5F6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | C20 | doub | 1.36Å | 1.41Å | Aromatic |
| C19 | C18 | sing | 1.39Å | 1.42Å | Aromatic |
| C20 | C15 | sing | 1.41Å | 1.41Å | Aromatic |
| C18 | N17 | doub | 1.31Å | 1.37Å | Aromatic |
| C15 | C16 | doub | 1.40Å | 1.40Å | Aromatic |
| C15 | C14 | sing | 1.42Å | 1.42Å | Aromatic |
| C16 | C11 | sing | 1.39Å | 1.41Å | Aromatic |
| N17 | C14 | sing | 1.34Å | 1.37Å | Aromatic |
| C14 | C13 | doub | 1.41Å | 1.41Å | Aromatic |
| O10 | C9 | doub | 1.22Å | 1.23Å | |
| C11 | C9 | sing | 1.48Å | 1.51Å | |
| C11 | C12 | doub | 1.41Å | 1.41Å | Aromatic |
| C9 | C6 | sing | 1.48Å | 1.53Å | |
| C13 | C12 | sing | 1.36Å | 1.39Å | Aromatic |
| CL7 | C1 | sing | 1.74Å | 1.76Å | |
| C6 | C1 | doub | 1.40Å | 1.40Å | Aromatic |
| C6 | C5 | sing | 1.40Å | 1.40Å | Aromatic |
| CL8 | C5 | sing | 1.74Å | 1.74Å | |
| C1 | C2 | sing | 1.38Å | 1.41Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.42Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C3 | H2 | sing | 1.08Å | 1.08Å | |
| C12 | H3 | sing | 1.08Å | 1.08Å | |
| C13 | H4 | sing | 1.08Å | 1.08Å | |
| C16 | H5 | sing | 1.08Å | 1.08Å | |
| C18 | H6 | sing | 1.08Å | 1.08Å | |
| C19 | H7 | sing | 1.08Å | 1.08Å | |
| C20 | H8 | sing | 1.08Å | 1.08Å | |
| C4 | H9 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C19 | C18 | 119.8° | 119.9° |
| C19 | C20 | C15 | 119.0° | 118.2° |
| C20 | C19 | H7 | 120.1° | 120.1° |
| C19 | C20 | H8 | 120.5° | 120.9° |
| C19 | C18 | N17 | 120.4° | 121.7° |
| C19 | C18 | H6 | 119.8° | 119.1° |
| C18 | C19 | H7 | 120.1° | 120.0° |
| C20 | C15 | C16 | 121.7° | 121.3° |
| C20 | C15 | C14 | 119.2° | 119.0° |
| C15 | C20 | H8 | 120.5° | 120.9° |
| C18 | N17 | C14 | 120.9° | 121.4° |
| N17 | C18 | H6 | 119.8° | 119.1° |
| C16 | C15 | C14 | 119.1° | 119.8° |
| C15 | C16 | C11 | 120.6° | 119.4° |
| C15 | C16 | H5 | 119.7° | 120.3° |
| C15 | C14 | N17 | 120.6° | 119.8° |
| C15 | C14 | C13 | 119.8° | 119.4° |
| C16 | C11 | C9 | 119.0° | 119.8° |
| C16 | C11 | C12 | 119.7° | 120.3° |
| C11 | C16 | H5 | 119.7° | 120.3° |
| N17 | C14 | C13 | 119.5° | 120.8° |
| C14 | C13 | C12 | 120.5° | 120.2° |
| C14 | C13 | H4 | 119.8° | 120.0° |
| O10 | C9 | C11 | 118.4° | 120.0° |
| O10 | C9 | C6 | 121.9° | 120.0° |
