KD0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4P | P | sing | 1.61Å | 1.63Å | |
| O4P | HO4P | sing | 0.97Å | 0.95Å | |
| O2P | P | doub | 1.48Å | 1.61Å | |
| O1P | P | sing | 1.61Å | 1.52Å | |
| P | O3P | sing | 1.61Å | 1.50Å | |
| O3P | HO3P | sing | 0.97Å | 0.95Å | |
| C8 | O1P | sing | 1.43Å | 1.41Å | |
| C8 | C7 | sing | 1.53Å | 1.53Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H8A | sing | 1.09Å | 1.10Å | |
| C6 | C7 | sing | 1.53Å | 1.53Å | |
| C7 | O7 | sing | 1.43Å | 1.42Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| O7 | HO7 | sing | 0.97Å | 0.95Å | |
| O6 | C6 | sing | 1.43Å | 1.44Å | |
| C6 | C5 | sing | 1.53Å | 1.55Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| O6 | HO6 | sing | 0.97Å | 0.95Å | |
| C4 | C5 | sing | 1.53Å | 1.52Å | |
| C5 | O5 | sing | 1.43Å | 1.46Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å | |
| O4 | C4 | sing | 1.43Å | 1.44Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| C1 | C3 | sing | 1.51Å | 1.54Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| O3 | C1 | doub | 1.21Å | 1.24Å | |
| C1 | C2 | sing | 1.49Å | 1.54Å | |
| O1 | C2 | doub | 1.21Å | 1.27Å | |
| C2 | O2 | sing | 1.35Å | 1.27Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| P | O4P | HO4P | 109.5° | 114.0° |
| O4P | P | O2P | 108.8° | 109.5° |
| O4P | P | O1P | 105.0° | 109.5° |
| O4P | P | O3P | 113.3° | 109.5° |
| O2P | P | O1P | 109.1° | 109.4° |
| O2P | P | O3P | 110.1° | 109.5° |
| O1P | P | O3P | 110.4° | 109.5° |
| P | O1P | C8 | 119.0° | 123.0° |
| P | O3P | HO3P | 109.5° | 114.0° |
| O1P | C8 | C7 | 107.1° | 109.5° |
| O1P | C8 | H8 | 110.3° | 109.5° |
| O1P | C8 | H8A | 110.8° | 109.5° |
| C7 | C8 | H8 | 110.3° | 109.5° |
| C7 | C8 | H8A | 110.8° | 109.5° |
| C8 | C7 | C6 | 110.7° | 109.5° |
| C8 | C7 | O7 | 107.9° | 109.5° |
| C8 | C7 | H7 | 109.6° | 109.5° |
| H8 | C8 | H8A | 107.6° | 109.5° |
| C6 | C7 | O7 | 109.2° | 109.4° |
| C6 | C7 | H7 | 108.3° | 109.5° |
| C7 | C6 | O6 | 110.8° | 109.4° |
| C7 | C6 | C5 | 114.0° | 109.5° |
| C7 | C6 | H6 | 105.5° | 109.5° |
| O7 | C7 | H7 | 111.1° | 109.4° |
| C7 | O7 | HO7 | 109.5° | 113.9° |
| O6 | C6 | C5 | 110.1° | 109.5° |
| O6 | C6 | H6 | 109.8° | 109.4° |
| C6 | O6 | HO6 | 109.5° | 114.0° |
| C5 | C6 | H6 | 106.3° | 109.6° |
| C6 | C5 | C4 | 108.4° | 109.5° |
| C6 | C5 | O5 | 113.8° | 109.5° |
| C6 | C5 | H5 | 106.7° | 109.4° |
| C4 | C5 | O5 | 107.7° | 109.5° |
| C4 | C5 | H5 | 112.9° | 109.5° |
| C5 | C4 | O4 | 110.4° | 109.5° |
| C5 | C4 | C3 | 110.0° | 109.5° |
| C5 | C4 | H4 | 108.1° | 109.5° |
