I7W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C06 | C05 | doub | 1.36Å | 1.38Å | Aromatic |
| C06 | C07 | sing | 1.41Å | 1.40Å | Aromatic |
| C08 | C07 | sing | 1.40Å | 1.40Å | Aromatic |
| C08 | C09 | doub | 1.36Å | 1.38Å | Aromatic |
| C05 | C04 | sing | 1.41Å | 1.39Å | Aromatic |
| F10 | C09 | sing | 1.35Å | 1.37Å | |
| C07 | C13 | doub | 1.42Å | 1.38Å | Aromatic |
| O01 | C02 | doub | 1.22Å | 1.26Å | |
| C09 | C11 | sing | 1.40Å | 1.39Å | Aromatic |
| C04 | C02 | sing | 1.48Å | 1.52Å | |
| C04 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.40Å | 1.42Å | Aromatic |
| C13 | C12 | sing | 1.41Å | 1.40Å | Aromatic |
| C02 | O03 | sing | 1.35Å | 1.26Å | |
| C11 | C12 | doub | 1.36Å | 1.39Å | Aromatic |
| O03 | H1 | sing | 0.97Å | 0.95Å | |
| C05 | H2 | sing | 1.08Å | 1.08Å | |
| C06 | H3 | sing | 1.08Å | 1.08Å | |
| C08 | H4 | sing | 1.08Å | 1.08Å | |
| C11 | H5 | sing | 1.08Å | 1.08Å | |
| C12 | H6 | sing | 1.08Å | 1.08Å | |
| C14 | H7 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C05 | C06 | C07 | 119.5° | 120.0° |
| C06 | C05 | C04 | 120.2° | 120.8° |
| C06 | C05 | H2 | 119.9° | 119.6° |
| C05 | C06 | H3 | 120.3° | 120.0° |
| C06 | C07 | C08 | 118.4° | 121.0° |
| C06 | C07 | C13 | 120.8° | 119.7° |
| C07 | C06 | H3 | 120.2° | 120.0° |
| C07 | C08 | C09 | 119.6° | 119.7° |
| C08 | C07 | C13 | 120.8° | 119.3° |
| C07 | C08 | H4 | 120.2° | 120.1° |
| C08 | C09 | F10 | 119.0° | 119.5° |
| C08 | C09 | C11 | 120.1° | 120.9° |
| C09 | C08 | H4 | 120.2° | 120.2° |
| C05 | C04 | C02 | 116.5° | 119.7° |
| C05 | C04 | C14 | 121.2° | 120.5° |
| C04 | C05 | H2 | 119.9° | 119.6° |
| F10 | C09 | C11 | 120.9° | 119.5° |
| C07 | C13 | C14 | 120.0° | 119.5° |
| C07 | C13 | C12 | 119.2° | 119.5° |
| O01 | C02 | C04 | 118.0° | 120.0° |
| O01 | C02 | O03 | 120.6° | 120.0° |
| C09 | C11 | C12 | 120.3° | 121.0° |
| C09 | C11 | H5 | 119.8° | 119.5° |
| C02 | C04 | C14 | 122.4° | 119.8° |
| C04 | C02 | O03 | 121.4° | 120.0° |
| C04 | C14 | C13 | 118.3° | 119.5° |
| C04 | C14 | H7 | 120.8° | 120.3° |
| C14 | C13 | C12 | 120.7° | 121.1° |
| C13 | C14 | H7 | 120.8° | 120.3° |
| C13 | C12 | C11 | 120.0° | 119.6° |
| C13 | C12 | H6 | 120.0° | 120.2° |
| C02 | O03 | H1 | 109.5° | 117.0° |
| C12 | C11 | H5 | 119.9° | 119.5° |
| C11 | C12 | H6 | 120.0° | 120.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C05 | C06 | C07 | H3 | 180.0° | 179.1° |
| C05 | C06 | C07 | C08 | 179.8° | 179.5° |