| C9 | C11 | C12 | 119.9° | 119.8° |
| C11 | C9 | C6 | 119.5° | 120.0° |
| C11 | C12 | C13 | 119.9° | 120.9° |
| C11 | C12 | H3 | 120.1° | 119.5° |
| C9 | C6 | C1 | 122.6° | 120.2° |
| C9 | C6 | C5 | 119.5° | 120.1° |
| C13 | C12 | H3 | 120.1° | 119.6° |
| C12 | C13 | H4 | 119.7° | 119.9° |
| CL7 | C1 | C6 | 118.9° | 120.1° |
| CL7 | C1 | C2 | 121.1° | 120.1° |
| C1 | C6 | C5 | 117.6° | 119.6° |
| C6 | C1 | C2 | 120.0° | 119.9° |
| C6 | C5 | CL8 | 116.2° | 120.1° |
| C6 | C5 | C4 | 122.3° | 119.8° |
| CL8 | C5 | C4 | 121.4° | 120.1° |
| C1 | C2 | C3 | 122.2° | 120.2° |
| C1 | C2 | H1 | 118.9° | 119.9° |
| C5 | C4 | C3 | 119.8° | 120.2° |
| C5 | C4 | H9 | 120.1° | 119.9° |
| C2 | C3 | C4 | 118.1° | 120.4° |
| C3 | C2 | H1 | 118.9° | 119.9° |
| C2 | C3 | H2 | 121.0° | 119.8° |
| C4 | C3 | H2 | 121.0° | 119.8° |
| C3 | C4 | H9 | 120.1° | 119.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C19 | C18 | H7 | 180.0° | 179.5° |
| C19 | C20 | C15 | H8 | 180.0° | 180.0° |
| C20 | C19 | C18 | N17 | 4.7° | 0.3° |
| C19 | C20 | C15 | C16 | 178.3° | 179.9° |
| C19 | C20 | C15 | C14 | 0.7° | 0.5° |
| C20 | C19 | C18 | H6 | 175.3° | 179.7° |
| C18 | C19 | C20 | C15 | 3.0° | 0.5° |
| C19 | C18 | N17 | H6 | 180.0° | 180.0° |
| C19 | C18 | N17 | C14 | 3.8° | 0.0° |
| C18 | C19 | C20 | H8 | 176.9° | 179.5° |
| C20 | C15 | C16 | C14 | 179.0° | 179.5° |
| C20 | C15 | C16 | C11 | 177.2° | 180.0° |
| C20 | C15 | C14 | N17 | 0.2° | 0.3° |
| C20 | C15 | C14 | C13 | 177.6° | 179.8° |
| C20 | C15 | C16 | H5 | 2.8° | 0.5° |
| C15 | C20 | C19 | H7 | 176.9° | 180.0° |
| C18 | N17 | C14 | C15 | 1.4° | 0.0° |
| C18 | N17 | C14 | C13 | 176.1° | 180.0° |
| N17 | C18 | C19 | H7 | 175.3° | 179.8° |
| C15 | C16 | C11 | H5 | 180.0° | 179.5° |
| C16 | C15 | C14 | N17 | 179.2° | 179.8° |
| C16 | C15 | C14 | C13 | 3.3° | 0.2° |
| C15 | C16 | C11 | C9 | 173.3° | 179.8° |
| C15 | C16 | C11 | C12 | 6.4° | 0.6° |
| C16 | C15 | C20 | H8 | 1.7° | 0.1° |
| C14 | C15 | C16 | C11 | 1.8° | 0.5° |
| C15 | C14 | N17 | C13 | 177.5° | 180.0° |
| C15 | C14 | C13 | C12 | 3.9° | 0.0° |
| C15 | C14 | C13 | H4 | 176.1° | 179.9° |
| C14 | C15 | C16 | H5 | 178.2° | 180.0° |
| C14 | C15 | C20 | H8 | 179.3° | 179.5° |
| C16 | C11 | C9 | O10 | 8.4° | 5.5° |
