6G7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O7 | C1 | sing | 1.36Å | 1.36Å | |
| C1 | C2 | doub | 1.39Å | 1.40Å | Aromatic |
| C1 | C6 | sing | 1.39Å | 1.38Å | Aromatic |
| C18 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.38Å | Aromatic |
| C6 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C17 | C16 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | C14 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | O8 | sing | 1.36Å | 1.37Å | |
| C3 | C4 | doub | 1.40Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.40Å | 1.40Å | Aromatic |
| C16 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C9 | sing | 1.48Å | 1.46Å | |
| C14 | C15 | sing | 1.39Å | 1.38Å | Aromatic |
| C14 | N13 | sing | 1.40Å | 1.42Å | |
| C15 | F21 | sing | 1.35Å | 1.35Å | |
| C9 | N13 | sing | 1.38Å | 1.41Å | |
| C9 | N10 | doub | 1.30Å | 1.31Å | |
| N13 | C12 | sing | 1.35Å | 1.36Å | |
| N10 | N11 | sing | 1.40Å | 1.41Å | |
| C12 | O20 | doub | 1.22Å | 1.22Å | |
| C12 | N11 | sing | 1.35Å | 1.34Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C16 | H2 | sing | 1.08Å | 1.08Å | |
| C19 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H5 | sing | 1.08Å | 1.08Å | |
| O7 | H6 | sing | 0.97Å | 0.95Å | |
| O8 | H7 | sing | 0.97Å | 0.95Å | |
| N11 | H8 | sing | 0.97Å | 1.00Å | |
| C17 | H9 | sing | 1.08Å | 1.08Å | |
| C18 | H10 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O7 | C1 | C2 | 120.1° | 119.8° |
| O7 | C1 | C6 | 119.1° | 119.9° |
| C1 | O7 | H6 | 109.5° | 114.0° |
| C2 | C1 | C6 | 120.8° | 120.2° |
| C1 | C2 | C3 | 119.1° | 120.0° |
| C1 | C2 | H1 | 120.4° | 120.0° |
| C1 | C6 | C5 | 120.1° | 120.2° |
| C1 | C6 | H5 | 120.0° | 119.9° |
| C17 | C18 | C19 | 121.7° | 120.1° |
| C18 | C17 | C16 | 119.2° | 120.1° |
| C18 | C17 | H9 | 120.4° | 120.0° |
| C17 | C18 | H10 | 119.2° | 119.9° |
| C18 | C19 | C14 | 118.6° | 119.9° |
| C18 | C19 | H3 | 120.7° | 120.0° |
| C19 | C18 | H10 | 119.1° | 120.0° |
| C2 | C3 | O8 | 120.2° | 120.1° |
| C2 | C3 | C4 | 120.3° | 119.8° |
| C3 | C2 | H1 | 120.5° | 120.0° |
| C6 | C5 | C4 | 119.5° | 119.9° |
| C6 | C5 | H4 | 120.3° | 120.0° |
| C5 | C6 | H5 | 120.0° | 119.9° |
| C17 | C16 | C15 | 119.3° | 120.1° |
| C17 | C16 | H2 | 120.3° | 120.0° |
| C16 | C17 | H9 | 120.4° | 119.9° |
| C19 | C14 | C15 | 120.7° | 119.9° |
| C19 | C14 | N13 | 122.6° | 120.1° |
