5SP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C2 | sing | 1.43Å | 1.40Å | |
| C2 | C3 | sing | 1.51Å | 1.51Å | |
| C3 | O4 | doub | 1.21Å | 1.21Å | |
| C3 | C5 | sing | 1.51Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.53Å | |
| C5 | O13 | sing | 1.43Å | 1.39Å | |
| C6 | C7 | sing | 1.53Å | 1.51Å | |
| C6 | O14 | sing | 1.43Å | 1.38Å | |
| C7 | O8 | sing | 1.43Å | 1.41Å | |
| O8 | P9 | sing | 1.61Å | 1.58Å | |
| P9 | O10 | doub | 1.48Å | 1.52Å | |
| P9 | O11 | sing | 1.61Å | 1.56Å | |
| P9 | O12 | sing | 1.61Å | 1.58Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| O11 | HO11 | sing | 0.97Å | 0.95Å | |
| O12 | HO12 | sing | 0.97Å | 0.95Å | |
| O13 | HO13 | sing | 0.97Å | 0.95Å | |
| O14 | HO14 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C2 | C3 | 117.8° | 109.5° |
| C2 | O1 | HO1 | 109.5° | 114.0° |
| O1 | C2 | H2 | 106.8° | 109.4° |
| O1 | C2 | H2A | 106.8° | 109.5° |
| C2 | C3 | O4 | 119.5° | 120.0° |
| C2 | C3 | C5 | 120.9° | 120.0° |
| C3 | C2 | H2 | 106.8° | 109.4° |
| C3 | C2 | H2A | 106.8° | 109.5° |
| O4 | C3 | C5 | 119.3° | 120.0° |
| C3 | C5 | C6 | 114.4° | 109.5° |
| C3 | C5 | O13 | 114.3° | 109.5° |
| C3 | C5 | H5 | 105.0° | 109.5° |
| C6 | C5 | O13 | 116.4° | 109.5° |
| C5 | C6 | C7 | 111.5° | 109.5° |
| C5 | C6 | O14 | 116.4° | 109.5° |
| C6 | C5 | H5 | 102.1° | 109.5° |
| C5 | C6 | H6 | 104.6° | 109.5° |
| O13 | C5 | H5 | 102.2° | 109.4° |
| C5 | O13 | HO13 | 109.5° | 114.0° |
| C7 | C6 | O14 | 114.0° | 109.4° |
| C6 | C7 | O8 | 116.2° | 109.5° |
| C7 | C6 | H6 | 107.5° | 109.5° |
| C6 | C7 | H7 | 107.3° | 109.4° |
| C6 | C7 | H7A | 107.3° | 109.5° |
| O14 | C6 | H6 | 101.4° | 109.5° |
| C6 | O14 | HO14 | 109.5° | 114.0° |
| C7 | O8 | P9 | 118.4° | 123.0° |
| O8 | C7 | H7 | 107.3° | 109.5° |
| O8 | C7 | H7A | 107.3° | 109.5° |
| O8 | P9 | O10 | 105.7° | 109.5° |
| O8 | P9 | O11 | 110.6° | 109.5° |
| O8 | P9 | O12 | 109.7° | 109.5° |
| O10 | P9 | O11 | 108.5° | 109.5° |
| O10 | P9 | O12 | 112.2° | 109.5° |
| O11 | P9 | O12 | 110.1° | 109.5° |
| P9 | O11 | HO11 | 109.5° | 114.0° |
| P9 | O12 | HO12 | 109.5° | 114.0° |
| H2 | C2 | H2A | 112.0° | 109.5° |
| H7 | C7 | H7A | 111.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C2 | C3 | H2 | 120.0° | 119.9° |
| O1 | C2 | C3 | H2A | 120.0° | 120.1° |
| O1 | C2 | C3 | O4 | 7.2° | 0.0° |
| O1 | C2 | C3 | C5 | 178.7° | 180.0° |
| O1 | C2 | H2 | H2A | 116.6° | 120.0° |
| C2 | C3 | O4 | C5 | 174.2° | 180.0° |
| C2 | C3 | C5 | C6 | 41.5° | 75.0° |
| C2 | C3 | C5 | O13 | 96.3° | 165.0° |
| C3 | C2 | O1 | HO1 | 3.3° | 180.0° |
