A7F
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O01 | C16 | doub | 1.21Å | 1.20Å | |
| O02 | C17 | doub | 1.22Å | 1.16Å | |
| N03 | C08 | sing | 1.38Å | 1.37Å | Aromatic |
| N03 | C15 | sing | 1.38Å | 1.38Å | Aromatic |
| N04 | C09 | sing | 1.38Å | 1.38Å | Aromatic |
| N04 | C14 | sing | 1.38Å | 1.37Å | Aromatic |
| N05 | C16 | sing | 1.34Å | 1.46Å | |
| N05 | C17 | sing | 1.35Å | 1.45Å | |
| C06 | C08 | doub | 1.40Å | 1.41Å | Aromatic |
| C06 | C10 | sing | 1.40Å | 1.52Å | Aromatic |
| C06 | C12 | sing | 1.47Å | 1.36Å | Aromatic |
| C07 | C09 | doub | 1.40Å | 1.40Å | Aromatic |
| C07 | C11 | sing | 1.40Å | 1.51Å | Aromatic |
| C07 | C13 | sing | 1.47Å | 1.38Å | Aromatic |
| C08 | C09 | sing | 1.40Å | 1.48Å | Aromatic |
| C10 | C11 | doub | 1.41Å | 1.40Å | Aromatic |
| C10 | C16 | sing | 1.47Å | 1.54Å | |
| C11 | C17 | sing | 1.47Å | 1.52Å | |
| C12 | C15 | doub | 1.40Å | 1.41Å | Aromatic |
| C12 | C18 | sing | 1.39Å | 1.55Å | Aromatic |
| C13 | C14 | doub | 1.40Å | 1.41Å | Aromatic |
| C13 | C19 | sing | 1.39Å | 1.57Å | Aromatic |
| C14 | C21 | sing | 1.39Å | 1.54Å | Aromatic |
| C15 | C20 | sing | 1.39Å | 1.54Å | Aromatic |
| C18 | C22 | doub | 1.38Å | 1.49Å | Aromatic |
| C19 | C23 | doub | 1.38Å | 1.51Å | Aromatic |
| C20 | C25 | doub | 1.38Å | 1.48Å | Aromatic |
| C21 | C24 | doub | 1.38Å | 1.50Å | Aromatic |
| C22 | C25 | sing | 1.39Å | 1.49Å | Aromatic |
| C23 | C24 | sing | 1.39Å | 1.50Å | Aromatic |
| C18 | H2 | sing | 1.08Å | 1.08Å | |
| C19 | H3 | sing | 1.08Å | 1.08Å | |
| C20 | H201 | sing | 1.08Å | 1.08Å | |
| C21 | H211 | sing | 1.08Å | 1.08Å | |
| C22 | H221 | sing | 1.08Å | 1.08Å | |
| C23 | H231 | sing | 1.08Å | 1.08Å | |
| C24 | H241 | sing | 1.08Å | 1.08Å | |
| C25 | H251 | sing | 1.08Å | 1.08Å | |
| N03 | H031 | sing | 0.97Å | 1.00Å | |
| N04 | H041 | sing | 0.97Å | 1.00Å | |
| N05 | H051 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C16 | N05 | 127.9° | 125.7° |
| O01 | C16 | C10 | 125.3° | 125.7° |
| O02 | C17 | N05 | 128.1° | 125.7° |
| O02 | C17 | C11 | 124.2° | 125.7° |
| C08 | N03 | C15 | 105.4° | 110.3° |
| N03 | C08 | C06 | 110.7° | 108.4° |
| N03 | C08 | C09 | 130.0° | 131.6° |
| C08 | N03 | H031 | 127.3° | 124.8° |
| N03 | C15 | C12 | 109.3° | 108.3° |
| N03 | C15 | C20 | 130.3° | 132.4° |
| C15 | N03 | H031 | 127.3° | 124.9° |
| C09 | N04 | C14 | 106.3° | 110.4° |
| N04 | C09 | C07 | 109.8° | 108.4° |
| N04 | C09 | C08 | 128.3° | 131.8° |
| C09 | N04 | H041 | 126.8° | 124.8° |
| N04 | C14 | C13 | 109.7° | 108.3° |
| N04 | C14 | C21 | 130.2° | 132.4° |
| C14 | N04 | H041 | 126.9° | 124.9° |
