F4G
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | N12 | sing | 1.32Å | 1.35Å | Aromatic |
| C15 | C10 | doub | 1.40Å | 1.40Å | Aromatic |
| C5 | C4 | doub | 1.35Å | 1.41Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.38Å | Aromatic |
| C4 | N3 | sing | 1.36Å | 1.37Å | Aromatic |
| N12 | C11 | doub | 1.32Å | 1.35Å | Aromatic |
| C10 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
| C10 | C9 | sing | 1.48Å | 1.51Å | |
| C6 | C1 | doub | 1.39Å | 1.40Å | Aromatic |
| N3 | C9 | sing | 1.38Å | 1.37Å | Aromatic |
| N3 | C2 | sing | 1.37Å | 1.36Å | Aromatic |
| C9 | C8 | doub | 1.36Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.46Å | 1.51Å | Aromatic |
| C1 | C16 | sing | 1.47Å | 1.51Å | |
| C2 | N7 | doub | 1.32Å | 1.37Å | Aromatic |
| C8 | N7 | sing | 1.33Å | 1.35Å | Aromatic |
| N18 | C16 | sing | 1.35Å | 1.33Å | |
| C16 | O17 | doub | 1.22Å | 1.23Å | |
| N18 | H1 | sing | 0.97Å | 1.00Å | |
| N18 | H2 | sing | 0.97Å | 1.00Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C4 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C15 | H7 | sing | 1.08Å | 1.08Å | |
| C14 | H8 | sing | 1.08Å | 1.08Å | |
| C13 | H9 | sing | 1.08Å | 1.08Å | |
| C11 | H10 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C14 | C15 | 118.7° | 119.3° |
| C14 | C13 | N12 | 121.4° | 121.1° |
| C13 | C14 | H8 | 120.6° | 120.4° |
| C14 | C13 | H9 | 119.3° | 119.4° |
| C14 | C15 | C10 | 119.5° | 118.3° |
| C14 | C15 | H7 | 120.2° | 120.8° |
| C15 | C14 | H8 | 120.6° | 120.3° |
| C13 | N12 | C11 | 120.8° | 121.9° |
| N12 | C13 | H9 | 119.3° | 119.5° |
| C15 | C10 | C11 | 119.0° | 118.9° |
| C15 | C10 | C9 | 121.5° | 120.6° |
| C10 | C15 | H7 | 120.2° | 120.8° |
| C4 | C5 | C6 | 119.9° | 121.2° |
| C5 | C4 | N3 | 124.2° | 121.7° |
| C4 | C5 | H4 | 120.1° | 119.4° |
| C5 | C4 | H5 | 117.9° | 119.2° |
| C5 | C6 | C1 | 118.3° | 119.3° |
| C5 | C6 | H3 | 120.8° | 120.4° |
| C6 | C5 | H4 | 120.1° | 119.4° |
| C4 | N3 | C9 | 135.2° | 132.6° |
| C4 | N3 | C2 | 118.8° | 120.6° |
| N3 | C4 | H5 | 117.9° | 119.1° |
| N12 | C11 | C10 | 120.5° | 120.6° |
| N12 | C11 | H10 | 119.7° | 119.7° |
| C11 | C10 | C9 | 119.3° | 120.6° |
| C10 | C11 | H10 | 119.7° | 119.7° |
| C10 | C9 | N3 | 121.5° | 126.6° |
| C10 | C9 | C8 | 128.4° | 126.6° |
| C6 | C1 | C2 | 119.8° | 118.3° |
| C6 | C1 | C16 | 120.0° | 120.8° |
| C1 | C6 | H3 | 120.8° | 120.4° |
| C9 | N3 | C2 | 106.0° | 106.8° |
| N3 | C9 | C8 | 110.0° | 106.8° |
| N3 | C2 | C1 | 119.0° | 119.0° |
| N3 | C2 | N7 | 109.1° | 108.5° |
| C9 | C8 | N7 | 105.6° | 108.5° |
| C9 | C8 | H6 | 127.2° | 125.8° |
| C2 | C1 | C16 | 120.2° | 120.8° |
| C1 | C2 | N7 | 132.0° | 132.5° |
| C1 | C16 | N18 | 119.8° | 120.0° |
| C1 | C16 | O17 | 119.8° | 120.0° |
| C2 | N7 | C8 | 109.3° | 109.5° |
| N7 | C8 | H6 | 127.2° | 125.7° |
| N18 | C16 | O17 | 120.4° | 120.0° |
| C16 | N18 | H1 | 120.0° | 120.0° |
| C16 | N18 | H2 | 120.0° | 120.0° |
| H1 | N18 | H2 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C14 | C15 | H8 | 180.0° | 179.9° |
| C14 | C13 | N12 | H9 | 180.0° | 180.0° |
| C13 | C14 | C15 | C10 | 0.7° | 0.0° |
| C14 | C13 | N12 | C11 | 0.5° | 0.0° |