| C3 | C2 | H2 | H2A | 116.6° | 120.0° |
| C2 | C3 | C5 | H5 | 152.6° | 45.0° |
| O4 | C3 | C5 | C6 | 132.7° | 105.0° |
| O4 | C3 | C5 | O13 | 89.6° | 15.0° |
| O4 | C3 | C2 | H2 | 127.2° | 120.0° |
| O4 | C3 | C2 | H2A | 112.8° | 120.0° |
| O4 | C3 | C5 | H5 | 21.6° | 135.0° |
| C3 | C5 | C6 | O13 | 136.9° | 120.0° |
| C3 | C5 | C6 | H5 | 112.8° | 120.0° |
| C3 | C5 | O13 | H5 | 112.8° | 120.0° |
| C3 | C5 | C6 | C7 | 117.9° | 175.0° |
| C3 | C5 | C6 | O14 | 108.9° | 55.0° |
| C5 | C3 | C2 | H2 | 58.7° | 60.0° |
| C5 | C3 | C2 | H2A | 61.4° | 59.9° |
| C3 | C5 | C6 | H6 | 2.0° | 65.0° |
| C3 | C5 | O13 | HO13 | 180.0° | 60.0° |
| C6 | C5 | O13 | H5 | 110.3° | 120.0° |
| C5 | C6 | C7 | O14 | 134.4° | 120.0° |
| C5 | C6 | C7 | H6 | 114.1° | 120.0° |
| C5 | C6 | O14 | H6 | 112.7° | 120.0° |
| C5 | C6 | C7 | O8 | 7.3° | 175.0° |
| C5 | C6 | C7 | H7 | 112.7° | 55.0° |
| C5 | C6 | C7 | H7A | 127.3° | 65.0° |
| C6 | C5 | O13 | HO13 | 43.1° | 60.0° |
| C5 | C6 | O14 | HO14 | 180.0° | 59.9° |
| O13 | C5 | C6 | C7 | 105.3° | 55.0° |
| O13 | C5 | C6 | O14 | 27.9° | 65.0° |
| O13 | C5 | C6 | H6 | 138.8° | 175.0° |
| C7 | C6 | O14 | H6 | 115.2° | 120.0° |
| C6 | C7 | O8 | H7 | 120.0° | 120.0° |
| C6 | C7 | O8 | H7A | 120.0° | 120.0° |
| C6 | C7 | O8 | P9 | 134.4° | 180.0° |
| C7 | C6 | C5 | H5 | 5.1° | 65.0° |
| C6 | C7 | H7 | H7A | 117.2° | 120.0° |
| C7 | C6 | O14 | HO14 | 47.9° | 60.1° |
| O14 | C6 | C7 | O8 | 141.7° | 65.0° |
| O14 | C6 | C5 | H5 | 138.3° | 175.0° |
| O14 | C6 | C7 | H7 | 21.7° | 175.0° |
| O14 | C6 | C7 | H7A | 98.3° | 55.0° |
| C7 | O8 | P9 | O10 | 24.4° | 55.0° |
| C7 | O8 | P9 | O11 | 92.8° | 65.0° |
| C7 | O8 | P9 | O12 | 145.5° | 175.0° |
| O8 | C7 | C6 | H6 | 106.8° | 55.0° |
| O8 | C7 | H7 | H7A | 117.3° | 120.0° |
| O8 | P9 | O10 | O11 | 118.7° | 120.0° |
| O8 | P9 | O10 | O12 | 119.5° | 120.0° |
| O8 | P9 | O11 | O12 | 121.5° | 120.0° |
| P9 | O8 | C7 | H7 | 14.4° | 60.0° |
| P9 | O8 | C7 | H7A | 105.6° | 60.0° |
| O8 | P9 | O11 | HO11 | 115.5° | 60.0° |
| O8 | P9 | O12 | HO12 | 117.1° | 180.0° |
| O10 | P9 | O11 | O12 | 123.1° | 120.0° |
| O10 | P9 | O11 | HO11 | 0.0° | 180.0° |
| O10 | P9 | O12 | HO12 | 0.0° | 60.0° |
| O11 | P9 | O12 | HO12 | 120.9° | 60.0° |
| O12 | P9 | O11 | HO11 | 123.1° | 60.0° |
| HO1 | O1 | C2 | H2 | 123.2° | 60.1° |
| HO1 | O1 | C2 | H2A | 116.7° | 59.9° |
| H5 | C5 | C6 | H6 | 110.8° | 55.0° |
| H5 | C5 | O13 | HO13 | 67.1° | 180.0° |
| H6 | C6 | C7 | H7 | 133.2° | 65.0° |
| H6 | C6 | C7 | H7A | 13.3° | 175.0° |
| H6 | C6 | O14 | HO14 | 67.3° | 179.9° |
