SZY
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C02 | C01 | sing | 1.51Å | 1.53Å | |
| O03 | C02 | doub | 1.21Å | 1.18Å | |
| N04 | C02 | sing | 1.35Å | 1.45Å | |
| C05 | N04 | sing | 1.40Å | 1.45Å | |
| C06 | C05 | doub | 1.39Å | 1.39Å | Aromatic |
| N07 | C06 | sing | 1.32Å | 1.32Å | Aromatic |
| C08 | N07 | doub | 1.32Å | 1.31Å | Aromatic |
| C09 | C08 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | C09 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C10 | sing | 1.51Å | 1.53Å | |
| C05 | C10 | sing | 1.39Å | 1.39Å | Aromatic |
| C01 | H012 | sing | 1.09Å | 1.10Å | |
| C01 | H011 | sing | 1.09Å | 1.10Å | |
| C01 | H013 | sing | 1.09Å | 1.10Å | |
| C06 | H061 | sing | 1.08Å | 1.08Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C09 | H091 | sing | 1.08Å | 1.08Å | |
| C11 | H111 | sing | 1.09Å | 1.10Å | |
| C11 | H113 | sing | 1.09Å | 1.10Å | |
| C11 | H112 | sing | 1.09Å | 1.10Å | |
| N04 | H041 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C01 | C02 | O03 | 119.5° | 120.1° |
| C01 | C02 | N04 | 120.3° | 120.0° |
| C02 | C01 | H012 | 109.5° | 109.5° |
| C02 | C01 | H011 | 109.5° | 109.5° |
| C02 | C01 | H013 | 109.5° | 109.5° |
| O03 | C02 | N04 | 120.2° | 120.0° |
| C02 | N04 | C05 | 120.5° | 120.0° |
| C02 | N04 | H041 | 119.8° | 120.0° |
| N04 | C05 | C06 | 120.0° | 120.5° |
| N04 | C05 | C10 | 121.1° | 120.5° |
| C05 | N04 | H041 | 119.7° | 120.0° |
| C05 | C06 | N07 | 121.5° | 120.7° |
| C06 | C05 | C10 | 118.9° | 119.0° |
| C05 | C06 | H061 | 119.2° | 119.6° |
| C06 | N07 | C08 | 120.8° | 121.8° |
| N07 | C06 | H061 | 119.3° | 119.7° |
| N07 | C08 | C09 | 121.9° | 120.9° |
| N07 | C08 | H081 | 119.0° | 119.5° |
| C08 | C09 | C10 | 118.6° | 119.2° |
| C09 | C08 | H081 | 119.0° | 119.6° |
| C08 | C09 | H091 | 120.7° | 120.4° |
| C09 | C10 | C11 | 121.1° | 120.8° |
| C09 | C10 | C05 | 118.3° | 118.4° |
| C10 | C09 | H091 | 120.7° | 120.4° |
| C11 | C10 | C05 | 120.6° | 120.8° |
| C10 | C11 | H111 | 109.5° | 109.5° |
| C10 | C11 | H113 | 109.5° | 109.5° |
| C10 | C11 | H112 | 109.5° | 109.5° |
| H012 | C01 | H011 | 109.5° | 109.5° |
| H012 | C01 | H013 | 109.4° | 109.5° |
| H011 | C01 | H013 | 109.5° | 109.4° |
| H111 | C11 | H113 | 109.5° | 109.4° |
| H111 | C11 | H112 | 109.4° | 109.5° |
| H113 | C11 | H112 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C01 | C02 | O03 | N04 | 179.6° | 180.0° |
| C01 | C02 | N04 | C05 | 179.8° | 175.6° |
| C02 | C01 | H012 | H011 | 120.0° | 120.0° |
| C02 | C01 | H012 | H013 | 120.0° | 120.0° |
| C02 | C01 | H011 | H013 | 120.0° | 120.0° |
| C01 | C02 | N04 | H041 | 0.2° | 4.5° |
| O03 | C02 | N04 | C05 | 0.6° | 4.4° |
| O03 | C02 | C01 | H012 | 0.0° | 180.0° |
| O03 | C02 | C01 | H011 | 120.0° | 60.0° |
| O03 | C02 | C01 | H013 | 120.0° | 60.0° |
| O03 | C02 | N04 | H041 | 179.4° | 175.5° |
| C02 | N04 | C05 | H041 | 180.0° | 179.9° |
| C02 | N04 | C05 | C06 | 73.4° | 34.5° |
| C02 | N04 | C05 | C10 | 106.5° | 145.4° |
| N04 | C02 | C01 | H012 | 179.6° | 0.0° |
| N04 | C02 | C01 | H011 | 59.6° | 120.0° |
| N04 | C02 | C01 | H013 | 60.4° | 120.0° |
| N04 | C05 | C06 | C10 | 179.9° | 180.0° |
| N04 | C05 | C06 | N07 | 179.9° | 179.9° |
| N04 | C05 | C10 | C09 | 179.8° | 179.9° |
| N04 | C05 | C10 | C11 | 0.4° | 0.3° |
| N04 | C05 | C06 | H061 | 0.1° | 0.0° |
| C05 | C06 | N07 | H061 | 180.0° | 179.9° |
| C05 | C06 | N07 | C08 | 0.2° | 0.0° |
| C06 | C05 | C10 | C09 | 0.1° | 0.0° |
| C06 | C05 | C10 | C11 | 179.5° | 179.7° |
| C06 | C05 | N04 | H041 | 106.6° | 145.4° |
| C06 | N07 | C08 | C09 | 0.1° | 0.0° |
| N07 | C06 | C05 | C10 | 0.2° | 0.0° |
| C06 | N07 | C08 | H081 | 179.9° | 180.0° |
| N07 | C08 | C09 | H081 | 180.0° | 180.0° |
| N07 | C08 | C09 | C10 | 0.4° | 0.0° |
| C08 | N07 | C06 | H061 | 179.8° | 179.9° |
| N07 | C08 | C09 | H091 | 179.6° | 180.0° |
| C08 | C09 | C10 | H091 | 180.0° | 180.0° |
| C08 | C09 | C10 | C11 | 179.8° | 179.7° |
| C08 | C09 | C10 | C05 | 0.4° | 0.0° |
| C09 | C10 | C11 | C05 | 179.4° | 179.7° |
| C10 | C09 | C08 | H081 | 179.6° | 180.0° |
| C09 | C10 | C11 | H111 | 90.3° | 90.0° |
| C09 | C10 | C11 | H113 | 149.7° | 150.0° |
| C09 | C10 | C11 | H112 | 29.7° | 30.0° |
| C11 | C10 | C09 | H091 | 0.2° | 0.2° |
| C10 | C11 | H111 | H113 | 120.0° | 120.0° |
| C10 | C11 | H111 | H112 | 120.0° | 120.1° |
| C10 | C11 | H113 | H112 | 120.0° | 120.1° |
| C10 | C05 | C06 | H061 | 179.8° | 179.9° |
| C05 | C10 | C09 | H091 | 179.6° | 180.0° |
| C05 | C10 | C11 | H111 | 90.3° | 89.7° |
| C05 | C10 | C11 | H113 | 29.7° | 30.3° |
| C05 | C10 | C11 | H112 | 149.7° | 150.3° |
| C10 | C05 | N04 | H041 | 73.5° | 34.7° |
| H012 | C01 | H011 | H013 | 120.0° | 120.0° |
| H081 | C08 | C09 | H091 | 0.4° | 0.0° |
| H111 | C11 | H113 | H112 | 120.0° | 119.9° |
