OYO
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C6 | O3 | sing | 1.43Å | 1.42Å | |
| C6 | C5 | sing | 1.53Å | 1.51Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| O5 | C2 | sing | 1.44Å | 1.45Å | |
| O5 | C8 | sing | 1.44Å | 1.44Å | |
| C7 | C5 | sing | 1.53Å | 1.51Å | |
| C7 | O4 | sing | 1.43Å | 1.43Å | |
| C7 | C8 | sing | 1.54Å | 1.56Å | |
| C5 | O2 | sing | 1.43Å | 1.47Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C2 | O1 | sing | 1.43Å | 1.46Å | |
| C8 | C4 | sing | 1.56Å | 1.54Å | |
| O1 | C4 | sing | 1.44Å | 1.42Å | |
| O2 | C4 | sing | 1.44Å | 1.43Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| C3 | H9 | sing | 1.09Å | 1.10Å | |
| C1 | H10 | sing | 1.09Å | 1.10Å | |
| C1 | H11 | sing | 1.09Å | 1.10Å | |
| C1 | H12 | sing | 1.09Å | 1.10Å | |
| O3 | H13 | sing | 0.97Å | 0.95Å | |
| O4 | H14 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C6 | C5 | 110.4° | 109.4° |
| O3 | C6 | H3 | 109.2° | 109.5° |
| O3 | C6 | H4 | 109.2° | 109.5° |
| C6 | O3 | H13 | 109.5° | 114.0° |
| C6 | C5 | C7 | 111.6° | 109.4° |
| C6 | C5 | O2 | 115.0° | 109.9° |
| C6 | C5 | H2 | 108.1° | 109.8° |
| C5 | C6 | H3 | 109.2° | 109.5° |
| C5 | C6 | H4 | 109.2° | 109.4° |
| C3 | C2 | O5 | 115.2° | 109.6° |
| C3 | C2 | C1 | 109.6° | 109.6° |
| C3 | C2 | O1 | 109.6° | 109.6° |
| C2 | C3 | H7 | 109.5° | 109.5° |
| C2 | C3 | H8 | 109.5° | 109.5° |
| C2 | C3 | H9 | 109.5° | 109.5° |
| C2 | O5 | C8 | 110.2° | 105.3° |
| O5 | C2 | C1 | 109.2° | 109.5° |
| O5 | C2 | O1 | 100.7° | 108.9° |
| O5 | C8 | C7 | 111.8° | 109.0° |
| O5 | C8 | C4 | 104.7° | 102.0° |
| O5 | C8 | H6 | 113.0° | 114.4° |
| C5 | C7 | O4 | 102.8° | 110.4° |
| C5 | C7 | C8 | 104.4° | 105.0° |
| C7 | C5 | O2 | 105.2° | 107.3° |
| C7 | C5 | H2 | 108.1° | 110.5° |
| C5 | C7 | H5 | 112.8° | 110.4° |
| O4 | C7 | C8 | 109.9° | 109.3° |
| O4 | C7 | H5 | 114.1° | 110.3° |
| C7 | O4 | H14 | 109.5° | 114.0° |
| C7 | C8 | C4 | 104.2° | 102.7° |
| C8 | C7 | H5 | 112.0° | 111.3° |
| C7 | C8 | H6 | 111.1° | 113.6° |
| C5 | O2 | C4 | 109.9° | 107.8° |
| O2 | C5 | H2 | 108.6° | 109.9° |
| C1 | C2 | O1 | 112.4° | 109.6° |
| C2 | C1 | H10 | 109.5° | 109.5° |
| C2 | C1 | H11 | 109.4° | 109.5° |
| C2 | C1 | H12 | 109.5° | 109.5° |
| C2 | O1 | C4 | 112.5° | 107.7° |
| C8 | C4 | O1 | 103.5° | 103.1° |
| C8 | C4 | O2 | 107.8° | 104.0° |
| C8 | C4 | H1 | 110.4° | 113.3° |
