CP5
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.40Å | 1.37Å | Aromatic |
| C1 | C6 | sing | 1.40Å | 1.35Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.10Å | |
| C2 | C3 | sing | 1.36Å | 1.37Å | Aromatic |
| C2 | H2 | sing | 1.08Å | 1.10Å | |
| C3 | C4 | doub | 1.48Å | 1.41Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.10Å | |
| C4 | C5 | sing | 1.48Å | 1.41Å | Aromatic |
| C4 | C7 | sing | 1.39Å | 1.45Å | |
| C5 | C6 | doub | 1.35Å | 1.37Å | Aromatic |
| C5 | H5 | sing | 1.08Å | 1.10Å | |
| C6 | H6 | sing | 1.08Å | 1.10Å | |
| C7 | C8 | doub | 1.48Å | 1.37Å | |
| C7 | C9 | sing | 1.49Å | 1.48Å | |
| C8 | O1 | sing | 1.22Å | 1.35Å | |
| C8 | H8 | sing | 1.08Å | 1.10Å | |
| C9 | O4 | sing | 1.22Å | 1.28Å | |
| C9 | O5 | doub | 1.22Å | 1.21Å | |
| O1 | P1 | sing | 1.72Å | 1.62Å | |
| P1 | O2 | doub | 1.72Å | 1.51Å | |
| P1 | O3 | doub | 1.72Å | 1.49Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | C6 | 118.1° | 122.0° |
| C2 | C1 | H1 | 121.5° | 119.0° |
| C1 | C2 | C3 | 118.0° | 121.0° |
| C1 | C2 | H2 | 120.9° | 119.5° |
| C6 | C1 | H1 | 120.4° | 119.0° |
| C1 | C6 | C5 | 125.6° | 121.0° |
| C1 | C6 | H6 | 116.5° | 119.5° |
| C3 | C2 | H2 | 121.1° | 119.5° |
| C2 | C3 | C4 | 125.4° | 118.9° |
| C2 | C3 | H3 | 115.9° | 120.5° |
| C4 | C3 | H3 | 118.7° | 120.6° |
| C3 | C4 | C5 | 114.7° | 118.2° |
| C3 | C4 | C7 | 118.3° | 120.9° |
| C5 | C4 | C7 | 127.0° | 120.9° |
| C4 | C5 | C6 | 118.3° | 118.9° |
| C4 | C5 | H5 | 122.3° | 120.5° |
| C4 | C7 | C8 | 118.0° | 120.0° |
| C4 | C7 | C9 | 122.3° | 120.0° |
| C6 | C5 | H5 | 119.4° | 120.6° |
| C5 | C6 | H6 | 117.9° | 119.5° |
| C8 | C7 | C9 | 118.4° | 120.0° |
| C7 | C8 | O1 | 115.1° | 120.0° |
| C7 | C8 | H8 | 123.1° | 120.0° |
| C7 | C9 | O4 | 115.9° | 120.0° |
| C7 | C9 | O5 | 122.0° | 120.0° |
| O1 | C8 | H8 | 121.7° | 120.0° |
| C8 | O1 | P1 | 120.5° | 117.0° |
| O4 | C9 | O5 | 122.1° | 120.0° |
| O1 | P1 | O2 | 113.2° | 120.0° |
| O1 | P1 | O3 | 101.8° | 120.0° |
| O2 | P1 | O3 | 118.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | C6 | H1 | 180.0° | 179.7° |
| C1 | C2 | C3 | H2 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 0.2° | 0.0° |
| C1 | C2 | C3 | H3 | 179.8° | 180.0° |
| C2 | C1 | C6 | C5 | 0.2° | 0.0° |
| C2 | C1 | C6 | H6 | 179.8° | 180.0° |
| C6 | C1 | C2 | C3 | 0.1° | 0.0° |
| C6 | C1 | C2 | H2 | 179.9° | 180.0° |
| C1 | C6 | C5 | C4 | 0.0° | 0.0° |
| C1 | C6 | C5 | H6 | 180.0° | 180.0° |
| C1 | C6 | C5 | H5 | 180.0° | 179.9° |
| H1 | C1 | C2 | C3 | 180.0° | 179.8° |
| H1 | C1 | C2 | H2 | 0.1° | 0.2° |
| H1 | C1 | C6 | C5 | 179.9° | 179.7° |
| H1 | C1 | C6 | H6 | 0.1° | 0.2° |
| C2 | C3 | C4 | H3 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.3° | 0.0° |
| C2 | C3 | C4 | C7 | 179.9° | 180.0° |
| H2 | C2 | C3 | C4 | 179.8° | 180.0° |
| H2 | C2 | C3 | H3 | 0.2° | 0.0° |
| C3 | C4 | C5 | C7 | 179.5° | 180.0° |
| C3 | C4 | C5 | C6 | 0.2° | 0.0° |
| C3 | C4 | C5 | H5 | 179.8° | 179.9° |
| C3 | C4 | C7 | C8 | 165.9° | 115.0° |
| C3 | C4 | C7 | C9 | 1.2° | 65.0° |
| H3 | C3 | C4 | C5 | 179.6° | 180.0° |
| H3 | C3 | C4 | C7 | 0.1° | 0.0° |
| C4 | C5 | C6 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | H6 | 180.0° | 180.0° |
| C5 | C4 | C7 | C8 | 14.6° | 65.0° |
| C5 | C4 | C7 | C9 | 178.4° | 115.0° |
| C7 | C4 | C5 | C6 | 179.7° | 180.0° |
| C7 | C4 | C5 | H5 | 0.2° | 0.0° |
| C4 | C7 | C8 | C9 | 167.6° | 180.0° |
| C4 | C7 | C8 | O1 | 177.3° | 180.0° |
| C4 | C7 | C8 | H8 | 2.6° | 0.1° |
| C4 | C7 | C9 | O4 | 90.2° | 180.0° |
| C4 | C7 | C9 | O5 | 90.1° | 0.1° |
| H5 | C5 | C6 | H6 | 0.0° | 0.1° |
| C7 | C8 | O1 | H8 | 180.0° | 179.9° |
| C8 | C7 | C9 | O4 | 102.8° | 0.0° |
| C8 | C7 | C9 | O5 | 76.9° | 180.0° |
| C7 | C8 | O1 | P1 | 149.8° | 180.0° |
| C9 | C7 | C8 | O1 | 9.8° | 0.0° |
| C9 | C7 | C8 | H8 | 170.2° | 179.9° |
| C7 | C9 | O4 | O5 | 179.6° | 179.9° |
| C8 | O1 | P1 | O2 | 24.7° | 60.0° |
| C8 | O1 | P1 | O3 | 152.3° | 120.0° |
| H8 | C8 | O1 | P1 | 30.2° | 0.1° |
| O1 | P1 | O2 | O3 | 118.6° | 180.0° |
