GO1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | CL1 | sing | 1.74Å | 1.71Å | |
| C3 | C2 | doub | 1.39Å | 1.38Å | Aromatic |
| C12 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C3 | sing | 1.41Å | 1.37Å | Aromatic |
| C3 | N4 | sing | 1.38Å | 1.34Å | Aromatic |
| C6 | N4 | sing | 1.38Å | 1.33Å | Aromatic |
| C7 | C6 | doub | 1.36Å | 1.37Å | Aromatic |
| C6 | C22 | sing | 1.47Å | 1.35Å | |
| C15 | C7 | sing | 1.51Å | 1.52Å | |
| C7 | C8 | sing | 1.42Å | 1.50Å | Aromatic |
| C9 | C8 | doub | 1.40Å | 1.42Å | Aromatic |
| C9 | C11 | sing | 1.37Å | 1.42Å | Aromatic |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| CL14 | C11 | sing | 1.74Å | 1.75Å | |
| C11 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C18 | C15 | sing | 1.51Å | 1.50Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| O19 | C18 | doub | 1.21Å | 1.22Å | |
| O20 | C18 | sing | 1.34Å | 1.34Å | |
| O20 | HO20 | sing | 0.97Å | 0.95Å | |
| O23 | C22 | doub | 1.22Å | 1.22Å | |
| C22 | O24 | sing | 1.35Å | 1.34Å | |
| O24 | HO24 | sing | 0.97Å | 0.95Å | |
| N4 | HN4 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL1 | C2 | C3 | 122.3° | 120.1° |
| CL1 | C2 | C12 | 118.6° | 120.1° |
| C3 | C2 | C12 | 119.2° | 119.8° |
| C2 | C3 | C8 | 120.9° | 119.4° |
| C2 | C3 | N4 | 127.2° | 133.2° |
| C2 | C12 | C11 | 120.6° | 120.6° |
| C2 | C12 | H12 | 119.7° | 119.7° |
| C8 | C3 | N4 | 111.9° | 107.4° |
| C3 | C8 | C7 | 102.0° | 107.0° |
| C3 | C8 | C9 | 122.3° | 119.7° |
| C3 | N4 | C6 | 110.1° | 108.7° |
| C3 | N4 | HN4 | 124.9° | 125.6° |
| N4 | C6 | C7 | 108.9° | 109.1° |
| N4 | C6 | C22 | 123.5° | 125.4° |
| C6 | N4 | HN4 | 124.9° | 125.7° |
| C7 | C6 | C22 | 127.6° | 125.5° |
| C6 | C7 | C15 | 127.8° | 126.1° |
| C6 | C7 | C8 | 107.1° | 107.7° |
| C6 | C22 | O23 | 121.1° | 120.0° |
| C6 | C22 | O24 | 119.7° | 120.0° |
| C15 | C7 | C8 | 125.1° | 126.2° |
| C7 | C15 | C18 | 109.4° | 109.5° |
| C7 | C15 | H15 | 109.5° | 109.5° |
| C7 | C15 | H15A | 109.5° | 109.5° |
| C7 | C8 | C9 | 135.8° | 133.3° |
| C8 | C9 | C11 | 115.7° | 119.8° |
| C8 | C9 | H9 | 122.1° | 120.1° |
| C11 | C9 | H9 | 122.1° | 120.1° |
| C9 | C11 | CL14 | 124.6° | 119.7° |
| C9 | C11 | C12 | 121.3° | 120.6° |
| CL14 | C11 | C12 | 114.1° | 119.7° |
| C11 | C12 | H12 | 119.7° | 119.6° |
| C18 | C15 | H15 | 109.5° | 109.4° |
| C18 | C15 | H15A | 109.5° | 109.5° |
| C15 | C18 | O19 | 121.8° | 120.0° |
| C15 | C18 | O20 | 115.5° | 120.0° |
| H15 | C15 | H15A | 109.4° | 109.5° |
| O19 | C18 | O20 | 122.7° | 120.0° |
| C18 | O20 | HO20 | 109.5° | 117.0° |
| O23 | C22 | O24 | 119.2° | 120.0° |
| C22 | O24 | HO24 | 109.5° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL1 | C2 | C3 | C12 | 179.4° | 179.7° |
| CL1 | C2 | C3 | C8 | 179.0° | 180.0° |
| CL1 | C2 | C3 | N4 | 0.8° | 0.1° |
| CL1 | C2 | C12 | C11 | 179.7° | 179.8° |
| CL1 | C2 | C12 | H12 | 0.3° | 0.2° |