| C13 | C14 | C15 | H7 | 179.3° | 179.9° |
| C15 | C14 | C13 | N12 | 0.2° | 0.0° |
| C14 | C15 | C10 | H7 | 180.0° | 179.9° |
| C14 | C15 | C10 | C11 | 1.5° | 0.0° |
| C14 | C15 | C10 | C9 | 176.9° | 179.7° |
| C15 | C14 | C13 | H9 | 179.8° | 180.0° |
| C13 | N12 | C11 | C10 | 1.3° | 0.0° |
| N12 | C13 | C14 | H8 | 179.8° | 179.9° |
| C13 | N12 | C11 | H10 | 178.7° | 179.7° |
| C15 | C10 | C11 | N12 | 1.8° | 0.0° |
| C15 | C10 | C11 | C9 | 175.5° | 179.7° |
| C15 | C10 | C9 | N3 | 26.5° | 22.2° |
| C15 | C10 | C9 | C8 | 148.6° | 157.9° |
| C10 | C15 | C14 | H8 | 179.3° | 179.9° |
| C15 | C10 | C11 | H10 | 178.2° | 179.7° |
| C4 | C5 | C6 | H4 | 180.0° | 180.0° |
| C5 | C4 | N3 | H5 | 180.0° | 179.9° |
| C4 | C5 | C6 | C1 | 0.0° | 0.0° |
| C5 | C4 | N3 | C9 | 177.9° | 180.0° |
| C5 | C4 | N3 | C2 | 0.6° | 0.1° |
| C4 | C5 | C6 | H3 | 180.0° | 180.0° |
| C6 | C5 | C4 | N3 | 0.5° | 0.1° |
| C5 | C6 | C1 | H3 | 180.0° | 180.0° |
| C5 | C6 | C1 | C2 | 0.3° | 0.0° |
| C5 | C6 | C1 | C16 | 179.7° | 179.7° |
| C6 | C5 | C4 | H5 | 179.5° | 180.0° |
| C4 | N3 | C9 | C10 | 3.9° | 0.1° |
| C4 | N3 | C9 | C2 | 178.6° | 179.9° |
| C4 | N3 | C9 | C8 | 179.8° | 180.0° |
| C4 | N3 | C2 | C1 | 0.3° | 0.1° |
| C4 | N3 | C2 | N7 | 179.8° | 180.0° |
| N3 | C4 | C5 | H4 | 179.5° | 180.0° |
| N12 | C11 | C10 | H10 | 180.0° | 179.7° |
| N12 | C11 | C10 | C9 | 177.3° | 179.7° |
| C11 | N12 | C13 | H9 | 179.5° | 180.0° |
| C11 | C10 | C9 | N3 | 158.1° | 158.1° |
| C11 | C10 | C9 | C8 | 26.7° | 21.8° |
| C11 | C10 | C15 | H7 | 178.5° | 180.0° |
| C10 | C9 | N3 | C8 | 175.9° | 180.0° |
| C10 | C9 | N3 | C2 | 177.5° | 180.0° |
| C10 | C9 | C8 | N7 | 177.2° | 180.0° |
| C10 | C9 | C8 | H6 | 2.8° | 0.1° |
| C9 | C10 | C15 | H7 | 3.1° | 0.3° |
| C9 | C10 | C11 | H10 | 2.7° | 0.0° |
| C6 | C1 | C2 | N3 | 0.2° | 0.1° |
| C6 | C1 | C2 | C16 | 179.9° | 179.7° |
| C6 | C1 | C2 | N7 | 179.3° | 180.0° |
| C6 | C1 | C16 | N18 | 36.8° | 180.0° |
| C6 | C1 | C16 | O17 | 142.1° | 0.2° |
| C1 | C6 | C5 | H4 | 180.0° | 180.0° |
| C9 | N3 | C2 | C1 | 178.6° | 179.9° |
| C9 | N3 | C2 | N7 | 1.0° | 0.0° |
| N3 | C9 | C8 | N7 | 1.6° | 0.0° |
| C9 | N3 | C4 | H5 | 2.1° | 0.1° |
| N3 | C9 | C8 | H6 | 178.4° | 180.0° |
| C2 | N3 | C9 | C8 | 1.6° | 0.0° |
| N3 | C2 | C1 | N7 | 179.5° | 179.9° |
| N3 | C2 | C1 | C16 | 179.8° | 179.8° |
| N3 | C2 | N7 | C8 | 0.0° | 0.0° |
| C2 | N3 | C4 | H5 | 179.4° | 180.0° |
| C9 | C8 | N7 | C2 | 1.0° | 0.0° |
| C9 | C8 | N7 | H6 | 180.0° | 180.0° |
| C1 | C2 | N7 | C8 | 179.5° | 179.9° |
| C2 | C1 | C16 | N18 | 143.2° | 0.3° |
| C2 | C1 | C16 | O17 | 37.8° | 180.0° |
| C2 | C1 | C6 | H3 | 179.7° | 180.0° |
| C16 | C1 | C2 | N7 | 0.8° | 0.3° |
| C1 | C16 | N18 | O17 | 179.0° | 179.8° |
| C1 | C16 | N18 | H1 | 179.0° | 179.7° |
| C1 | C16 | N18 | H2 | 1.0° | 0.3° |
| C16 | C1 | C6 | H3 | 0.4° | 0.3° |
| C2 | N7 | C8 | H6 | 179.0° | 180.0° |
| C16 | N18 | H1 | H2 | 180.0° | 180.0° |
| O17 | C16 | N18 | H1 | 0.0° | 0.0° |
| O17 | C16 | N18 | H2 | 180.0° | 180.0° |
| H3 | C6 | C5 | H4 | 0.0° | 0.0° |
| H4 | C5 | C4 | H5 | 0.5° | 0.1° |
| H7 | C15 | C14 | H8 | 0.7° | 0.0° |
| H8 | C14 | C13 | H9 | 0.2° | 0.1° |