| C16 | N05 | C17 | 108.5° | 110.9° |
| N05 | C16 | C10 | 106.7° | 108.6° |
| C16 | N05 | H051 | 125.8° | 124.5° |
| N05 | C17 | C11 | 107.7° | 108.6° |
| C17 | N05 | H051 | 125.7° | 124.6° |
| C08 | C06 | C10 | 119.8° | 120.3° |
| C08 | C06 | C12 | 106.5° | 106.4° |
| C06 | C08 | C09 | 119.3° | 119.9° |
| C10 | C06 | C12 | 133.7° | 133.3° |
| C06 | C10 | C11 | 119.9° | 119.8° |
| C06 | C10 | C16 | 131.6° | 134.2° |
| C06 | C12 | C15 | 108.1° | 106.5° |
| C06 | C12 | C18 | 131.0° | 133.5° |
| C09 | C07 | C11 | 119.0° | 120.3° |
| C09 | C07 | C13 | 107.2° | 106.4° |
| C07 | C09 | C08 | 122.0° | 119.8° |
| C11 | C07 | C13 | 133.8° | 133.3° |
| C07 | C11 | C10 | 119.9° | 119.8° |
| C07 | C11 | C17 | 131.4° | 134.2° |
| C07 | C13 | C14 | 107.1° | 106.5° |
| C07 | C13 | C19 | 133.2° | 133.4° |
| C11 | C10 | C16 | 108.4° | 106.0° |
| C10 | C11 | C17 | 108.6° | 106.0° |
| C15 | C12 | C18 | 120.8° | 120.0° |
| C12 | C15 | C20 | 120.4° | 119.3° |
| C12 | C18 | C22 | 118.4° | 119.8° |
| C12 | C18 | H2 | 120.8° | 120.1° |
| C14 | C13 | C19 | 119.7° | 120.0° |
| C13 | C14 | C21 | 120.1° | 119.3° |
| C13 | C19 | C23 | 120.4° | 119.8° |
| C13 | C19 | H3 | 119.8° | 120.1° |
| C14 | C21 | C24 | 122.0° | 120.1° |
| C14 | C21 | H211 | 119.0° | 119.9° |
| C15 | C20 | C25 | 119.8° | 120.1° |
| C15 | C20 | H201 | 120.1° | 119.9° |
| C18 | C22 | C25 | 121.0° | 120.3° |
| C22 | C18 | H2 | 120.8° | 120.2° |
| C18 | C22 | H221 | 119.5° | 119.8° |
| C19 | C23 | C24 | 119.5° | 120.3° |
| C23 | C19 | H3 | 119.8° | 120.1° |
| C19 | C23 | H231 | 120.2° | 119.9° |
| C20 | C25 | C22 | 119.4° | 120.6° |
| C25 | C20 | H201 | 120.1° | 120.0° |
| C20 | C25 | H251 | 120.3° | 119.7° |
| C21 | C24 | C23 | 118.3° | 120.6° |
| C24 | C21 | H211 | 119.0° | 120.0° |
| C21 | C24 | H241 | 120.8° | 119.7° |
| C25 | C22 | H221 | 119.5° | 119.9° |
| C22 | C25 | H251 | 120.3° | 119.7° |
| C24 | C23 | H231 | 120.3° | 119.9° |
| C23 | C24 | H241 | 120.9° | 119.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C16 | N05 | C10 | 178.4° | 179.9° |
| O01 | C16 | N05 | C17 | 176.4° | 180.0° |
| O01 | C16 | C10 | C06 | 2.2° | 0.1° |
| O01 | C16 | C10 | C11 | 176.8° | 180.0° |
| O01 | C16 | N05 | H051 | 3.6° | 0.1° |
| O02 | C17 | N05 | C16 | 178.2° | 179.8° |
| O02 | C17 | N05 | C11 | 179.8° | 179.9° |
| O02 | C17 | C11 | C07 | 0.9° | 0.1° |
| O02 | C17 | C11 | C10 | 179.3° | 179.9° |
| O02 | C17 | N05 | H051 | 1.8° | 0.1° |
| C08 | N03 | C15 | H031 | 180.0° | 179.6° |
| N03 | C08 | C09 | N04 | 0.6° | 0.0° |
| N03 | C08 | C06 | C09 | 179.9° | 180.0° |
| N03 | C08 | C06 | C10 | 179.2° | 180.0° |
