A1EBQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O11 | C09 | doub | 1.22Å | 1.19Å | |
| C12 | N10 | sing | 1.46Å | 1.47Å | |
| C09 | N10 | sing | 1.35Å | 1.47Å | |
| C09 | C08 | sing | 1.46Å | 1.53Å | |
| C08 | C07 | doub | 1.35Å | 1.33Å | |
| C07 | C05 | sing | 1.47Å | 1.54Å | |
| C04 | C05 | doub | 1.40Å | 1.39Å | Aromatic |
| C04 | C03 | sing | 1.38Å | 1.40Å | Aromatic |
| C05 | C06 | sing | 1.40Å | 1.40Å | Aromatic |
| C03 | C02 | doub | 1.38Å | 1.41Å | Aromatic |
| C06 | C01 | doub | 1.38Å | 1.40Å | Aromatic |
| C02 | C01 | sing | 1.38Å | 1.39Å | Aromatic |
| C01 | H1 | sing | 1.08Å | 1.08Å | |
| C02 | H2 | sing | 1.08Å | 1.08Å | |
| C03 | H3 | sing | 1.08Å | 1.08Å | |
| C04 | H4 | sing | 1.08Å | 1.08Å | |
| C06 | H5 | sing | 1.08Å | 1.08Å | |
| C07 | H6 | sing | 1.08Å | 1.08Å | |
| C08 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.09Å | 1.10Å | |
| C12 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| N10 | H13 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O11 | C09 | N10 | 121.7° | 120.0° |
| O11 | C09 | C08 | 118.7° | 120.0° |
| C12 | N10 | C09 | 121.9° | 120.0° |
| N10 | C12 | H10 | 109.5° | 109.4° |
| N10 | C12 | H11 | 109.5° | 109.5° |
| N10 | C12 | H12 | 109.5° | 109.5° |
| C12 | N10 | H13 | 119.0° | 120.0° |
| N10 | C09 | C08 | 119.6° | 120.0° |
| C09 | N10 | H13 | 119.1° | 120.0° |
| C09 | C08 | C07 | 150.8° | 120.0° |
| C09 | C08 | H8 | 104.6° | 120.0° |
| C08 | C07 | C05 | 113.0° | 120.0° |
| C08 | C07 | H6 | 123.5° | 120.0° |
| C07 | C08 | H8 | 104.6° | 120.0° |
| C07 | C05 | C04 | 120.0° | 120.2° |
| C07 | C05 | C06 | 119.8° | 120.1° |
| C05 | C07 | H6 | 123.5° | 120.0° |
| C05 | C04 | C03 | 119.1° | 119.8° |
| C04 | C05 | C06 | 120.2° | 119.7° |
| C05 | C04 | H4 | 120.5° | 120.1° |
| C04 | C03 | C02 | 120.8° | 120.2° |
| C04 | C03 | H3 | 119.6° | 119.9° |
| C03 | C04 | H4 | 120.4° | 120.1° |
| C05 | C06 | C01 | 120.9° | 119.8° |
| C05 | C06 | H5 | 119.5° | 120.1° |
| C03 | C02 | C01 | 120.0° | 120.4° |
| C03 | C02 | H2 | 120.0° | 119.8° |
| C02 | C03 | H3 | 119.6° | 119.9° |
| C06 | C01 | C02 | 118.9° | 120.2° |
| C06 | C01 | H1 | 120.5° | 119.9° |
| C01 | C06 | H5 | 119.5° | 120.1° |
| C02 | C01 | H1 | 120.5° | 119.9° |
| C01 | C02 | H2 | 120.0° | 119.8° |
| H10 | C12 | H11 | 109.5° | 109.4° |
| H10 | C12 | H12 | 109.5° | 109.5° |
| H11 | C12 | H12 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O11 | C09 | N10 | C12 | 0.7° | 0.0° |
| O11 | C09 | N10 | C08 | 179.7° | 180.0° |