| C16 | C11 | C9 | C12 | 166.8° | 179.6° |
| C16 | C11 | C9 | C6 | 176.9° | 174.6° |
| C16 | C11 | C12 | C13 | 5.9° | 0.4° |
| C16 | C11 | C12 | H3 | 174.1° | 179.7° |
| N17 | C14 | C13 | C12 | 178.6° | 180.0° |
| N17 | C14 | C13 | H4 | 1.4° | 0.1° |
| C14 | N17 | C18 | H6 | 176.2° | 180.0° |
| C14 | C13 | C12 | C11 | 0.8° | 0.1° |
| C14 | C13 | C12 | H4 | 180.0° | 179.9° |
| C14 | C13 | C12 | H3 | 179.3° | 180.0° |
| O10 | C9 | C11 | C6 | 174.7° | 179.9° |
| O10 | C9 | C11 | C12 | 158.4° | 174.8° |
| O10 | C9 | C6 | C1 | 98.5° | 85.1° |
| O10 | C9 | C6 | C5 | 88.1° | 94.8° |
| C9 | C11 | C12 | C13 | 172.6° | 180.0° |
| C11 | C9 | C6 | C1 | 87.0° | 94.7° |
| C11 | C9 | C6 | C5 | 86.4° | 85.3° |
| C9 | C11 | C12 | H3 | 7.4° | 0.1° |
| C9 | C11 | C16 | H5 | 6.7° | 0.3° |
| C12 | C11 | C9 | C6 | 16.3° | 5.1° |
| C11 | C12 | C13 | H3 | 180.0° | 179.9° |
| C11 | C12 | C13 | H4 | 179.3° | 180.0° |
| C12 | C11 | C16 | H5 | 173.6° | 179.9° |
| C9 | C6 | C1 | CL7 | 5.1° | 0.2° |
| C9 | C6 | C1 | C5 | 173.5° | 180.0° |
| C9 | C6 | C5 | CL8 | 7.4° | 0.1° |
| C9 | C6 | C1 | C2 | 176.0° | 180.0° |
| C9 | C6 | C5 | C4 | 176.4° | 180.0° |
| CL7 | C1 | C6 | C2 | 178.9° | 179.7° |
| CL7 | C1 | C6 | C5 | 178.6° | 179.7° |
| CL7 | C1 | C2 | C3 | 179.7° | 179.8° |
| CL7 | C1 | C2 | H1 | 0.2° | 0.3° |
| C1 | C6 | C5 | CL8 | 178.9° | 179.9° |
| C1 | C6 | C5 | C4 | 2.7° | 0.0° |
| C6 | C1 | C2 | C3 | 0.8° | 0.0° |
| C6 | C1 | C2 | H1 | 179.1° | 179.9° |
| C6 | C5 | CL8 | C4 | 176.2° | 179.9° |
| C5 | C6 | C1 | C2 | 2.5° | 0.0° |
| C6 | C5 | C4 | C3 | 1.2° | 0.0° |
| C6 | C5 | C4 | H9 | 178.8° | 179.9° |
| CL8 | C5 | C4 | C3 | 177.2° | 179.9° |
| CL8 | C5 | C4 | H9 | 2.8° | 0.0° |
| C1 | C2 | C3 | H1 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 0.7° | 0.0° |
| C1 | C2 | C3 | H2 | 179.3° | 180.0° |
| C5 | C4 | C3 | C2 | 0.5° | 0.0° |
| C5 | C4 | C3 | H9 | 180.0° | 180.0° |
| C5 | C4 | C3 | H2 | 179.5° | 180.0° |
| C2 | C3 | C4 | H2 | 180.0° | 180.0° |
| C2 | C3 | C4 | H9 | 179.5° | 180.0° |
| C4 | C3 | C2 | H1 | 179.3° | 179.9° |
| H1 | C2 | C3 | H2 | 0.7° | 0.1° |
| H2 | C3 | C4 | H9 | 0.5° | 0.0° |
| H3 | C12 | C13 | H4 | 0.7° | 0.1° |
| H6 | C18 | C19 | H7 | 4.7° | 0.2° |
| H7 | C19 | C20 | H8 | 3.1° | 0.0° |