| C14 | C19 | H3 | 120.7° | 120.1° |
| O8 | C3 | C4 | 119.4° | 120.1° |
| C3 | O8 | H7 | 109.5° | 114.0° |
| C3 | C4 | C5 | 120.2° | 119.8° |
| C3 | C4 | C9 | 122.0° | 120.1° |
| C5 | C4 | C9 | 117.5° | 120.1° |
| C4 | C5 | H4 | 120.2° | 120.0° |
| C16 | C15 | C14 | 120.6° | 119.8° |
| C16 | C15 | F21 | 120.7° | 120.1° |
| C15 | C16 | H2 | 120.4° | 120.0° |
| C4 | C9 | N13 | 126.3° | 125.7° |
| C4 | C9 | N10 | 124.4° | 125.7° |
| C15 | C14 | N13 | 116.7° | 120.0° |
| C14 | C15 | F21 | 118.7° | 120.1° |
| C14 | N13 | C9 | 128.0° | 125.9° |
| C14 | N13 | C12 | 124.4° | 125.9° |
| N13 | C9 | N10 | 109.0° | 108.6° |
| C9 | N13 | C12 | 107.5° | 108.2° |
| C9 | N10 | N11 | 106.4° | 108.0° |
| N13 | C12 | O20 | 127.0° | 126.2° |
| N13 | C12 | N11 | 107.2° | 107.6° |
| N10 | N11 | C12 | 109.8° | 107.6° |
| N10 | N11 | H8 | 125.1° | 126.3° |
| O20 | C12 | N11 | 125.8° | 126.2° |
| C12 | N11 | H8 | 125.1° | 126.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O7 | C1 | C2 | C6 | 178.0° | 179.7° |
| O7 | C1 | C2 | C3 | 176.4° | 179.7° |
| O7 | C1 | C6 | C5 | 176.2° | 179.7° |
| O7 | C1 | C2 | H1 | 3.6° | 0.3° |
| O7 | C1 | C6 | H5 | 3.7° | 0.3° |
| C1 | C2 | C3 | H1 | 180.0° | 180.0° |
| C2 | C1 | C6 | C5 | 1.8° | 0.0° |
| C1 | C2 | C3 | O8 | 178.9° | 179.9° |
| C1 | C2 | C3 | C4 | 1.8° | 0.1° |
| C2 | C1 | C6 | H5 | 178.2° | 179.9° |
| C2 | C1 | O7 | H6 | 180.0° | 90.1° |
| C6 | C1 | C2 | C3 | 1.6° | 0.1° |
| C1 | C6 | C5 | H5 | 180.0° | 180.0° |
| C1 | C6 | C5 | C4 | 2.1° | 0.0° |
| C6 | C1 | C2 | H1 | 178.4° | 180.0° |
| C1 | C6 | C5 | H4 | 177.9° | 180.0° |
| C6 | C1 | O7 | H6 | 2.0° | 90.3° |
| C17 | C18 | C19 | H10 | 180.0° | 179.1° |
| C18 | C17 | C16 | H9 | 180.0° | 179.4° |
| C17 | C18 | C19 | C14 | 1.9° | 0.6° |
| C18 | C17 | C16 | C15 | 0.3° | 0.6° |
| C18 | C17 | C16 | H2 | 179.7° | 179.5° |
| C17 | C18 | C19 | H3 | 178.2° | 179.5° |
| C19 | C18 | C17 | C16 | 1.2° | 0.9° |
| C18 | C19 | C14 | H3 | 180.0° | 179.9° |
| C18 | C19 | C14 | C15 | 1.0° | 0.0° |
| C18 | C19 | C14 | N13 | 178.3° | 179.7° |
| C19 | C18 | C17 | H9 | 178.8° | 179.7° |
| C2 | C3 | O8 | C4 | 177.2° | 180.0° |
| C2 | C3 | C4 | C5 | 2.2° | 0.0° |
| C2 | C3 | C4 | C9 | 175.3° | 180.0° |
| C2 | C3 | O8 | H7 | 180.0° | 90.0° |
| C6 | C5 | C4 | C3 | 2.4° | 0.0° |
| C6 | C5 | C4 | H4 | 180.0° | 180.0° |
| C6 | C5 | C4 | C9 | 175.7° | 180.0° |