| C06 | C05 | C04 | H2 | 180.0° | 179.4° |
| C05 | C06 | C07 | C13 | 0.1° | 0.6° |
| C06 | C05 | C04 | C02 | 179.8° | 179.4° |
| C06 | C05 | C04 | C14 | 0.4° | 0.6° |
| C06 | C07 | C08 | C13 | 179.9° | 179.9° |
| C06 | C07 | C08 | C09 | 179.9° | 180.0° |
| C07 | C06 | C05 | C04 | 0.2° | 0.9° |
| C06 | C07 | C13 | C14 | 0.1° | 0.0° |
| C06 | C07 | C13 | C12 | 179.8° | 179.7° |
| C07 | C06 | C05 | H2 | 179.8° | 179.7° |
| C06 | C07 | C08 | H4 | 0.1° | 0.1° |
| C07 | C08 | C09 | H4 | 180.0° | 180.0° |
| C07 | C08 | C09 | F10 | 180.0° | 180.0° |
| C07 | C08 | C09 | C11 | 0.0° | 0.1° |
| C08 | C07 | C13 | C14 | 179.8° | 180.0° |
| C08 | C07 | C13 | C12 | 0.1° | 0.2° |
| C08 | C07 | C06 | H3 | 0.2° | 0.4° |
| C08 | C09 | F10 | C11 | 180.0° | 180.0° |
| C09 | C08 | C07 | C13 | 0.1° | 0.1° |
| C08 | C09 | C11 | C12 | 0.1° | 0.2° |
| C08 | C09 | C11 | H5 | 179.9° | 180.0° |
| C05 | C04 | C02 | O01 | 25.5° | 179.9° |
| C05 | C04 | C02 | C14 | 179.5° | 180.0° |
| C05 | C04 | C14 | C13 | 0.4° | 0.0° |
| C05 | C04 | C02 | O03 | 154.4° | 0.0° |
| C04 | C05 | C06 | H3 | 179.8° | 180.0° |
| C05 | C04 | C14 | H7 | 179.6° | 179.9° |
| F10 | C09 | C11 | C12 | 179.9° | 179.8° |
| F10 | C09 | C08 | H4 | 0.0° | 0.0° |
| F10 | C09 | C11 | H5 | 0.1° | 0.0° |
| C07 | C13 | C14 | C04 | 0.3° | 0.2° |
| C07 | C13 | C14 | C12 | 179.7° | 179.8° |
| C07 | C13 | C12 | C11 | 0.2° | 0.4° |
| C13 | C07 | C06 | H3 | 179.9° | 179.7° |
| C13 | C07 | C08 | H4 | 179.9° | 180.0° |
| C07 | C13 | C12 | H6 | 179.8° | 179.8° |
| C07 | C13 | C14 | H7 | 179.7° | 179.8° |
| O01 | C02 | C04 | O03 | 179.9° | 180.0° |
| O01 | C02 | C04 | C14 | 154.0° | 0.0° |
| O01 | C02 | O03 | H1 | 0.0° | 0.0° |
| C09 | C11 | C12 | C13 | 0.2° | 0.4° |
| C09 | C11 | C12 | H5 | 180.0° | 179.8° |
| C11 | C09 | C08 | H4 | 180.0° | 180.0° |
| C09 | C11 | C12 | H6 | 179.8° | 179.8° |
| C02 | C04 | C14 | C13 | 179.8° | 180.0° |
| C04 | C02 | O03 | H1 | 179.9° | 179.9° |
| C02 | C04 | C05 | H2 | 0.2° | 0.0° |
| C02 | C04 | C14 | H7 | 0.2° | 0.0° |
| C04 | C14 | C13 | H7 | 180.0° | 180.0° |
| C04 | C14 | C13 | C12 | 179.9° | 180.0° |
| C14 | C04 | C02 | O03 | 26.1° | 180.0° |
| C14 | C04 | C05 | H2 | 179.7° | 180.0° |
| C14 | C13 | C12 | C11 | 179.9° | 179.8° |
| C14 | C13 | C12 | H6 | 0.1° | 0.0° |
| C13 | C12 | C11 | H6 | 180.0° | 179.8° |
| C13 | C12 | C11 | H5 | 179.7° | 179.8° |
| C12 | C13 | C14 | H7 | 0.0° | 0.0° |
| H2 | C05 | C06 | H3 | 0.2° | 0.6° |
| H5 | C11 | C12 | H6 | 0.2° | 0.0° |
