0CM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C4 | C3 | sing | 1.47Å | 1.44Å | |
| C4 | O5 | sing | 1.43Å | 1.47Å | |
| C3 | C2 | trip | 1.17Å | 1.24Å | |
| C2 | C1 | sing | 1.47Å | 1.48Å | |
| O5 | P6 | sing | 1.61Å | 1.59Å | |
| O13 | P8 | doub | 1.48Å | 1.44Å | |
| O9 | P8 | sing | 1.61Å | 1.53Å | |
| P6 | O7 | sing | 1.61Å | 1.57Å | |
| P6 | O10 | doub | 1.48Å | 1.43Å | |
| P6 | O11 | sing | 1.61Å | 1.48Å | |
| O7 | P8 | sing | 1.61Å | 1.57Å | |
| P8 | O12 | sing | 1.61Å | 1.49Å | |
| O12 | H1 | sing | 0.97Å | 0.95Å | |
| O9 | H2 | sing | 0.97Å | 0.95Å | |
| O11 | H3 | sing | 0.97Å | 0.95Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H7 | sing | 1.09Å | 1.10Å | |
| C1 | H8 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | C4 | O5 | 112.2° | 109.4° |
| C4 | C3 | C2 | 178.3° | 180.0° |
| C3 | C4 | H4 | 108.8° | 109.5° |
| C3 | C4 | H5 | 108.8° | 109.5° |
| C4 | O5 | P6 | 130.9° | 123.0° |
| O5 | C4 | H4 | 108.8° | 109.5° |
| O5 | C4 | H5 | 108.8° | 109.4° |
| C3 | C2 | C1 | 178.2° | 180.0° |
| C2 | C1 | H6 | 109.5° | 109.4° |
| C2 | C1 | H7 | 109.4° | 109.5° |
| C2 | C1 | H8 | 109.5° | 109.5° |
| O5 | P6 | O7 | 105.4° | 109.5° |
| O5 | P6 | O10 | 109.4° | 109.5° |
| O5 | P6 | O11 | 100.4° | 109.5° |
| O13 | P8 | O9 | 113.8° | 109.5° |
| O13 | P8 | O7 | 109.2° | 109.5° |
| O13 | P8 | O12 | 111.3° | 109.5° |
| O9 | P8 | O7 | 108.8° | 109.4° |
| O9 | P8 | O12 | 109.7° | 109.4° |
| P8 | O9 | H2 | 109.5° | 114.0° |
| O7 | P6 | O10 | 108.7° | 109.5° |
| O7 | P6 | O11 | 111.2° | 109.4° |
| P6 | O7 | P8 | 136.3° | 134.0° |
| O10 | P6 | O11 | 120.6° | 109.5° |
| P6 | O11 | H3 | 109.5° | 114.0° |
| O7 | P8 | O12 | 103.6° | 109.5° |
| P8 | O12 | H1 | 109.5° | 114.0° |
| H4 | C4 | H5 | 109.4° | 109.5° |
| H6 | C1 | H7 | 109.5° | 109.5° |
| H6 | C1 | H8 | 109.4° | 109.4° |
| H7 | C1 | H8 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | C4 | O5 | H4 | 120.4° | 120.0° |
| C3 | C4 | O5 | H5 | 120.4° | 120.0° |
| C4 | C3 | C2 | C1 | 46.0° | NaN° |
| C3 | C4 | O5 | P6 | 36.5° | 180.0° |
| C3 | C4 | H4 | H5 | 118.7° | 120.0° |
| O5 | C4 | C3 | C2 | 101.3° | 11.4° |
| C4 | O5 | P6 | O7 | 33.6° | 175.0° |
| C4 | O5 | P6 | O10 | 83.1° | 55.0° |
| C4 | O5 | P6 | O11 | 149.1° | 65.0° |
| O5 | C4 | H4 | H5 | 118.8° | 120.0° |
| C2 | C3 | C4 | H4 | 19.2° | 131.4° |
| C2 | C3 | C4 | H5 | 138.3° | 108.6° |
| C3 | C2 | C1 | H6 | 180.0° | 11.4° |
| C3 | C2 | C1 | H7 | 60.0° | 131.4° |
| C3 | C2 | C1 | H8 | 60.0° | 108.6° |
| C2 | C1 | H6 | H7 | 120.0° | 120.0° |
| C2 | C1 | H6 | H8 | 120.0° | 119.9° |
| C2 | C1 | H7 | H8 | 120.0° | 120.0° |
| O5 | P6 | O7 | O10 | 117.2° | 120.0° |
| O5 | P6 | O7 | O11 | 107.9° | 120.0° |
| O5 | P6 | O10 | O11 | 115.5° | 120.0° |
| O5 | P6 | O7 | P8 | 86.9° | 159.9° |
| O5 | P6 | O11 | H3 | 120.0° | 59.9° |
| P6 | O5 | C4 | H4 | 83.9° | 60.0° |
| P6 | O5 | C4 | H5 | 156.9° | 60.0° |
| O13 | P8 | O9 | O7 | 121.9° | 120.0° |
| O13 | P8 | O9 | O12 | 125.4° | 120.0° |
| O13 | P8 | O7 | P6 | 35.4° | 44.9° |
| O13 | P8 | O7 | O12 | 118.7° | 120.1° |
| O13 | P8 | O12 | H1 | 0.0° | 59.9° |
| O13 | P8 | O9 | H2 | 0.0° | 180.0° |
| O9 | P8 | O7 | P6 | 160.1° | 75.1° |
| O9 | P8 | O7 | O12 | 116.6° | 120.0° |
| O9 | P8 | O12 | H1 | 126.8° | 60.1° |
| O7 | P6 | O10 | O11 | 130.0° | 120.0° |
| P6 | O7 | P8 | O12 | 83.3° | 165.0° |
| O7 | P6 | O11 | H3 | 128.9° | 60.1° |
| O10 | P6 | O7 | P8 | 155.9° | 39.9° |
| O10 | P6 | O11 | H3 | 0.0° | 179.9° |
| O11 | P6 | O7 | P8 | 21.0° | 80.1° |
| O7 | P8 | O12 | H1 | 117.2° | 180.0° |
| O7 | P8 | O9 | H2 | 121.9° | 60.0° |
| O12 | P8 | O9 | H2 | 125.4° | 59.9° |
| H6 | C1 | H7 | H8 | 120.0° | 120.0° |
