P9P
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O07 | N05 | sing | 1.22Å | 1.22Å | |
| N05 | O06 | doub | 1.22Å | 1.35Å | |
| N05 | C04 | sing | 1.48Å | 1.40Å | |
| C04 | C03 | doub | 1.38Å | 1.38Å | Aromatic |
| C04 | C08 | sing | 1.38Å | 1.38Å | Aromatic |
| C03 | C02 | sing | 1.38Å | 1.38Å | Aromatic |
| C08 | C09 | doub | 1.38Å | 1.39Å | Aromatic |
| C02 | CL1 | sing | 1.74Å | 1.73Å | |
| C02 | C10 | doub | 1.39Å | 1.38Å | Aromatic |
| C09 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C10 | O11 | sing | 1.36Å | 1.40Å | |
| C03 | H1 | sing | 1.08Å | 1.08Å | |
| C08 | H2 | sing | 1.08Å | 1.08Å | |
| C09 | H3 | sing | 1.08Å | 1.08Å | |
| O11 | H4 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O07 | N05 | O06 | 122.3° | 120.0° |
| O07 | N05 | C04 | 119.8° | 120.0° |
| O06 | N05 | C04 | 117.9° | 120.0° |
| N05 | C04 | C03 | 118.5° | 120.0° |
| N05 | C04 | C08 | 119.2° | 120.0° |
| C03 | C04 | C08 | 122.3° | 120.1° |
| C04 | C03 | C02 | 117.7° | 120.1° |
| C04 | C03 | H1 | 121.1° | 120.0° |
| C04 | C08 | C09 | 119.4° | 120.1° |
| C04 | C08 | H2 | 120.3° | 119.9° |
| C03 | C02 | CL1 | 119.9° | 120.0° |
| C03 | C02 | C10 | 121.0° | 119.9° |
| C02 | C03 | H1 | 121.2° | 120.0° |
| C08 | C09 | C10 | 118.5° | 120.0° |
| C09 | C08 | H2 | 120.3° | 120.0° |
| C08 | C09 | H3 | 120.7° | 120.0° |
| CL1 | C02 | C10 | 119.2° | 120.1° |
| C02 | C10 | C09 | 121.1° | 119.9° |
| C02 | C10 | O11 | 119.4° | 120.0° |
| C09 | C10 | O11 | 119.5° | 120.1° |
| C10 | C09 | H3 | 120.8° | 120.0° |
| C10 | O11 | H4 | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O07 | N05 | O06 | C04 | 179.4° | 180.0° |
| O07 | N05 | C04 | C03 | 11.5° | 180.0° |
| O07 | N05 | C04 | C08 | 168.8° | 0.1° |
| O06 | N05 | C04 | C03 | 167.9° | 0.0° |
| O06 | N05 | C04 | C08 | 11.8° | 179.9° |
| N05 | C04 | C03 | C08 | 179.6° | 179.9° |
| N05 | C04 | C03 | C02 | 179.8° | 180.0° |
| N05 | C04 | C08 | C09 | 179.8° | 180.0° |
| N05 | C04 | C03 | H1 | 0.2° | 0.0° |
| N05 | C04 | C08 | H2 | 0.2° | 0.1° |
| C04 | C03 | C02 | H1 | 180.0° | 180.0° |
| C03 | C04 | C08 | C09 | 0.6° | 0.0° |
| C04 | C03 | C02 | CL1 | 179.2° | 180.0° |
| C04 | C03 | C02 | C10 | 0.7° | 0.3° |
| C03 | C04 | C08 | H2 | 179.4° | 180.0° |
| C08 | C04 | C03 | C02 | 0.6° | 0.0° |
| C04 | C08 | C09 | H2 | 180.0° | 179.9° |
| C04 | C08 | C09 | C10 | 0.6° | 0.3° |
| C08 | C04 | C03 | H1 | 179.4° | 180.0° |
| C04 | C08 | C09 | H3 | 179.4° | 180.0° |
| C03 | C02 | CL1 | C10 | 178.5° | 179.7° |
| C03 | C02 | C10 | C09 | 0.8° | 0.5° |
| C03 | C02 | C10 | O11 | 179.7° | 179.8° |
| C08 | C09 | C10 | C02 | 0.7° | 0.5° |
| C08 | C09 | C10 | H3 | 180.0° | 179.7° |
| C08 | C09 | C10 | O11 | 179.8° | 179.8° |
| CL1 | C02 | C10 | C09 | 179.3° | 179.8° |
| CL1 | C02 | C10 | O11 | 1.2° | 0.0° |
| CL1 | C02 | C03 | H1 | 0.8° | 0.0° |
| C02 | C10 | C09 | O11 | 179.5° | 179.7° |
| C10 | C02 | C03 | H1 | 179.3° | 179.7° |
| C02 | C10 | C09 | H3 | 179.3° | 179.7° |
| C02 | C10 | O11 | H4 | 180.0° | 90.0° |
| C10 | C09 | C08 | H2 | 179.4° | 179.8° |
| C09 | C10 | O11 | H4 | 0.5° | 89.7° |
| O11 | C10 | C09 | H3 | 0.3° | 0.0° |
| H2 | C08 | C09 | H3 | 0.6° | 0.1° |
