OW7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O12 | C10 | doub | 1.21Å | 1.26Å | |
| O11 | C10 | sing | 1.35Å | 1.26Å | |
| C10 | C08 | sing | 1.48Å | 1.53Å | |
| C09 | C08 | doub | 1.40Å | 1.39Å | Aromatic |
| C09 | C04 | sing | 1.38Å | 1.39Å | Aromatic |
| C08 | C07 | sing | 1.40Å | 1.39Å | Aromatic |
| C02 | O03 | sing | 1.43Å | 1.40Å | |
| C02 | C01 | sing | 1.53Å | 1.53Å | |
| O03 | C04 | sing | 1.36Å | 1.40Å | |
| C04 | C05 | doub | 1.39Å | 1.39Å | Aromatic |
| C07 | C06 | doub | 1.38Å | 1.39Å | Aromatic |
| C05 | C06 | sing | 1.38Å | 1.38Å | Aromatic |
| C01 | H1 | sing | 1.09Å | 1.10Å | |
| C01 | H2 | sing | 1.09Å | 1.10Å | |
| C01 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.09Å | 1.10Å | |
| C02 | H5 | sing | 1.09Å | 1.10Å | |
| C05 | H6 | sing | 1.08Å | 1.08Å | |
| C06 | H7 | sing | 1.08Å | 1.08Å | |
| C07 | H8 | sing | 1.08Å | 1.08Å | |
| C09 | H9 | sing | 1.08Å | 1.08Å | |
| O11 | H10 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O12 | C10 | O11 | 120.1° | 120.0° |
| O12 | C10 | C08 | 119.7° | 120.1° |
| O11 | C10 | C08 | 120.2° | 120.0° |
| C10 | O11 | H10 | 109.5° | 117.0° |
| C10 | C08 | C09 | 120.0° | 120.1° |
| C10 | C08 | C07 | 119.9° | 120.2° |
| C08 | C09 | C04 | 119.9° | 119.8° |
| C09 | C08 | C07 | 120.1° | 119.7° |
| C08 | C09 | H9 | 120.0° | 120.1° |
| C09 | C04 | O03 | 120.0° | 120.0° |
| C09 | C04 | C05 | 119.9° | 120.1° |
| C04 | C09 | H9 | 120.1° | 120.1° |
| C08 | C07 | C06 | 120.0° | 120.0° |
| C08 | C07 | H8 | 120.0° | 120.0° |
| O03 | C02 | C01 | 108.4° | 109.5° |
| C02 | O03 | C04 | 114.7° | 117.0° |
| O03 | C02 | H4 | 109.8° | 109.4° |
| O03 | C02 | H5 | 109.8° | 109.5° |
| C02 | C01 | H1 | 109.5° | 109.5° |
| C02 | C01 | H2 | 109.5° | 109.5° |
| C02 | C01 | H3 | 109.5° | 109.5° |
| C01 | C02 | H4 | 109.7° | 109.5° |
| C01 | C02 | H5 | 109.7° | 109.5° |
| O03 | C04 | C05 | 120.2° | 120.0° |
| C04 | C05 | C06 | 120.2° | 120.3° |
| C04 | C05 | H6 | 119.9° | 119.9° |
| C07 | C06 | C05 | 119.9° | 120.2° |
| C07 | C06 | H7 | 120.1° | 119.9° |
| C06 | C07 | H8 | 120.0° | 120.1° |
| C06 | C05 | H6 | 119.9° | 119.9° |
| C05 | C06 | H7 | 120.1° | 119.9° |
| H1 | C01 | H2 | 109.5° | 109.5° |
| H1 | C01 | H3 | 109.5° | 109.5° |
| H2 | C01 | H3 | 109.5° | 109.5° |
| H4 | C02 | H5 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O12 | C10 | O11 | C08 | 180.0° | 179.7° |
| O12 | C10 | C08 | C09 | 15.6° | 0.3° |