| O5 | C5 | H5 | 107.4° | 109.5° |
| C5 | O5 | HO5 | 109.5° | 113.9° |
| O4 | C4 | C3 | 108.4° | 109.4° |
| O4 | C4 | H4 | 109.7° | 109.4° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| C3 | C4 | H4 | 110.2° | 109.4° |
| C4 | C3 | C1 | 111.8° | 109.5° |
| C4 | C3 | H3 | 108.7° | 109.5° |
| C4 | C3 | H3A | 108.2° | 109.5° |
| C1 | C3 | H3 | 108.7° | 109.5° |
| C1 | C3 | H3A | 108.2° | 109.5° |
| C3 | C1 | O3 | 121.1° | 120.0° |
| C3 | C1 | C2 | 119.6° | 120.0° |
| H3 | C3 | H3A | 111.3° | 109.4° |
| O3 | C1 | C2 | 119.3° | 119.9° |
| C1 | C2 | O1 | 115.5° | 120.0° |
| C1 | C2 | O2 | 117.4° | 120.0° |
| O1 | C2 | O2 | 127.0° | 120.0° |
| C2 | O2 | HO2 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4P | P | O2P | O1P | 114.0° | 120.0° |
| O4P | P | O2P | O3P | 124.7° | 120.0° |
| O4P | P | O1P | O3P | 122.5° | 120.0° |
| O4P | P | O3P | HO3P | 120.2° | 60.0° |
| O4P | P | O1P | C8 | 160.3° | 65.0° |
| HO4P | O4P | P | O2P | 129.3° | 180.0° |
| HO4P | O4P | P | O1P | 114.1° | 60.1° |
| HO4P | O4P | P | O3P | 6.5° | 59.9° |
| O2P | P | O1P | O3P | 121.1° | 120.0° |
| O2P | P | O3P | HO3P | 1.9° | 60.0° |
| O2P | P | O1P | C8 | 43.9° | 55.0° |
| O1P | P | O3P | HO3P | 122.3° | 180.0° |
| P | O1P | C8 | C7 | 149.0° | 180.0° |
| P | O1P | C8 | H8 | 29.0° | 60.0° |
| P | O1P | C8 | H8A | 90.1° | 60.0° |
| O3P | P | O1P | C8 | 77.1° | 175.0° |
| O1P | C8 | C7 | H8 | 120.0° | 120.0° |
| O1P | C8 | C7 | H8A | 120.9° | 120.0° |
| O1P | C8 | H8 | H8A | 120.9° | 120.0° |
| O1P | C8 | C7 | C6 | 152.0° | 175.0° |
| O1P | C8 | C7 | O7 | 88.5° | 65.0° |
| O1P | C8 | C7 | H7 | 32.6° | 55.0° |
| C7 | C8 | H8 | H8A | 121.0° | 120.0° |
| C8 | C7 | C6 | O7 | 118.7° | 120.0° |
| C8 | C7 | C6 | H7 | 120.2° | 120.1° |
| C8 | C7 | O7 | H7 | 120.1° | 120.0° |
| C8 | C7 | O7 | HO7 | 130.3° | 60.0° |
| C8 | C7 | C6 | O6 | 62.2° | 60.0° |
| C8 | C7 | C6 | C5 | 172.9° | 180.0° |
| C8 | C7 | C6 | H6 | 56.6° | 59.9° |
| H8 | C8 | C7 | C6 | 88.0° | 65.0° |
| H8 | C8 | C7 | O7 | 31.5° | 55.0° |
| H8 | C8 | C7 | H7 | 152.6° | 175.0° |
| H8A | C8 | C7 | C6 | 31.1° | 55.0° |
| H8A | C8 | C7 | O7 | 150.5° | 175.0° |
| H8A | C8 | C7 | H7 | 88.4° | 65.0° |
| C6 | C7 | O7 | H7 | 119.4° | 119.9° |
| C6 | C7 | O7 | HO7 | 9.9° | 60.0° |
| C7 | C6 | O6 | C5 | 127.1° | 120.0° |
| C7 | C6 | O6 | H6 | 116.2° | 119.9° |
| C7 | C6 | C5 | H6 | 115.8° | 120.1° |
| C7 | C6 | O6 | HO6 | 77.8° | 60.0° |
| C7 | C6 | C5 | C4 | 174.2° | 175.0° |
| C7 | C6 | C5 | O5 | 54.4° | 54.9° |
| C7 | C6 | C5 | H5 | 63.9° | 65.1° |
| O7 | C7 | C6 | O6 | 179.1° | 180.0° |
