Z6J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O5 | C5 | sing | 1.43Å | 1.43Å | |
| C5 | C4 | sing | 1.53Å | 1.52Å | |
| C4 | O4 | sing | 1.44Å | 1.43Å | |
| C4 | C3 | sing | 1.55Å | 1.52Å | |
| O4 | C1 | sing | 1.43Å | 1.43Å | |
| C3 | O3 | sing | 1.43Å | 1.43Å | |
| C3 | C2 | sing | 1.55Å | 1.52Å | |
| C2 | O2 | sing | 1.43Å | 1.43Å | |
| C2 | C1 | sing | 1.54Å | 1.52Å | |
| C1 | O1 | sing | 1.43Å | 1.34Å | |
| C5 | H51 | sing | 1.09Å | 1.10Å | |
| C5 | H52 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| O1 | HO1 | sing | 0.97Å | 0.95Å | |
| O5 | HO5 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O5 | C5 | C4 | 111.3° | 109.5° |
| O5 | C5 | H51 | 109.0° | 109.5° |
| O5 | C5 | H52 | 109.0° | 109.5° |
| C5 | O5 | HO5 | 109.5° | 114.0° |
| C5 | C4 | O4 | 109.4° | 110.3° |
| C5 | C4 | C3 | 112.6° | 110.4° |
| C4 | C5 | H51 | 109.0° | 109.5° |
| C4 | C5 | H52 | 109.0° | 109.5° |
| C5 | C4 | H4 | 108.6° | 110.3° |
| O4 | C4 | C3 | 107.7° | 105.1° |
| C4 | O4 | C1 | 110.6° | 109.9° |
| O4 | C4 | H4 | 109.9° | 110.3° |
| C4 | C3 | O3 | 109.2° | 111.1° |
| C4 | C3 | C2 | 104.8° | 101.0° |
| C3 | C4 | H4 | 108.6° | 110.4° |
| C4 | C3 | H3 | 109.8° | 111.1° |
| O4 | C1 | C2 | 105.9° | 107.7° |
| O4 | C1 | O1 | 101.3° | 109.8° |
| O4 | C1 | H1 | 106.7° | 109.8° |
| O3 | C3 | C2 | 111.7° | 111.2° |
| O3 | C3 | H3 | 111.2° | 110.9° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| C3 | C2 | O2 | 112.8° | 110.8° |
| C3 | C2 | C1 | 105.3° | 102.2° |
| C2 | C3 | H3 | 109.9° | 111.2° |
| C3 | C2 | H2 | 109.2° | 110.9° |
| O2 | C2 | C1 | 109.7° | 110.8° |
| O2 | C2 | H2 | 110.5° | 110.8° |
| C2 | O2 | HO2 | 109.5° | 114.0° |
| C2 | C1 | O1 | 127.8° | 109.9° |
| C2 | C1 | H1 | 105.7° | 109.8° |
| C1 | C2 | H2 | 109.2° | 111.0° |
| O1 | C1 | H1 | 107.9° | 109.9° |
| C1 | O1 | HO1 | 109.5° | 114.0° |
| H51 | C5 | H52 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O5 | C5 | C4 | H51 | 120.3° | 120.0° |
| O5 | C5 | C4 | H52 | 120.3° | 120.0° |
| O5 | C5 | C4 | O4 | 58.3° | 66.5° |
| O5 | C5 | C4 | C3 | 61.5° | 177.8° |
| O5 | C5 | H51 | H52 | 119.1° | 120.0° |
| O5 | C5 | C4 | H4 | 178.2° | 55.6° |
| C5 | C4 | O4 | C3 | 122.7° | 118.9° |
| C5 | C4 | O4 | H4 | 119.2° | 122.1° |
| C5 | C4 | C3 | H4 | 120.3° | 122.2° |
| C5 | C4 | O4 | C1 | 133.6° | 143.4° |
| C5 | C4 | C3 | O3 | 124.2° | 86.7° |
| C5 | C4 | C3 | C2 | 116.0° | 155.3° |
| C4 | C5 | H51 | H52 | 119.1° | 120.0° |
