2E7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O16 | P13 | doub | 1.48Å | 1.49Å | |
| O11 | P9 | doub | 1.48Å | 1.53Å | |
| P13 | O12 | sing | 1.61Å | 1.58Å | |
| P13 | O14 | sing | 1.61Å | 1.47Å | |
| P13 | O15 | sing | 1.61Å | 1.47Å | |
| O10 | P9 | sing | 1.61Å | 1.53Å | |
| O12 | P9 | sing | 1.61Å | 1.64Å | |
| P9 | O8 | sing | 1.61Å | 1.65Å | |
| O8 | C7 | sing | 1.43Å | 1.45Å | |
| N3 | C4 | doub | 1.32Å | 1.37Å | Aromatic |
| N3 | C2 | sing | 1.32Å | 1.36Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.41Å | Aromatic |
| CL | C2 | sing | 1.74Å | 1.75Å | |
| C2 | C1 | doub | 1.38Å | 1.37Å | Aromatic |
| C5 | C7 | sing | 1.51Å | 1.51Å | |
| C5 | C6 | doub | 1.39Å | 1.38Å | Aromatic |
| C1 | C6 | sing | 1.39Å | 1.37Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| O10 | H2 | sing | 0.97Å | 0.95Å | |
| O14 | H3 | sing | 0.97Å | 0.95Å | |
| O15 | H4 | sing | 0.97Å | 0.95Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.08Å | 1.08Å | |
| C6 | H8 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O16 | P13 | O12 | 107.7° | 109.5° |
| O16 | P13 | O14 | 108.9° | 109.4° |
| O16 | P13 | O15 | 112.2° | 109.5° |
| O11 | P9 | O10 | 121.2° | 109.5° |
| O11 | P9 | O12 | 111.8° | 109.4° |
| O11 | P9 | O8 | 106.2° | 109.5° |
| O12 | P13 | O14 | 100.1° | 109.5° |
| O12 | P13 | O15 | 111.0° | 109.5° |
| P13 | O12 | P9 | 131.0° | 134.0° |
| O14 | P13 | O15 | 116.0° | 109.4° |
| P13 | O14 | H3 | 109.5° | 114.0° |
| P13 | O15 | H4 | 109.5° | 114.0° |
| O10 | P9 | O12 | 101.6° | 109.5° |
| O10 | P9 | O8 | 106.1° | 109.5° |
| P9 | O10 | H2 | 109.5° | 114.0° |
| O12 | P9 | O8 | 109.5° | 109.5° |
| P9 | O8 | C7 | 125.0° | 123.0° |
| O8 | C7 | C5 | 108.3° | 109.5° |
| O8 | C7 | H5 | 109.8° | 109.5° |
| O8 | C7 | H6 | 109.7° | 109.5° |
| C4 | N3 | C2 | 116.8° | 121.7° |
| N3 | C4 | C5 | 120.2° | 120.8° |
| N3 | C4 | H7 | 119.9° | 119.6° |
| N3 | C2 | CL | 121.5° | 119.6° |
| N3 | C2 | C1 | 125.3° | 120.7° |
| C4 | C5 | C7 | 123.3° | 120.4° |
| C4 | C5 | C6 | 120.4° | 119.2° |
| C5 | C4 | H7 | 119.9° | 119.6° |
| CL | C2 | C1 | 113.2° | 119.7° |
| C2 | C1 | C6 | 117.8° | 119.2° |
| C2 | C1 | H1 | 121.1° | 120.4° |
| C7 | C5 | C6 | 116.3° | 120.4° |
| C5 | C7 | H5 | 109.7° | 109.5° |
| C5 | C7 | H6 | 109.8° | 109.4° |
| C5 | C6 | C1 | 119.5° | 118.4° |
| C5 | C6 | H8 | 120.2° | 120.8° |
| C6 | C1 | H1 | 121.1° | 120.4° |
| C1 | C6 | H8 | 120.2° | 120.8° |
| H5 | C7 | H6 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O16 | P13 | O12 | O14 | 113.7° | 119.9° |
