GVH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C2 | sing | 1.35Å | 1.34Å | |
| C2 | C3 | doub | 1.39Å | 1.40Å | |
| C3 | C4 | sing | 1.40Å | 1.38Å | |
| C3 | C20 | sing | 1.42Å | 1.40Å | |
| C4 | C5 | doub | 1.39Å | 1.38Å | |
| N1 | C6 | doub | 1.35Å | 1.34Å | |
| C5 | C6 | sing | 1.39Å | 1.39Å | |
| C2 | N7 | sing | 1.37Å | 1.36Å | |
| C20 | C8 | doub | 1.38Å | 1.38Å | |
| N7 | C8 | sing | 1.37Å | 1.36Å | |
| C6 | H6 | sing | 1.09Å | 1.08Å | |
| N7 | H7 | sing | 1.01Å | 1.00Å | |
| C4 | H4 | sing | 1.09Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C5 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C2 | C3 | 125.6° | 127.1° |
| C2 | N1 | C6 | 114.6° | 112.9° |
| N1 | C2 | N7 | 126.3° | 124.9° |
| C2 | C3 | C4 | 117.8° | 117.4° |
| C2 | C3 | C20 | 106.8° | 106.8° |
| C3 | C2 | N7 | 108.0° | 107.9° |
| C4 | C3 | C20 | 135.4° | 135.8° |
| C3 | C4 | C5 | 117.8° | 117.8° |
| C3 | C4 | H4 | 121.1° | 121.5° |
| C3 | C20 | C8 | 107.5° | 107.6° |
| C3 | C20 | H20 | 126.2° | 127.0° |
| C4 | C5 | C6 | 120.0° | 118.7° |
| C5 | C4 | H4 | 121.1° | 120.7° |
| C4 | C5 | H5 | 120.0° | 120.5° |
| N1 | C6 | C5 | 124.2° | 126.0° |
| N1 | C6 | H6 | 117.9° | 114.3° |
| C5 | C6 | H6 | 117.9° | 119.7° |
| C6 | C5 | H5 | 120.0° | 120.7° |
| C2 | N7 | C8 | 109.2° | 109.6° |
| C2 | N7 | H7 | 125.4° | 125.2° |
| C20 | C8 | N7 | 108.5° | 108.0° |
| C8 | C20 | H20 | 126.3° | 125.4° |
| C20 | C8 | H8 | 125.8° | 131.4° |
| C8 | N7 | H7 | 125.4° | 125.2° |
| N7 | C8 | H8 | 125.7° | 120.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C2 | C3 | N7 | 179.1° | 180.0° |
| N1 | C2 | C3 | C4 | 1.5° | 0.0° |
| N1 | C2 | C3 | C20 | 179.6° | 180.0° |
| C2 | N1 | C6 | C5 | 0.6° | 0.0° |
| N1 | C2 | N7 | C8 | 179.3° | 180.0° |
| C2 | N1 | C6 | H6 | 179.4° | 179.9° |
| N1 | C2 | N7 | H7 | 0.7° | 0.1° |
| C2 | C3 | C4 | C20 | 178.4° | 180.0° |
| C2 | C3 | C4 | C5 | 1.1° | 0.0° |
| C3 | C2 | N1 | C6 | 0.7° | 0.0° |
| C2 | C3 | C20 | C8 | 0.6° | 0.0° |
| C3 | C2 | N7 | C8 | 0.2° | 0.0° |
| C3 | C2 | N7 | H7 | 179.8° | 180.0° |
| C2 | C3 | C4 | H4 | 178.9° | 180.0° |
| C2 | C3 | C20 | H20 | 179.4° | 180.0° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.0° | 0.0° |
| C4 | C3 | C2 | N7 | 179.3° | 180.0° |
| C4 | C3 | C20 | C8 | 179.1° | 180.0° |
| C4 | C3 | C20 | H20 | 0.8° | 0.0° |
| C3 | C4 | C5 | H5 | 180.0° | 180.0° |
| C20 | C3 | C4 | C5 | 179.5° | 180.0° |
| C20 | C3 | C2 | N7 | 0.5° | 0.0° |
| C3 | C20 | C8 | H20 | 180.0° | 180.0° |
| C3 | C20 | C8 | N7 | 0.5° | 0.0° |
| C20 | C3 | C4 | H4 | 0.5° | 0.0° |
| C3 | C20 | C8 | H8 | 179.5° | 180.0° |
| C4 | C5 | C6 | N1 | 0.9° | 0.0° |
| C4 | C5 | C6 | H5 | 180.0° | 180.0° |
| C4 | C5 | C6 | H6 | 179.1° | 179.9° |
| N1 | C6 | C5 | H6 | 180.0° | 179.9° |
| C6 | N1 | C2 | N7 | 179.6° | 180.0° |
| N1 | C6 | C5 | H5 | 179.1° | 180.0° |
| C6 | C5 | C4 | H4 | 180.0° | 180.0° |
| C2 | N7 | C8 | C20 | 0.2° | 0.0° |
| C2 | N7 | C8 | H7 | 180.0° | 179.9° |
| C2 | N7 | C8 | H8 | 179.8° | 180.0° |
| C20 | C8 | N7 | H8 | 180.0° | 180.0° |
| C20 | C8 | N7 | H7 | 179.8° | 180.0° |
| N7 | C8 | C20 | H20 | 179.5° | 180.0° |
| H6 | C6 | C5 | H5 | 0.9° | 0.1° |
| H7 | N7 | C8 | H8 | 0.2° | 0.0° |
| H4 | C4 | C5 | H5 | 0.0° | 0.0° |
| H20 | C20 | C8 | H8 | 0.5° | 0.0° |