| O7 | C7 | C6 | C5 | 54.2° | 60.0° |
| O7 | C7 | C6 | H6 | 62.1° | 60.1° |
| H7 | C7 | O7 | HO7 | 109.5° | 180.0° |
| H7 | C7 | C6 | O6 | 57.9° | 60.1° |
| H7 | C7 | C6 | C5 | 66.9° | 59.9° |
| H7 | C7 | C6 | H6 | 176.7° | NaN° |
| O6 | C6 | C5 | H6 | 118.9° | 120.0° |
| O6 | C6 | C5 | C4 | 49.0° | 55.1° |
| O6 | C6 | C5 | O5 | 70.9° | 65.0° |
| O6 | C6 | C5 | H5 | 170.9° | 175.0° |
| C5 | C6 | O6 | HO6 | 49.3° | 60.0° |
| C6 | C5 | C4 | O5 | 123.6° | 120.1° |
| C6 | C5 | C4 | H5 | 118.0° | 119.9° |
| C6 | C5 | O5 | H5 | 117.8° | 119.9° |
| C6 | C5 | O5 | HO5 | 108.2° | 60.0° |
| C6 | C5 | C4 | O4 | 54.6° | 59.9° |
| C6 | C5 | C4 | C3 | 174.2° | 180.0° |
| C6 | C5 | C4 | H4 | 65.4° | 60.1° |
| H6 | C6 | O6 | HO6 | 166.0° | 180.0° |
| H6 | C6 | C5 | C4 | 69.9° | 65.0° |
| H6 | C6 | C5 | O5 | 170.2° | 175.0° |
| H6 | C6 | C5 | H5 | 52.0° | 55.0° |
| C4 | C5 | O5 | H5 | 121.9° | 120.0° |
| C4 | C5 | O5 | HO5 | 131.5° | 60.1° |
| C5 | C4 | O4 | C3 | 120.6° | 120.1° |
| C5 | C4 | O4 | H4 | 119.1° | 120.0° |
| C5 | C4 | C3 | H4 | 119.1° | 120.0° |
| C5 | C4 | O4 | HO4 | 131.7° | 60.0° |
| C5 | C4 | C3 | C1 | 165.5° | 175.0° |
| C5 | C4 | C3 | H3 | 45.4° | 54.9° |
| C5 | C4 | C3 | H3A | 75.6° | 65.0° |
| O5 | C5 | C4 | O4 | 178.2° | 180.0° |
| O5 | C5 | C4 | C3 | 62.2° | 59.9° |
| O5 | C5 | C4 | H4 | 58.2° | 60.0° |
| H5 | C5 | O5 | HO5 | 9.6° | 179.9° |
| H5 | C5 | C4 | O4 | 63.4° | 60.0° |
| H5 | C5 | C4 | C3 | 56.3° | 60.0° |
| H5 | C5 | C4 | H4 | 176.6° | 180.0° |
| O4 | C4 | C3 | H4 | 120.0° | 119.9° |
| O4 | C4 | C3 | C1 | 73.7° | 65.0° |
| O4 | C4 | C3 | H3 | 166.3° | 175.0° |
| O4 | C4 | C3 | H3A | 45.3° | 55.1° |
| C3 | C4 | O4 | HO4 | 107.8° | 60.1° |
| C4 | C3 | C1 | H3 | 120.0° | 120.0° |
| C4 | C3 | C1 | H3A | 119.0° | 120.0° |
| C4 | C3 | H3 | H3A | 119.0° | 120.0° |
| C4 | C3 | C1 | O3 | 73.2° | 0.0° |
| C4 | C3 | C1 | C2 | 107.6° | 180.0° |
| H4 | C4 | O4 | HO4 | 12.6° | 180.0° |
| H4 | C4 | C3 | C1 | 46.3° | 55.0° |
| H4 | C4 | C3 | H3 | 73.7° | 65.1° |
| H4 | C4 | C3 | H3A | 165.3° | 175.0° |
| C1 | C3 | H3 | H3A | 119.1° | 120.0° |
| C3 | C1 | O3 | C2 | 179.2° | 180.0° |
| C3 | C1 | C2 | O1 | 176.7° | 0.0° |
| C3 | C1 | C2 | O2 | 1.0° | 180.0° |
| H3 | C3 | C1 | O3 | 46.8° | 120.0° |
| H3 | C3 | C1 | C2 | 132.4° | 60.0° |
| H3A | C3 | C1 | O3 | 167.8° | 120.0° |
| H3A | C3 | C1 | C2 | 11.4° | 60.0° |
| O3 | C1 | C2 | O1 | 2.5° | 180.0° |
| O3 | C1 | C2 | O2 | 179.8° | 0.1° |
| C1 | C2 | O1 | O2 | 177.5° | 180.0° |
| C1 | C2 | O2 | HO2 | 177.4° | 180.0° |
| O1 | C2 | O2 | HO2 | 0.0° | 0.1° |