| O16 | P13 | O12 | O15 | 123.3° | 120.1° |
| O16 | P13 | O14 | O15 | 127.7° | 120.0° |
| O16 | P13 | O12 | P9 | 89.9° | 45.1° |
| O16 | P13 | O14 | H3 | 0.0° | 60.0° |
| O16 | P13 | O15 | H4 | 0.0° | 180.0° |
| O11 | P9 | O12 | P13 | 32.9° | 45.0° |
| O11 | P9 | O10 | O12 | 124.7° | 120.0° |
| O11 | P9 | O10 | O8 | 120.9° | 120.0° |
| O11 | P9 | O12 | O8 | 117.4° | 120.0° |
| O11 | P9 | O8 | C7 | 158.0° | 55.0° |
| O11 | P9 | O10 | H2 | 0.0° | 180.0° |
| O12 | P13 | O14 | O15 | 119.5° | 120.0° |
| P13 | O12 | P9 | O10 | 163.7° | 75.0° |
| P13 | O12 | P9 | O8 | 84.5° | 165.0° |
| O12 | P13 | O14 | H3 | 112.8° | 180.0° |
| O12 | P13 | O15 | H4 | 120.6° | 59.9° |
| O14 | P13 | O12 | P9 | 156.4° | 165.0° |
| O14 | P13 | O15 | H4 | 126.0° | 60.1° |
| O15 | P13 | O12 | P9 | 33.3° | 75.0° |
| O15 | P13 | O14 | H3 | 127.7° | 59.9° |
| O10 | P9 | O12 | O8 | 111.9° | 120.0° |
| O10 | P9 | O8 | C7 | 27.8° | 65.0° |
| O12 | P9 | O8 | C7 | 81.1° | 175.0° |
| O12 | P9 | O10 | H2 | 124.7° | 60.0° |
| P9 | O8 | C7 | C5 | 61.7° | 180.0° |
| O8 | P9 | O10 | H2 | 120.9° | 60.0° |
| P9 | O8 | C7 | H5 | 58.1° | 60.0° |
| P9 | O8 | C7 | H6 | 178.5° | 60.0° |
| O8 | C7 | C5 | C4 | 125.8° | 90.5° |
| O8 | C7 | C5 | H5 | 119.8° | 120.0° |
| O8 | C7 | C5 | H6 | 119.8° | 120.0° |
| O8 | C7 | C5 | C6 | 53.1° | 90.0° |
| O8 | C7 | H5 | H6 | 120.5° | 120.0° |
| N3 | C4 | C5 | H7 | 180.0° | 180.0° |
| C4 | N3 | C2 | CL | 177.6° | 180.0° |
| C4 | N3 | C2 | C1 | 1.6° | 0.0° |
| N3 | C4 | C5 | C7 | 179.7° | 180.0° |
| N3 | C4 | C5 | C6 | 0.8° | 0.5° |
| C2 | N3 | C4 | C5 | 1.2° | 0.3° |
| N3 | C2 | CL | C1 | 179.3° | 179.9° |
| N3 | C2 | C1 | C6 | 1.6° | 0.0° |
| N3 | C2 | C1 | H1 | 178.4° | 179.7° |
| C2 | N3 | C4 | H7 | 178.8° | 179.8° |
| C4 | C5 | C7 | C6 | 179.0° | 179.5° |
| C4 | C5 | C6 | C1 | 0.7° | 0.5° |
| C4 | C5 | C7 | H5 | 6.0° | 149.5° |
| C4 | C5 | C7 | H6 | 114.4° | 29.5° |
| C4 | C5 | C6 | H8 | 179.3° | 179.5° |
| CL | C2 | C1 | C6 | 177.7° | 180.0° |
| CL | C2 | C1 | H1 | 2.3° | 0.2° |
| C2 | C1 | C6 | C5 | 1.0° | 0.2° |
| C2 | C1 | C6 | H1 | 180.0° | 179.7° |
| C2 | C1 | C6 | H8 | 178.9° | 179.8° |
| C7 | C5 | C6 | C1 | 179.7° | 180.0° |
| C5 | C7 | H5 | H6 | 120.5° | 120.0° |
| C7 | C5 | C4 | H7 | 0.3° | 0.0° |
| C7 | C5 | C6 | H8 | 0.3° | 0.0° |
| C5 | C6 | C1 | H8 | 180.0° | 180.0° |
| C5 | C6 | C1 | H1 | 179.0° | 180.0° |
| C6 | C5 | C7 | H5 | 173.0° | 30.0° |
| C6 | C5 | C7 | H6 | 66.7° | 150.0° |
| C6 | C5 | C4 | H7 | 179.2° | 179.5° |
| H1 | C1 | C6 | H8 | 1.1° | 0.0° |