| N03 | C08 | C06 | C12 | 0.2° | 0.2° |
| N03 | C08 | C09 | C07 | 179.2° | 180.0° |
| C08 | N03 | C15 | C12 | 1.9° | 0.4° |
| C08 | N03 | C15 | C20 | 179.6° | 179.9° |
| C15 | N03 | C08 | C06 | 1.0° | 0.4° |
| N03 | C15 | C12 | C06 | 2.1° | 0.2° |
| C15 | N03 | C08 | C09 | 178.9° | 179.6° |
| N03 | C15 | C12 | C20 | 178.0° | 179.8° |
| N03 | C15 | C12 | C18 | 179.7° | 179.8° |
| N03 | C15 | C20 | C25 | 178.9° | 179.7° |
| N03 | C15 | C20 | H201 | 1.1° | 0.3° |
| C09 | N04 | C14 | H041 | 180.0° | 180.0° |
| N04 | C09 | C08 | C06 | 179.3° | 180.0° |
| N04 | C09 | C07 | C08 | 179.9° | 179.9° |
| N04 | C09 | C07 | C11 | 179.6° | 180.0° |
| N04 | C09 | C07 | C13 | 0.2° | 0.1° |
| C09 | N04 | C14 | C13 | 0.0° | 0.0° |
| C09 | N04 | C14 | C21 | 179.3° | 180.0° |
| C14 | N04 | C09 | C07 | 0.2° | 0.0° |
| N04 | C14 | C13 | C07 | 0.1° | 0.0° |
| C14 | N04 | C09 | C08 | 179.7° | 180.0° |
| N04 | C14 | C13 | C21 | 179.4° | 180.0° |
| N04 | C14 | C13 | C19 | 179.8° | 180.0° |
| N04 | C14 | C21 | C24 | 179.3° | 179.9° |
| N04 | C14 | C21 | H211 | 0.7° | 0.0° |
| C16 | N05 | C17 | H051 | 180.0° | 180.0° |
| N05 | C16 | C10 | C06 | 179.3° | 180.0° |
| N05 | C16 | C10 | C11 | 1.7° | 0.1° |
| C16 | N05 | C17 | C11 | 1.6° | 0.0° |
| N05 | C17 | C11 | C07 | 179.2° | 179.9° |
| N05 | C17 | C11 | C10 | 0.5° | 0.0° |
| C17 | N05 | C16 | C10 | 2.0° | 0.0° |
| C08 | C06 | C10 | C12 | 178.6° | 179.7° |
| C06 | C08 | C09 | C07 | 0.8° | 0.0° |
| C08 | C06 | C10 | C11 | 0.7° | 0.0° |
| C08 | C06 | C10 | C16 | 179.5° | 180.0° |
| C08 | C06 | C12 | C15 | 1.4° | 0.0° |
| C08 | C06 | C12 | C18 | 178.7° | 180.0° |
| C06 | C08 | N03 | H031 | 179.0° | 180.0° |
| C06 | C10 | C11 | C07 | 0.4° | 0.0° |
| C10 | C06 | C08 | C09 | 0.9° | 0.0° |
| C06 | C10 | C11 | C16 | 179.1° | 180.0° |
| C06 | C10 | C11 | C17 | 179.8° | 180.0° |
| C10 | C06 | C12 | C15 | 179.8° | 179.7° |
| C10 | C06 | C12 | C18 | 2.6° | 0.3° |
| C12 | C06 | C08 | C09 | 179.8° | 179.8° |
| C12 | C06 | C10 | C11 | 179.3° | 179.7° |
| C12 | C06 | C10 | C16 | 1.9° | 0.3° |
| C06 | C12 | C15 | C18 | 177.6° | 180.0° |
| C06 | C12 | C15 | C20 | 179.9° | 180.0° |
| C06 | C12 | C18 | C22 | 179.4° | 180.0° |
| C06 | C12 | C18 | H2 | 0.6° | 0.0° |
| C09 | C07 | C11 | C13 | 179.8° | 179.9° |
| C09 | C07 | C11 | C10 | 0.3° | 0.1° |
| C09 | C07 | C11 | C17 | 179.9° | 180.0° |
| C09 | C07 | C13 | C14 | 0.2° | 0.0° |
| C09 | C07 | C13 | C19 | 179.9° | 180.0° |
| C07 | C09 | N04 | H041 | 179.8° | 180.0° |
| C11 | C07 | C09 | C08 | 0.5° | 0.1° |
| C07 | C11 | C10 | C17 | 179.8° | 180.0° |
| C07 | C11 | C10 | C16 | 179.5° | 179.9° |
