A1AZH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O01 | C01 | sing | 1.43Å | 1.39Å | |
| C01 | C02 | sing | 1.53Å | 1.52Å | |
| C02 | O02 | sing | 1.43Å | 1.40Å | |
| C02 | C03 | sing | 1.53Å | 1.53Å | |
| C03 | S01 | sing | 1.81Å | 1.81Å | |
| S01 | O03 | sing | 1.52Å | 1.47Å | |
| S01 | O04 | doub | 1.42Å | 1.47Å | |
| S01 | O05 | doub | 1.42Å | 1.46Å | |
| C01 | H02 | sing | 1.09Å | 1.10Å | |
| C01 | H03 | sing | 1.09Å | 1.10Å | |
| C02 | H04 | sing | 1.09Å | 1.10Å | |
| O01 | H01 | sing | 0.97Å | 0.95Å | |
| C03 | H05 | sing | 1.09Å | 1.10Å | |
| C03 | H06 | sing | 1.09Å | 1.10Å | |
| O02 | H07 | sing | 0.97Å | 0.95Å | |
| O03 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C01 | C02 | 105.4° | 109.4° |
| O01 | C01 | H02 | 110.4° | 109.5° |
| O01 | C01 | H03 | 110.5° | 109.5° |
| C01 | O01 | H01 | 109.5° | 114.0° |
| C01 | C02 | O02 | 104.8° | 109.5° |
| C01 | C02 | C03 | 109.5° | 109.5° |
| C02 | C01 | H02 | 110.5° | 109.5° |
| C02 | C01 | H03 | 110.5° | 109.5° |
| C01 | C02 | H04 | 108.8° | 109.5° |
| O02 | C02 | C03 | 114.2° | 109.4° |
| O02 | C02 | H04 | 110.5° | 109.5° |
| C02 | O02 | H07 | 109.5° | 114.0° |
| C02 | C03 | S01 | 113.0° | 109.5° |
| C03 | C02 | H04 | 108.8° | 109.5° |
| C02 | C03 | H05 | 108.6° | 109.5° |
| C02 | C03 | H06 | 108.6° | 109.5° |
| C03 | S01 | O03 | 112.2° | 104.5° |
| C03 | S01 | O04 | 115.4° | 110.6° |
| C03 | S01 | O05 | 113.8° | 110.6° |
| S01 | C03 | H05 | 108.6° | 109.5° |
| S01 | C03 | H06 | 108.6° | 109.5° |
| O03 | S01 | O04 | 103.8° | 104.3° |
| O03 | S01 | O05 | 103.5° | 104.2° |
| S01 | O03 | H1 | 109.5° | 114.0° |
| O04 | S01 | O05 | 107.0° | 121.0° |
| H02 | C01 | H03 | 109.5° | 109.5° |
| H05 | C03 | H06 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C01 | C02 | H02 | 119.3° | 120.0° |
| O01 | C01 | C02 | H03 | 119.4° | 120.0° |
| O01 | C01 | C02 | O02 | 86.3° | 65.0° |
| O01 | C01 | C02 | C03 | 150.7° | 175.0° |
| O01 | C01 | H02 | H03 | 121.9° | 120.0° |
| O01 | C01 | C02 | H04 | 31.9° | 55.0° |
| C01 | C02 | O02 | C03 | 119.9° | 120.0° |
| C01 | C02 | O02 | H04 | 117.1° | 120.0° |
| C01 | C02 | C03 | H04 | 118.8° | 120.0° |
| C01 | C02 | C03 | S01 | 171.7° | 180.0° |
| C02 | C01 | H02 | H03 | 121.9° | 120.0° |
| C02 | C01 | O01 | H01 | 180.0° | 180.0° |
| C01 | C02 | C03 | H05 | 67.8° | 60.0° |
| C01 | C02 | C03 | H06 | 51.2° | 60.0° |
| C01 | C02 | O02 | H07 | 180.0° | 59.9° |
| O02 | C02 | C03 | H04 | 124.0° | 120.0° |
| O02 | C02 | C03 | S01 | 71.1° | 60.0° |
| O02 | C02 | C01 | H02 | 33.0° | 175.0° |
| O02 | C02 | C01 | H03 | 154.3° | 54.9° |
| O02 | C02 | C03 | H05 | 49.4° | 60.0° |
| O02 | C02 | C03 | H06 | 168.4° | 180.0° |
| C02 | C03 | S01 | H05 | 120.5° | 120.0° |
| C02 | C03 | S01 | H06 | 120.5° | 120.0° |
| C02 | C03 | S01 | O03 | 166.2° | 180.0° |
| C02 | C03 | S01 | O04 | 75.2° | 68.3° |
| C02 | C03 | S01 | O05 | 49.0° | 68.4° |
| C03 | C02 | C01 | H02 | 90.0° | 55.0° |
| C03 | C02 | C01 | H03 | 31.3° | 65.0° |
| C02 | C03 | H05 | H06 | 118.4° | 120.0° |
| C03 | C02 | O02 | H07 | 60.1° | 60.0° |
| C03 | S01 | O03 | O04 | 125.3° | 116.1° |
| C03 | S01 | O03 | O05 | 123.1° | 116.1° |
| C03 | S01 | O04 | O05 | 127.7° | 131.5° |
| S01 | C03 | C02 | H04 | 52.9° | 60.0° |
| S01 | C03 | H05 | H06 | 118.4° | 120.0° |
| C03 | S01 | O03 | H1 | 123.1° | 180.0° |
| O03 | S01 | O04 | O05 | 109.1° | 116.7° |
| O03 | S01 | C03 | H05 | 45.6° | 60.0° |
| O03 | S01 | C03 | H06 | 73.3° | 59.9° |
| O04 | S01 | C03 | H05 | 164.3° | 51.7° |
| O04 | S01 | C03 | H06 | 45.3° | 171.6° |
| O04 | S01 | O03 | H1 | 111.6° | 63.9° |
| O05 | S01 | C03 | H05 | 71.5° | 171.6° |
| O05 | S01 | C03 | H06 | 169.6° | 51.6° |
| O05 | S01 | O03 | H1 | 0.0° | 63.9° |
| H02 | C01 | C02 | H04 | 151.3° | 65.0° |
| H02 | C01 | O01 | H01 | 60.7° | 60.0° |
| H03 | C01 | C02 | H04 | 87.5° | 175.0° |
| H03 | C01 | O01 | H01 | 60.6° | 60.0° |
| H04 | C02 | C03 | H05 | 173.4° | 180.0° |
| H04 | C02 | C03 | H06 | 67.7° | 60.0° |
| H04 | C02 | O02 | H07 | 62.9° | 180.0° |