| C2 | C3 | C8 | N4 | 179.8° | 179.9° |
| C2 | C3 | N4 | C6 | 179.3° | 180.0° |
| C2 | C3 | C8 | C7 | 179.7° | 179.9° |
| C2 | C3 | C8 | C9 | 0.8° | 0.1° |
| C3 | C2 | C12 | C11 | 0.9° | 0.5° |
| C3 | C2 | C12 | H12 | 179.2° | 179.9° |
| C2 | C3 | N4 | HN4 | 0.6° | 0.1° |
| C12 | C2 | C3 | C8 | 0.5° | 0.3° |
| C12 | C2 | C3 | N4 | 179.7° | 179.8° |
| C2 | C12 | C11 | C9 | 1.9° | 0.5° |
| C2 | C12 | C11 | CL14 | 178.4° | 179.7° |
| C2 | C12 | C11 | H12 | 180.0° | 179.6° |
| C8 | C3 | N4 | C6 | 0.5° | 0.1° |
| C3 | C8 | C7 | C6 | 0.3° | 0.1° |
| C3 | C8 | C7 | C15 | 179.3° | 180.0° |
| C3 | C8 | C7 | C9 | 179.4° | 180.0° |
| C3 | C8 | C9 | C11 | 0.3° | 0.0° |
| C3 | C8 | C9 | H9 | 179.7° | 179.9° |
| C8 | C3 | N4 | HN4 | 179.6° | 180.0° |
| C3 | N4 | C6 | HN4 | 180.0° | 179.9° |
| C3 | N4 | C6 | C7 | 0.6° | 0.1° |
| C3 | N4 | C6 | C22 | 179.6° | 180.0° |
| N4 | C3 | C8 | C7 | 0.1° | 0.0° |
| N4 | C3 | C8 | C9 | 179.4° | 180.0° |
| N4 | C6 | C7 | C22 | 179.7° | 179.9° |
| N4 | C6 | C7 | C15 | 179.0° | 180.0° |
| N4 | C6 | C7 | C8 | 0.6° | 0.1° |
| N4 | C6 | C22 | O23 | 172.8° | 179.9° |
| N4 | C6 | C22 | O24 | 7.7° | 0.1° |
| C6 | C7 | C15 | C8 | 179.5° | 179.9° |
| C6 | C7 | C8 | C9 | 179.7° | 180.0° |
| C6 | C7 | C15 | C18 | 120.2° | 90.0° |
| C6 | C7 | C15 | H15 | 119.8° | 150.0° |
| C6 | C7 | C15 | H15A | 0.3° | 30.0° |
| C7 | C6 | C22 | O23 | 7.5° | 0.1° |
| C7 | C6 | C22 | O24 | 172.0° | 180.0° |
| C7 | C6 | N4 | HN4 | 179.4° | 180.0° |
| C22 | C6 | C7 | C15 | 0.7° | 0.1° |
| C22 | C6 | C7 | C8 | 179.7° | 180.0° |
| C6 | C22 | O23 | O24 | 179.5° | 180.0° |
| C6 | C22 | O24 | HO24 | 179.6° | 179.9° |
| C22 | C6 | N4 | HN4 | 0.3° | 0.1° |
| C15 | C7 | C8 | C9 | 0.1° | 0.0° |
| C7 | C15 | C18 | H15 | 120.0° | 120.0° |
| C7 | C15 | C18 | H15A | 120.0° | 120.0° |
| C7 | C15 | H15 | H15A | 120.1° | 120.0° |
| C7 | C15 | C18 | O19 | 26.4° | 0.0° |
| C7 | C15 | C18 | O20 | 153.9° | 180.0° |
| C7 | C8 | C9 | C11 | 179.1° | 180.0° |
| C7 | C8 | C9 | H9 | 0.9° | 0.1° |
| C8 | C7 | C15 | C18 | 59.2° | 89.9° |
| C8 | C7 | C15 | H15 | 60.8° | 30.0° |
| C8 | C7 | C15 | H15A | 179.2° | 150.0° |
| C8 | C9 | C11 | H9 | 180.0° | 179.9° |
| C8 | C9 | C11 | CL14 | 178.8° | 180.0° |
| C8 | C9 | C11 | C12 | 1.6° | 0.3° |
| C9 | C11 | CL14 | C12 | 179.7° | 179.8° |
| C9 | C11 | C12 | H12 | 178.1° | 179.9° |
| H9 | C9 | C11 | CL14 | 1.3° | 0.1° |
| H9 | C9 | C11 | C12 | 178.4° | 179.9° |
| CL14 | C11 | C12 | H12 | 1.6° | 0.2° |
| C18 | C15 | H15 | H15A | 120.0° | 120.0° |
| C15 | C18 | O19 | O20 | 179.7° | 180.0° |
| C15 | C18 | O20 | HO20 | 179.7° | 180.0° |
| H15 | C15 | C18 | O19 | 146.4° | 120.0° |
| H15 | C15 | C18 | O20 | 33.8° | 60.0° |
| H15A | C15 | C18 | O19 | 93.6° | 120.0° |
| H15A | C15 | C18 | O20 | 86.1° | 59.9° |
| O19 | C18 | O20 | HO20 | 0.0° | 0.1° |
| O23 | C22 | O24 | HO24 | 0.0° | 0.0° |