| C11 | C07 | C13 | C14 | 179.6° | 179.9° |
| C11 | C07 | C13 | C19 | 0.1° | 0.1° |
| C13 | C07 | C09 | C08 | 179.6° | 180.0° |
| C13 | C07 | C11 | C10 | 179.9° | 180.0° |
| C13 | C07 | C11 | C17 | 0.2° | 0.1° |
| C07 | C13 | C14 | C19 | 179.7° | 179.9° |
| C07 | C13 | C14 | C21 | 179.5° | 180.0° |
| C07 | C13 | C19 | C23 | 179.5° | 180.0° |
| C07 | C13 | C19 | H3 | 0.5° | 0.1° |
| C09 | C08 | N03 | H031 | 1.1° | 0.0° |
| C08 | C09 | N04 | H041 | 0.3° | 0.0° |
| C16 | C10 | C11 | C17 | 0.7° | 0.0° |
| C10 | C16 | N05 | H051 | 177.9° | 180.0° |
| C11 | C17 | N05 | H051 | 178.4° | 180.0° |
| C15 | C12 | C18 | C22 | 2.4° | 0.0° |
| C12 | C15 | C20 | C25 | 1.4° | 0.0° |
| C15 | C12 | C18 | H2 | 177.6° | 180.0° |
| C12 | C15 | C20 | H201 | 178.6° | 180.0° |
| C12 | C15 | N03 | H031 | 178.1° | 180.0° |
| C18 | C12 | C15 | C20 | 2.3° | 0.0° |
| C12 | C18 | C22 | H2 | 180.0° | 180.0° |
| C12 | C18 | C22 | C25 | 1.5° | 0.0° |
| C12 | C18 | C22 | H221 | 178.5° | 180.0° |
| C14 | C13 | C19 | C23 | 0.9° | 0.0° |
| C13 | C14 | C21 | C24 | 0.1° | 0.1° |
| C14 | C13 | C19 | H3 | 179.1° | 180.0° |
| C13 | C14 | C21 | H211 | 179.9° | 180.0° |
| C13 | C14 | N04 | H041 | 180.0° | 180.0° |
| C19 | C13 | C14 | C21 | 0.8° | 0.0° |
| C13 | C19 | C23 | H3 | 180.0° | 179.9° |
| C13 | C19 | C23 | C24 | 0.3° | 0.1° |
| C13 | C19 | C23 | H231 | 179.7° | 179.9° |
| C14 | C21 | C24 | H211 | 180.0° | 179.9° |
| C14 | C21 | C24 | C23 | 0.6° | 0.1° |
| C14 | C21 | C24 | H241 | 179.4° | 180.0° |
| C21 | C14 | N04 | H041 | 0.7° | 0.0° |
| C15 | C20 | C25 | H201 | 180.0° | 179.9° |
| C15 | C20 | C25 | C22 | 0.5° | 0.1° |
| C15 | C20 | C25 | H251 | 179.5° | 180.0° |
| C20 | C15 | N03 | H031 | 0.4° | 0.3° |
| C18 | C22 | C25 | C20 | 0.7° | 0.1° |
| C18 | C22 | C25 | H221 | 180.0° | 179.9° |
| C18 | C22 | C25 | H251 | 179.3° | 180.0° |
| C19 | C23 | C24 | C21 | 0.4° | 0.1° |
| C19 | C23 | C24 | H231 | 180.0° | 180.0° |
| C19 | C23 | C24 | H241 | 179.6° | 180.0° |
| C20 | C25 | C22 | H251 | 180.0° | 179.9° |
| C20 | C25 | C22 | H221 | 179.3° | 180.0° |
| C21 | C24 | C23 | H241 | 180.0° | 179.9° |
| C21 | C24 | C23 | H231 | 179.6° | 179.9° |
| C25 | C22 | C18 | H2 | 178.5° | 180.0° |
| C22 | C25 | C20 | H201 | 179.5° | 180.0° |
| C24 | C23 | C19 | H3 | 179.7° | 180.0° |
| C23 | C24 | C21 | H211 | 179.4° | 180.0° |
| H2 | C18 | C22 | H221 | 1.5° | 0.0° |
| H3 | C19 | C23 | H231 | 0.3° | 0.0° |
| H201 | C20 | C25 | H251 | 0.6° | 0.0° |
| H211 | C21 | C24 | H241 | 0.6° | 0.1° |
| H221 | C22 | C25 | H251 | 0.7° | 0.0° |
| H231 | C23 | C24 | H241 | 0.4° | 0.0° |