| O12 | C10 | C08 | C07 | 164.2° | 179.6° |
| O12 | C10 | O11 | H10 | 0.0° | 0.3° |
| O11 | C10 | C08 | C09 | 164.4° | 179.9° |
| O11 | C10 | C08 | C07 | 15.7° | 0.0° |
| C10 | C08 | C09 | C07 | 179.9° | 179.9° |
| C10 | C08 | C09 | C04 | 179.9° | 180.0° |
| C10 | C08 | C07 | C06 | 180.0° | 180.0° |
| C10 | C08 | C07 | H8 | 0.0° | 0.1° |
| C10 | C08 | C09 | H9 | 0.1° | 0.0° |
| C08 | C10 | O11 | H10 | 179.9° | 180.0° |
| C08 | C09 | C04 | H9 | 180.0° | 180.0° |
| C08 | C09 | C04 | O03 | 179.6° | 179.8° |
| C08 | C09 | C04 | C05 | 0.1° | 0.0° |
| C09 | C08 | C07 | C06 | 0.1° | 0.1° |
| C09 | C08 | C07 | H8 | 179.9° | 180.0° |
| C04 | C09 | C08 | C07 | 0.0° | 0.0° |
| C09 | C04 | O03 | C02 | 128.1° | 179.7° |
| C09 | C04 | O03 | C05 | 179.5° | 179.8° |
| C09 | C04 | C05 | C06 | 0.4° | 0.0° |
| C09 | C04 | C05 | H6 | 179.6° | 180.0° |
| C08 | C07 | C06 | H8 | 180.0° | 179.9° |
| C08 | C07 | C06 | C05 | 0.3° | 0.1° |
| C08 | C07 | C06 | H7 | 179.7° | 179.9° |
| C07 | C08 | C09 | H9 | 180.0° | 179.9° |
| O03 | C02 | C01 | H4 | 119.9° | 120.0° |
| O03 | C02 | C01 | H5 | 119.9° | 120.0° |
| C02 | O03 | C04 | C05 | 52.4° | 0.0° |
| O03 | C02 | C01 | H1 | 180.0° | 180.0° |
| O03 | C02 | C01 | H2 | 60.0° | 60.0° |
| O03 | C02 | C01 | H3 | 60.0° | 60.0° |
| O03 | C02 | H4 | H5 | 120.5° | 120.0° |
| C01 | C02 | O03 | C04 | 113.0° | 180.0° |
| C02 | C01 | H1 | H2 | 120.0° | 120.0° |
| C02 | C01 | H1 | H3 | 120.0° | 120.0° |
| C02 | C01 | H2 | H3 | 120.0° | 120.0° |
| C01 | C02 | H4 | H5 | 120.4° | 120.1° |
| O03 | C04 | C05 | C06 | 179.9° | 179.8° |
| C04 | O03 | C02 | H4 | 127.1° | 60.0° |
| C04 | O03 | C02 | H5 | 6.8° | 59.9° |
| O03 | C04 | C05 | H6 | 0.1° | 0.2° |
| O03 | C04 | C09 | H9 | 0.3° | 0.2° |
| C04 | C05 | C06 | C07 | 0.4° | 0.0° |
| C04 | C05 | C06 | H6 | 180.0° | 180.0° |
| C04 | C05 | C06 | H7 | 179.6° | 179.9° |
| C05 | C04 | C09 | H9 | 179.8° | 180.0° |
| C07 | C06 | C05 | H7 | 180.0° | 180.0° |
| C07 | C06 | C05 | H6 | 179.6° | 180.0° |
| C05 | C06 | C07 | H8 | 179.7° | 180.0° |
| H1 | C01 | H2 | H3 | 120.0° | 120.0° |
| H1 | C01 | C02 | H4 | 60.1° | 60.0° |
| H1 | C01 | C02 | H5 | 60.1° | 60.0° |
| H2 | C01 | C02 | H4 | 179.9° | 60.0° |
| H2 | C01 | C02 | H5 | 59.9° | 180.0° |
| H3 | C01 | C02 | H4 | 59.9° | 180.0° |
| H3 | C01 | C02 | H5 | 179.9° | 60.0° |
| H6 | C05 | C06 | H7 | 0.4° | 0.1° |
| H7 | C06 | C07 | H8 | 0.3° | 0.0° |