| C4 | C8 | H6 | 111.5° | 114.0° |
| O1 | C4 | O2 | 110.6° | 109.3° |
| O1 | C4 | H1 | 112.1° | 113.2° |
| O2 | C4 | H1 | 112.0° | 113.1° |
| H3 | C6 | H4 | 109.4° | 109.5° |
| H7 | C3 | H8 | 109.5° | 109.4° |
| H7 | C3 | H9 | 109.5° | 109.5° |
| H8 | C3 | H9 | 109.4° | 109.5° |
| H10 | C1 | H11 | 109.5° | 109.4° |
| H10 | C1 | H12 | 109.5° | 109.4° |
| H11 | C1 | H12 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C6 | C5 | H3 | 120.2° | 120.0° |
| O3 | C6 | C5 | H4 | 120.2° | 119.9° |
| O3 | C6 | C5 | C7 | 158.3° | 176.0° |
| O3 | C6 | C5 | O2 | 38.6° | 66.4° |
| O3 | C6 | C5 | H2 | 82.9° | 54.6° |
| O3 | C6 | H3 | H4 | 119.5° | 120.0° |
| C6 | C5 | C7 | O2 | 125.3° | 119.2° |
| C6 | C5 | C7 | H2 | 118.8° | 121.0° |
| C6 | C5 | C7 | O4 | 149.0° | 118.7° |
| C6 | C5 | C7 | C8 | 96.1° | 123.7° |
| C6 | C5 | O2 | H2 | 121.3° | 120.9° |
| C6 | C5 | O2 | C4 | 96.7° | 145.3° |
| C5 | C6 | H3 | H4 | 119.6° | 120.0° |
| C6 | C5 | C7 | H5 | 25.7° | 3.6° |
| C5 | C6 | O3 | H13 | 180.0° | 180.0° |
| C3 | C2 | O5 | C1 | 123.8° | 120.3° |
| C3 | C2 | O5 | O1 | 117.8° | 119.9° |
| C3 | C2 | O5 | C8 | 147.0° | 144.0° |
| C3 | C2 | C1 | O1 | 122.1° | 120.3° |
| C3 | C2 | O1 | C4 | 147.4° | 121.4° |
| C2 | C3 | H7 | H8 | 120.0° | 120.0° |
| C2 | C3 | H7 | H9 | 120.0° | 120.0° |
| C2 | C3 | H8 | H9 | 119.9° | 120.0° |
| C3 | C2 | C1 | H10 | 180.0° | 60.7° |
| C3 | C2 | C1 | H11 | 60.0° | 179.3° |
| C3 | C2 | C1 | H12 | 60.0° | 59.3° |
| C2 | O5 | C8 | C7 | 134.9° | 142.9° |
| O5 | C2 | C1 | O1 | 110.9° | 119.4° |
| C2 | O5 | C8 | C4 | 22.7° | 34.9° |
| O5 | C2 | O1 | C4 | 25.6° | 1.5° |
| C2 | O5 | C8 | H6 | 98.8° | 88.7° |
| O5 | C2 | C3 | H7 | 180.0° | 179.5° |
| O5 | C2 | C3 | H8 | 60.0° | 60.5° |
| O5 | C2 | C3 | H9 | 60.0° | 59.5° |
| O5 | C2 | C1 | H10 | 53.0° | 59.5° |
| O5 | C2 | C1 | H11 | 172.9° | 60.4° |
| O5 | C2 | C1 | H12 | 67.1° | 179.5° |
| O5 | C8 | C7 | C5 | 90.9° | 90.8° |
| O5 | C8 | C7 | O4 | 159.4° | 150.8° |
| O5 | C8 | C7 | C4 | 112.5° | 107.5° |
| O5 | C8 | C7 | H6 | 127.3° | 128.8° |
| C8 | O5 | C2 | C1 | 89.2° | 95.7° |
| C8 | O5 | C2 | O1 | 29.2° | 24.1° |
| O5 | C8 | C4 | H6 | 122.5° | 123.8° |
| O5 | C8 | C4 | O1 | 5.9° | 33.7° |
| O5 | C8 | C4 | O2 | 111.3° | 80.3° |
| O5 | C8 | C4 | H1 | 126.1° | 156.5° |
| O5 | C8 | C7 | H5 | 31.5° | 28.7° |
| C5 | C7 | O4 | C8 | 110.8° | 115.0° |
| C5 | C7 | O4 | H5 | 122.5° | 122.3° |
