Y34
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C6 | S | sing | 1.76Å | 1.72Å | Aromatic |
| C6 | C5 | doub | 1.34Å | 1.35Å | Aromatic |
| O3 | C5 | sing | 1.38Å | 1.37Å | |
| O3 | C4 | sing | 1.43Å | 1.45Å | |
| S | C1 | sing | 1.76Å | 1.73Å | Aromatic |
| C5 | C2 | sing | 1.40Å | 1.42Å | Aromatic |
| C4 | C3 | sing | 1.53Å | 1.51Å | |
| C2 | C1 | doub | 1.37Å | 1.37Å | Aromatic |
| C2 | O2 | sing | 1.38Å | 1.37Å | |
| C1 | C | sing | 1.41Å | 1.48Å | |
| C3 | O2 | sing | 1.43Å | 1.46Å | |
| O1 | C | doub | 1.22Å | 1.21Å | |
| C | O | sing | 1.35Å | 1.30Å | |
| C4 | H1 | sing | 1.09Å | 1.10Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| O | H4 | sing | 0.97Å | 0.95Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| S | C6 | C5 | 111.2° | 110.7° |
| C6 | S | C1 | 92.7° | 91.2° |
| S | C6 | H3 | 124.4° | 124.7° |
| C6 | C5 | O3 | 124.5° | 124.1° |
| C6 | C5 | C2 | 112.8° | 114.5° |
| C5 | C6 | H3 | 124.4° | 124.6° |
| C5 | O3 | C4 | 111.9° | 114.4° |
| O3 | C5 | C2 | 122.7° | 121.4° |
| O3 | C4 | C3 | 111.4° | 109.2° |
| O3 | C4 | H1 | 109.0° | 109.5° |
| O3 | C4 | H2 | 109.0° | 109.6° |
| S | C1 | C2 | 109.9° | 109.8° |
| S | C1 | C | 120.0° | 125.1° |
| C5 | C2 | C1 | 113.4° | 113.8° |
| C5 | C2 | O2 | 122.8° | 121.8° |
| C4 | C3 | O2 | 115.0° | 109.2° |
| C3 | C4 | H1 | 109.0° | 109.5° |
| C3 | C4 | H2 | 109.0° | 109.5° |
| C4 | C3 | H5 | 108.1° | 109.5° |
| C4 | C3 | H6 | 108.1° | 109.5° |
| C1 | C2 | O2 | 123.5° | 124.5° |
| C2 | C1 | C | 130.0° | 125.1° |
| C2 | O2 | C3 | 114.0° | 114.5° |
| C1 | C | O1 | 120.6° | 120.0° |
| C1 | C | O | 116.0° | 120.0° |
| O2 | C3 | H5 | 108.1° | 109.5° |
| O2 | C3 | H6 | 108.1° | 109.6° |
| O1 | C | O | 123.4° | 120.0° |
| C | O | H4 | 109.5° | 114.0° |
| H1 | C4 | H2 | 109.5° | 109.5° |
| H5 | C3 | H6 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| S | C6 | C5 | H3 | 180.0° | 179.9° |
| S | C6 | C5 | O3 | 179.4° | 179.7° |
| S | C6 | C5 | C2 | 0.4° | 0.1° |
| C6 | S | C1 | C2 | 2.1° | 0.0° |
| C6 | S | C1 | C | 179.0° | 180.0° |
| C6 | C5 | O3 | C2 | 179.8° | 179.8° |
| C6 | C5 | O3 | C4 | 152.6° | 163.3° |
| C5 | C6 | S | C1 | 1.4° | 0.0° |
| C6 | C5 | C2 | C1 | 1.2° | 0.1° |
| C6 | C5 | C2 | O2 | 172.7° | 179.7° |
| C5 | O3 | C4 | C3 | 48.0° | 46.5° |
| O3 | C5 | C2 | C1 | 179.0° | 179.7° |
| O3 | C5 | C2 | O2 | 7.1° | 0.5° |
| C5 | O3 | C4 | H1 | 168.3° | 166.4° |
| C5 | O3 | C4 | H2 | 72.3° | 73.5° |
| O3 | C5 | C6 | H3 | 0.6° | 0.2° |
| C4 | O3 | C5 | C2 | 27.2° | 16.5° |
| O3 | C4 | C3 | H1 | 120.3° | 119.9° |
| O3 | C4 | C3 | H2 | 120.3° | 120.0° |
| O3 | C4 | C3 | O2 | 52.7° | 62.2° |
| O3 | C4 | H1 | H2 | 119.1° | 120.2° |
| O3 | C4 | C3 | H5 | 68.2° | 57.6° |
| O3 | C4 | C3 | H6 | 173.5° | 177.8° |
| S | C1 | C2 | C5 | 2.2° | 0.0° |
| S | C1 | C2 | C | 176.5° | 180.0° |
| S | C1 | C2 | O2 | 171.6° | 179.7° |
| S | C1 | C | O1 | 1.1° | 180.0° |
| S | C1 | C | O | 178.9° | 0.1° |
| C1 | S | C6 | H3 | 178.6° | 180.0° |
| C5 | C2 | C1 | O2 | 173.8° | 179.8° |
| C5 | C2 | C1 | C | 178.7° | 179.9° |
| C5 | C2 | O2 | C3 | 9.2° | 16.4° |
| C2 | C5 | C6 | H3 | 179.6° | 180.0° |
| C4 | C3 | O2 | C2 | 32.0° | 46.4° |
| C4 | C3 | O2 | H5 | 120.8° | 119.9° |
| C4 | C3 | O2 | H6 | 120.8° | 120.0° |
| C3 | C4 | H1 | H2 | 119.1° | 120.1° |
| C4 | C3 | H5 | H6 | 117.5° | 120.2° |
| C1 | C2 | O2 | C3 | 177.5° | 163.4° |
| C2 | C1 | C | O1 | 175.1° | 0.1° |
| C2 | C1 | C | O | 4.9° | 180.0° |
| O2 | C2 | C1 | C | 4.9° | 0.3° |
| C2 | O2 | C3 | H5 | 88.9° | 73.5° |
| C2 | O2 | C3 | H6 | 152.8° | 166.4° |
| C1 | C | O1 | O | 180.0° | 179.9° |
| C1 | C | O | H4 | 180.0° | 180.0° |
| O2 | C3 | C4 | H1 | 172.9° | 177.8° |
| O2 | C3 | C4 | H2 | 67.7° | 57.8° |
| O2 | C3 | H5 | H6 | 117.5° | 120.1° |
| O1 | C | O | H4 | 0.0° | 0.0° |
| H1 | C4 | C3 | H5 | 52.1° | 62.3° |
| H1 | C4 | C3 | H6 | 66.2° | 57.9° |
| H2 | C4 | C3 | H5 | 171.5° | 177.6° |
| H2 | C4 | C3 | H6 | 53.2° | 62.2° |