| C17 | C16 | C15 | H2 | 180.0° | 180.0° |
| C17 | C16 | C15 | C14 | 1.1° | 0.0° |
| C17 | C16 | C15 | F21 | 177.3° | 179.9° |
| C16 | C17 | C18 | H10 | 178.8° | 180.0° |
| C19 | C14 | C15 | C16 | 0.4° | 0.3° |
| C19 | C14 | C15 | N13 | 177.5° | 179.7° |
| C19 | C14 | C15 | F21 | 178.0° | 179.8° |
| C19 | C14 | N13 | C9 | 63.7° | 89.7° |
| C19 | C14 | N13 | C12 | 114.4° | 90.3° |
| C14 | C19 | C18 | H10 | 178.1° | 179.7° |
| O8 | C3 | C4 | C5 | 179.4° | 180.0° |
| O8 | C3 | C4 | C9 | 7.6° | 0.0° |
| O8 | C3 | C2 | H1 | 1.1° | 0.0° |
| C3 | C4 | C5 | C9 | 173.4° | 180.0° |
| C3 | C4 | C9 | N13 | 122.5° | 174.2° |
| C3 | C4 | C9 | N10 | 51.7° | 5.5° |
| C4 | C3 | C2 | H1 | 178.2° | 179.9° |
| C3 | C4 | C5 | H4 | 177.6° | 180.0° |
| C4 | C3 | O8 | H7 | 2.8° | 90.0° |
| C5 | C4 | C9 | N13 | 50.7° | 5.8° |
| C5 | C4 | C9 | N10 | 135.1° | 174.5° |
| C4 | C5 | C6 | H5 | 177.9° | 180.0° |
| C16 | C15 | C14 | F21 | 178.4° | 179.9° |
| C16 | C15 | C14 | N13 | 177.1° | 180.0° |
| C15 | C16 | C17 | H9 | 179.7° | 180.0° |
| C4 | C9 | N13 | C14 | 2.0° | 0.3° |
| C4 | C9 | N13 | N10 | 174.9° | 179.8° |
| C4 | C9 | N13 | C12 | 176.3° | 179.8° |
| C4 | C9 | N10 | N11 | 177.6° | 179.8° |
| C9 | C4 | C5 | H4 | 4.3° | 0.0° |
| C15 | C14 | N13 | C9 | 113.7° | 90.0° |
| C15 | C14 | N13 | C12 | 68.2° | 90.0° |
| C14 | C15 | C16 | H2 | 178.9° | 180.0° |
| C15 | C14 | C19 | H3 | 179.0° | 179.9° |
| N13 | C14 | C15 | F21 | 4.6° | 0.1° |
| C14 | N13 | C9 | C12 | 178.3° | 180.0° |
| C14 | N13 | C9 | N10 | 176.9° | 180.0° |
| C14 | N13 | C12 | O20 | 2.4° | 0.0° |
| C14 | N13 | C12 | N11 | 178.8° | 180.0° |
| N13 | C14 | C19 | H3 | 1.7° | 0.2° |
| F21 | C15 | C16 | H2 | 2.7° | 0.0° |
| N13 | C9 | N10 | N11 | 2.5° | 0.0° |
| C9 | N13 | C12 | O20 | 179.2° | 180.0° |
| C9 | N13 | C12 | N11 | 0.4° | 0.0° |
| N10 | C9 | N13 | C12 | 1.4° | 0.0° |
| C9 | N10 | N11 | C12 | 2.9° | 0.0° |
| C9 | N10 | N11 | H8 | 177.1° | 180.0° |
| N13 | C12 | N11 | N10 | 2.0° | 0.0° |
| N13 | C12 | O20 | N11 | 178.6° | 180.0° |
| N13 | C12 | N11 | H8 | 178.0° | 180.0° |
| N10 | N11 | C12 | O20 | 179.2° | 180.0° |
| N10 | N11 | C12 | H8 | 180.0° | 180.0° |
| O20 | C12 | N11 | H8 | 0.8° | 0.0° |
| H2 | C16 | C17 | H9 | 0.3° | 0.0° |
| H3 | C19 | C18 | H10 | 1.9° | 0.4° |
| H4 | C5 | C6 | H5 | 2.1° | 0.1° |
| H9 | C17 | C18 | H10 | 1.2° | 0.6° |
