C2 | 123.5° | 120.0° |
| C3 | N | H11 | 118.2° | 120.0° |
| N | C2 | C1 | 113.0° | 109.5° |
| N | C2 | H8 | 108.6° | 109.4° |
| N | C2 | H9 | 108.6° | 109.4° |
| C2 | N | H11 | 118.2° | 120.0° |
| C2 | C1 | O | 104.4° | 109.5° |
| C2 | C1 | H3 | 110.7° | 109.4° |
| C2 | C1 | H4 | 110.7° | 109.5° |
| C1 | C2 | H8 | 108.6° | 109.5° |
| C1 | C2 | H9 | 108.6° | 109.5° |
| C1 | O | C | 113.9° | 114.0° |
| O | C1 | H3 | 110.7° | 109.5° |
| O | C1 | H4 | 110.7° | 109.5° |
| O | C | H12 | 109.5° | 109.4° |
| O | C | H13 | 109.5° | 109.4° |
| O | C | H14 | 109.5° | 109.5° |
| H3 | C1 | H4 | 109.5° | 109.5° |
| H6 | C4 | H7 | 109.4° | 109.4° |
| H8 | C2 | H9 | 109.5° | 109.4° |
| H12 | C | H13 | 109.5° | 109.5° |
| H12 | C | H14 | 109.4° | 109.5° |
| H13 | C | H14 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F | C8 | C9 | C7 | 176.6° | 180.0° |
| F | C8 | C9 | C10 | 174.3° | 180.0° |
| F | C8 | C7 | C6 | 174.6° | 180.0° |
| F | C8 | C7 | H1 | 5.4° | 0.2° |
| F | C8 | C9 | H2 | 5.8° | 0.1° |
| C8 | C9 | C10 | H2 | 180.0° | 180.0° |
| C9 | C8 | C7 | C6 | 2.0° | 0.0° |
| C8 | C9 | C10 | C5 | 0.3° | 0.3° |
| C9 | C8 | C7 | H1 | 178.0° | 179.8° |
| C8 | C9 | C10 | H10 | 179.7° | 179.9° |
| C7 | C8 | C9 | C10 | 2.4° | 0.0° |
| C8 | C7 | C6 | H1 | 180.0° | 179.8° |
| C8 | C7 | C6 | C5 | 0.5° | 0.2° |
| C7 | C8 | C9 | H2 | 177.6° | 180.0° |
| C8 | C7 | C6 | H5 | 179.5° | 179.7° |
| C9 | C10 | C5 | H10 | 180.0° | 179.7° |
| C9 | C10 | C5 | C6 | 2.1° | 0.5° |
| C9 | C10 | C5 | O2 | 173.6° | 180.0° |
| C7 | C6 | C5 | C10 | 2.6° | 0.5° |
| C7 | C6 | C5 | H5 | 180.0° | 179.9° |
| C7 | C6 | C5 | O2 | 173.3° | 180.0° |
| C10 | C5 | C6 | O2 | 175.8° | 179.5° |
| C10 | C5 | O2 | C4 | 66.3° | 0.5° |
| C5 | C10 | C9 | H2 | 179.7° | 179.8° |
| C10 | C5 | C6 | H5 | 177.5° | 179.5° |
| C6 | C5 | O2 | C4 | 117.7° | 180.0° |
| C5 | C6 | C7 | H1 | 179.5° | 180.0° |
| C6 | C5 | C10 | H10 | 177.9° | 179.8° |
| C5 | O2 | C4 | C3 | 152.3° | 180.0° |
| O2 | C5 | C6 | H5 | 6.7° | 0.0° |
| C5 | O2 | C4 | H6 | 88.9° | 60.0° |
| C5 | O2 | C4 | H7 | 33.4° | 60.0° |
| O2 | C5 | C10 | H10 | 6.4° | 0.3° |
| O2 | C4 | C3 | H6 | 118.9° | 120.0° |
| O2 | C4 | C3 | H7 | 118.9° | 120.1° |
| O2 | C4 | C3 | O1 | 59.6° | 0.1° |
| O2 | C4 | C3 | N | 119.6° | 180.0° |
| O2 | C4 | H6 | H7 | 123.3° | 120.1° |
| C4 | C3 | O1 | N | 179.3° | 179.9° |
| C4 | C3 | N | C2 | 1.7° | 180.0° |
| C3 | C4 | H6 | H7 | 123.3° | 120.0° |
| C4 | C3 | N | H11 | 178.3° | 0.1° |
| O1 | C3 | N | C2 | 179.1° | 0.0° |
| O1 | C3 | C4 | H6 | 178.5° | 120.0° |
| O1 | C3 | C4 | H7 | 59.3° | 120.0° |
| O1 | C3 | N | H11 | 0.9° | 180.0° |
| C3 | N | C2 | H11 | 180.0° | 179.9° |
| C3 | N | C2 | C1 | 134.4° | 180.0° |
| N | C3 | C4 | H6 | 0.7° | 60.1° |
| N | C3 | C4 | H7 | 121.5° | 59.9° |
| C3 | N | C2 | H8 | 13.9° | 60.0° |
| C3 | N | C2 | H9 | 105.0° | 59.9° |
| N | C2 | C1 | H8 | 120.5° | 120.0° |
| N | C2 | C1 | H9 | 120.5° | 120.0° |
| N | C2 | C1 | O | 98.4° | 65.0° |
| N | C2 | C1 | H3 | 20.8° | 175.0° |
| N | C2 | C1 | H4 | 142.4° | 55.0° |
| N | C2 | H8 | H9 | 118.4° | 119.9° |
| C2 | C1 | O | H3 | 119.2° | 120.0° |
| C2 | C1 | O | H4 | 119.2° | 120.0° |
| C2 | C1 | O | C | 61.4° | 180.0° |
| C2 | C1 | H3 | H4 | 122.3° | 120.0° |
| C1 | C2 | H8 | H9 | 118.4° | 120.1° |
| C1 | C2 | N | H11 | 45.5° | 0.0° |
| O | C1 | H3 | H4 | 122.3° | 120.0° |
| O | C1 | C2 | H8 | 141.1° | 175.0° |
| O | C1 | C2 | H9 | 22.2° | 55.0° |
| C1 | O | C | H12 | 180.0° | 60.0° |
| C1 | O | C | H13 | 60.0° | 60.0° |
| C1 | O | C | H14 | 60.0° | 180.0° |
| C | O | C1 | H3 | 179.4° | 60.0° |
| C | O | C1 | H4 | 57.8° | 60.0° |
| O | C | H12 | H13 | 120.0° | 120.0° |
| O | C | H12 | H14 | 120.0° | 120.0° |
| O | C | H13 | H14 | 120.0° | 120.0° |
| H1 | C7 | C6 | H5 | 0.5° | 0.1° |
| H2 | C9 | C10 | H10 | 0.3° | 0.1° |
| H3 | C1 | C2 | H8 | 99.7° | 55.0° |
| H3 | C1 | C2 | H9 | 141.3° | 65.0° |
| H4 | C1 | C2 | H8 | 21.9° | 65.0° |
| H4 | C1 | C2 | H9 | 97.1° | 175.0° |
| H8 | C2 | N | H11 | 166.1° | 120.1° |
| H9 | C2 | N | H11 | 75.0° | 120.0° |
| H12 | C | H13 | H14 | 119.9° | 120.0° |