| C5 | C7 | C8 | H5 | 122.4° | 119.5° |
| C7 | C5 | O2 | H2 | 115.6° | 120.2° |
| C5 | C7 | C8 | C4 | 21.6° | 16.8° |
| C7 | C5 | O2 | C4 | 26.5° | 26.5° |
| C7 | C5 | C6 | H3 | 38.1° | 56.0° |
| C7 | C5 | C6 | H4 | 81.5° | 64.0° |
| C5 | C7 | C8 | H6 | 141.8° | 140.4° |
| C5 | C7 | O4 | H14 | 180.0° | 61.4° |
| O4 | C7 | C8 | H5 | 127.9° | 122.1° |
| O4 | C7 | C5 | O2 | 85.7° | 122.2° |
| O4 | C7 | C8 | C4 | 88.1° | 101.6° |
| O4 | C7 | C5 | H2 | 30.3° | 2.4° |
| O4 | C7 | C8 | H6 | 32.1° | 22.0° |
| C8 | C7 | C5 | O2 | 29.2° | 4.5° |
| C7 | C8 | C4 | H6 | 119.9° | 123.4° |
| C7 | C8 | C4 | O1 | 123.5° | 146.6° |
| C7 | C8 | C4 | O2 | 6.3° | 32.5° |
| C7 | C8 | C4 | H1 | 116.3° | 90.7° |
| C8 | C7 | C5 | H2 | 145.1° | 115.3° |
| C8 | C7 | O4 | H14 | 69.2° | 176.4° |
| C5 | O2 | C4 | C8 | 12.3° | 37.1° |
| C5 | O2 | C4 | O1 | 100.2° | 146.7° |
| C5 | O2 | C4 | H1 | 133.9° | 86.3° |
| O2 | C5 | C6 | H3 | 81.6° | 173.6° |
| O2 | C5 | C6 | H4 | 158.8° | 53.5° |
| O2 | C5 | C7 | H5 | 151.0° | 115.6° |
| C1 | C2 | O1 | C4 | 90.5° | 118.3° |
| C1 | C2 | C3 | H7 | 56.4° | 59.3° |
| C1 | C2 | C3 | H8 | 176.4° | 179.2° |
| C1 | C2 | C3 | H9 | 63.7° | 60.7° |
| C2 | C1 | H10 | H11 | 120.0° | 120.0° |
| C2 | C1 | H10 | H12 | 120.0° | 120.1° |
| C2 | C1 | H11 | H12 | 120.0° | 120.1° |
| C2 | O1 | C4 | C8 | 12.6° | 19.8° |
| C2 | O1 | C4 | O2 | 127.8° | 90.4° |
| C2 | O1 | C4 | H1 | 106.4° | 142.6° |
| O1 | C2 | C3 | H7 | 67.3° | 61.1° |
| O1 | C2 | C3 | H8 | 52.7° | 58.9° |
| O1 | C2 | C3 | H9 | 172.6° | 178.9° |
| O1 | C2 | C1 | H10 | 57.9° | 178.9° |
| O1 | C2 | C1 | H11 | 62.1° | 59.0° |
| O1 | C2 | C1 | H12 | 177.9° | 61.1° |
| C8 | C4 | O1 | O2 | 115.2° | 110.2° |
| C8 | C4 | O1 | H1 | 119.0° | 122.8° |
| C8 | C4 | O2 | H1 | 121.6° | 123.4° |
| C4 | C8 | C7 | H5 | 144.0° | 136.2° |
| O1 | C4 | O2 | H1 | 125.8° | 127.0° |
| O1 | C4 | C8 | H6 | 116.6° | 90.1° |
| C4 | O2 | C5 | H2 | 142.1° | 93.8° |
| O2 | C4 | C8 | H6 | 126.2° | 155.9° |
| H1 | C4 | C8 | H6 | 3.6° | 32.7° |
| H2 | C5 | C6 | H3 | 156.9° | 65.5° |
| H2 | C5 | C6 | H4 | 37.2° | 174.5° |
| H2 | C5 | C7 | H5 | 93.1° | 124.6° |
| H3 | C6 | O3 | H13 | 59.9° | 60.0° |
| H4 | C6 | O3 | H13 | 59.8° | 60.1° |
| H5 | C7 | C8 | H6 | 95.8° | 100.1° |
| H5 | C7 | O4 | H14 | 57.5° | 60.9° |
| H7 | C3 | H8 | H9 | 120.0° | 120.0° |
| H10 | C1 | H11 | H12 | 120.0° | 119.9° |