| C5 | C4 | C3 | H3 | 2.0° | 37.3° |
| C4 | C5 | O5 | HO5 | 180.0° | 180.0° |
| O4 | C4 | C3 | H4 | 119.0° | 118.9° |
| O4 | C4 | C3 | O3 | 115.1° | 154.4° |
| O4 | C4 | C3 | C2 | 4.8° | 36.4° |
| C4 | O4 | C1 | C2 | 22.0° | 1.8° |
| C4 | O4 | C1 | O1 | 113.0° | 117.8° |
| O4 | C4 | C5 | H51 | 62.0° | 173.5° |
| O4 | C4 | C5 | H52 | 178.6° | 53.5° |
| O4 | C4 | C3 | H3 | 122.7° | 81.6° |
| C4 | O4 | C1 | H1 | 134.3° | 121.3° |
| C3 | C4 | O4 | C1 | 10.9° | 24.4° |
| C4 | C3 | O3 | C2 | 115.4° | 111.6° |
| C4 | C3 | O3 | H3 | 121.4° | 124.1° |
| C4 | C3 | C2 | H3 | 117.9° | 117.9° |
| C4 | C3 | C2 | O2 | 137.0° | 84.1° |
| C4 | C3 | C2 | C1 | 17.4° | 34.1° |
| C3 | C4 | C5 | H51 | 178.2° | 57.8° |
| C3 | C4 | C5 | H52 | 58.8° | 62.1° |
| C4 | C3 | O3 | HO3 | 180.0° | 180.0° |
| C4 | C3 | C2 | H2 | 99.8° | 152.5° |
| O4 | C1 | C2 | C3 | 24.1° | 21.3° |
| O4 | C1 | C2 | O2 | 145.7° | 96.9° |
| O4 | C1 | C2 | O1 | 118.7° | 119.6° |
| O4 | C1 | C2 | H1 | 113.0° | 119.5° |
| O4 | C1 | O1 | H1 | 111.9° | 120.9° |
| C1 | O4 | C4 | H4 | 107.2° | 94.5° |
| O4 | C1 | C2 | H2 | 93.0° | 139.6° |
| O4 | C1 | O1 | HO1 | 180.0° | 61.4° |
| O3 | C3 | C2 | H3 | 123.9° | 124.1° |
| O3 | C3 | C2 | O2 | 18.8° | 33.9° |
| O3 | C3 | C2 | C1 | 100.8° | 152.0° |
| O3 | C3 | C4 | H4 | 3.9° | 35.5° |
| O3 | C3 | C2 | H2 | 142.1° | 89.6° |
| C3 | C2 | O2 | C1 | 117.0° | 112.8° |
| C3 | C2 | O2 | H2 | 122.5° | 123.5° |
| C3 | C2 | C1 | H2 | 117.1° | 118.3° |
| C3 | C2 | C1 | O1 | 94.5° | 140.9° |
| C2 | C3 | C4 | H4 | 123.7° | 82.5° |
| C3 | C2 | C1 | H1 | 137.1° | 98.2° |
| C2 | C3 | O3 | HO3 | 64.6° | 68.4° |
| C3 | C2 | O2 | HO2 | 180.0° | 180.0° |
| O2 | C2 | C1 | H2 | 121.3° | 123.5° |
| O2 | C2 | C1 | O1 | 27.1° | 22.7° |
| O2 | C2 | C3 | H3 | 105.1° | 158.0° |
| O2 | C2 | C1 | H1 | 101.3° | 143.6° |
| C2 | C1 | O1 | H1 | 127.5° | 120.9° |
| C1 | C2 | C3 | H3 | 135.3° | 83.8° |
| C1 | C2 | O2 | HO2 | 63.0° | 67.2° |
| C2 | C1 | O1 | HO1 | 59.4° | 179.6° |
| O1 | C1 | C2 | H2 | 148.3° | 100.8° |
| H51 | C5 | C4 | H4 | 57.9° | 64.4° |
| H51 | C5 | O5 | HO5 | 59.7° | 60.0° |
| H52 | C5 | C4 | H4 | 61.5° | 175.6° |
| H52 | C5 | O5 | HO5 | 59.7° | 60.0° |
| H4 | C4 | C3 | H3 | 118.3° | 159.5° |
| H3 | C3 | O3 | HO3 | 58.6° | 55.9° |
| H3 | C3 | C2 | H2 | 18.1° | 34.6° |
| H1 | C1 | C2 | H2 | 20.0° | 20.1° |
| H1 | C1 | O1 | HO1 | 68.1° | 59.5° |
| H2 | C2 | O2 | HO2 | 57.5° | 56.5° |