| O11 | C09 | C08 | C07 | 28.0° | 0.0° |
| O11 | C09 | C08 | H8 | 152.0° | 179.9° |
| O11 | C09 | N10 | H13 | 179.3° | 179.9° |
| C12 | N10 | C09 | H13 | 180.0° | 179.9° |
| C12 | N10 | C09 | C08 | 179.6° | 180.0° |
| N10 | C12 | H10 | H11 | 120.0° | 120.0° |
| N10 | C12 | H10 | H12 | 120.0° | 120.0° |
| N10 | C12 | H11 | H12 | 120.0° | 120.1° |
| N10 | C09 | C08 | C07 | 151.7° | 180.0° |
| N10 | C09 | C08 | H8 | 28.3° | 0.1° |
| C09 | N10 | C12 | H10 | 180.0° | 60.0° |
| C09 | N10 | C12 | H11 | 60.0° | 59.9° |
| C09 | N10 | C12 | H12 | 60.0° | 180.0° |
| C09 | C08 | C07 | H8 | 180.0° | 179.9° |
| C09 | C08 | C07 | C05 | 178.5° | 180.0° |
| C09 | C08 | C07 | H6 | 1.5° | 0.0° |
| C08 | C09 | N10 | H13 | 0.4° | 0.1° |
| C08 | C07 | C05 | H6 | 180.0° | 180.0° |
| C08 | C07 | C05 | C04 | 1.1° | 180.0° |
| C08 | C07 | C05 | C06 | 178.9° | 0.2° |
| C07 | C05 | C04 | C06 | 179.9° | 179.8° |
| C07 | C05 | C04 | C03 | 179.5° | 180.0° |
| C07 | C05 | C06 | C01 | 179.4° | 179.7° |
| C07 | C05 | C04 | H4 | 0.5° | 0.2° |
| C07 | C05 | C06 | H5 | 0.6° | 0.2° |
| C05 | C07 | C08 | H8 | 1.5° | 0.0° |
| C05 | C04 | C03 | H4 | 180.0° | 179.8° |
| C05 | C04 | C03 | C02 | 0.4° | 0.0° |
| C04 | C05 | C06 | C01 | 0.7° | 0.5° |
| C05 | C04 | C03 | H3 | 179.6° | 180.0° |
| C04 | C05 | C06 | H5 | 179.3° | 180.0° |
| C04 | C05 | C07 | H6 | 178.9° | 0.1° |
| C03 | C04 | C05 | C06 | 0.5° | 0.2° |
| C04 | C03 | C02 | H3 | 180.0° | 180.0° |
| C04 | C03 | C02 | C01 | 0.3° | 0.0° |
| C04 | C03 | C02 | H2 | 179.7° | 179.9° |
| C05 | C06 | C01 | H5 | 180.0° | 179.5° |
| C05 | C06 | C01 | C02 | 0.6° | 0.5° |
| C05 | C06 | C01 | H1 | 179.4° | 179.8° |
| C06 | C05 | C04 | H4 | 179.4° | 179.9° |
| C06 | C05 | C07 | H6 | 1.1° | 179.7° |
| C03 | C02 | C01 | C06 | 0.4° | 0.3° |
| C03 | C02 | C01 | H2 | 180.0° | 179.9° |
| C03 | C02 | C01 | H1 | 179.6° | 180.0° |
| C02 | C03 | C04 | H4 | 179.6° | 179.7° |
| C06 | C01 | C02 | H1 | 180.0° | 179.7° |
| C06 | C01 | C02 | H2 | 179.6° | 179.8° |
| C01 | C02 | C03 | H3 | 179.7° | 180.0° |
| C02 | C01 | C06 | H5 | 179.4° | 180.0° |
| H1 | C01 | C02 | H2 | 0.4° | 0.1° |
| H1 | C01 | C06 | H5 | 0.6° | 0.3° |
| H2 | C02 | C03 | H3 | 0.3° | 0.0° |
| H3 | C03 | C04 | H4 | 0.4° | 0.2° |
| H6 | C07 | C08 | H8 | 178.5° | 179.9° |
| H10 | C12 | H11 | H12 | 120.0° | 120.0° |
| H10 | C12 | N10 | H13 | 0.0° | 120.1° |
| H11 | C12 | N10 | H13 | 120.0° | 120.0° |
| H12 | C12 | N10 | H13 | 120.0° | 0.1° |
