7FC
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O01 | C14 | doub | 1.21Å | 1.29Å | |
| O04 | C19 | sing | 1.36Å | 1.38Å | |
| C08 | C10 | doub | 1.38Å | 1.37Å | Aromatic |
| C08 | C16 | sing | 1.40Å | 1.36Å | Aromatic |
| C14 | C16 | sing | 1.48Å | 1.48Å | |
| C14 | O03 | sing | 1.35Å | 1.26Å | |
| C10 | C18 | sing | 1.40Å | 1.39Å | Aromatic |
| C16 | C07 | doub | 1.40Å | 1.42Å | Aromatic |
| O02 | C21 | doub | 1.22Å | 1.35Å | |
| C19 | C21 | sing | 1.42Å | 1.42Å | |
| C19 | C20 | doub | 1.36Å | 1.38Å | |
| C18 | C20 | sing | 1.47Å | 1.47Å | |
| C18 | C09 | doub | 1.40Å | 1.38Å | Aromatic |
| C21 | C22 | sing | 1.47Å | 1.45Å | |
| C07 | C09 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | O13 | sing | 1.34Å | 1.36Å | |
| C22 | C12 | sing | 1.40Å | 1.42Å | Aromatic |
| C22 | C23 | doub | 1.40Å | 1.32Å | Aromatic |
| O13 | C23 | sing | 1.35Å | 1.34Å | |
| C12 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C17 | sing | 1.39Å | 1.40Å | Aromatic |
| C15 | C11 | sing | 1.39Å | 1.36Å | Aromatic |
| C15 | CL5 | sing | 1.74Å | 1.71Å | |
| C17 | C11 | doub | 1.38Å | 1.37Å | Aromatic |
| C17 | CL6 | sing | 1.74Å | 1.69Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| O03 | H3 | sing | 0.97Å | 0.95Å | |
| O04 | H4 | sing | 0.97Å | 0.95Å | |
| C07 | H5 | sing | 1.08Å | 1.08Å | |
| C08 | H6 | sing | 1.08Å | 1.08Å | |
| C09 | H7 | sing | 1.08Å | 1.08Å | |
| C11 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C14 | C16 | 117.4° | 120.0° |
| O01 | C14 | O03 | 123.2° | 120.0° |
| O04 | C19 | C21 | 116.1° | 120.3° |
| O04 | C19 | C20 | 125.3° | 120.3° |
| C19 | O04 | H4 | 109.5° | 114.0° |
| C10 | C08 | C16 | 119.9° | 120.0° |
| C08 | C10 | C18 | 119.8° | 120.0° |
| C08 | C10 | H1 | 120.1° | 120.0° |
| C10 | C08 | H6 | 120.0° | 120.0° |
| C08 | C16 | C14 | 119.0° | 120.0° |
| C08 | C16 | C07 | 121.6° | 120.0° |
| C16 | C08 | H6 | 120.1° | 120.0° |
| C16 | C14 | O03 | 119.2° | 120.0° |
| C14 | C16 | C07 | 119.4° | 120.0° |
| C14 | O03 | H3 | 109.5° | 117.0° |
| C10 | C18 | C20 | 119.5° | 120.1° |
| C10 | C18 | C09 | 120.9° | 120.0° |
| C18 | C10 | H1 | 120.1° | 120.0° |
| C16 | C07 | C09 | 117.9° | 120.0° |
| C16 | C07 | H5 | 121.0° | 120.0° |
| O02 | C21 | C19 | 120.8° | 121.3° |
| O02 | C21 | C22 | 121.0° | 121.4° |
| C21 | C19 | C20 | 118.6° | 119.4° |
| C19 | C21 | C22 | 118.2° | 117.4° |
| C19 | C20 | C18 | 126.1° | 118.8° |
| C19 | C20 | O13 | 120.8° | 122.4° |
| C20 | C18 | C09 | 119.5° | 120.0° |
| C18 | C20 | O13 | 113.1° | 118.7° |
| C18 | C09 | C07 | 119.9° | 120.0° |
| C18 | C09 | H7 | 120.1° | 120.0° |
| C21 | C22 | C12 | 121.6° | 121.3° |
| C21 | C22 | C23 | 118.3° | 118.5° |
| C09 | C07 | H5 | 121.0° | 120.0° |
| C07 | C09 | H7 | 120.1° | 120.0° |
| C20 | O13 | C23 | 120.5° | 122.4° |
| C12 | C22 | C23 | 120.1° | 120.2° |
| C22 | C12 | C15 | 118.9° | 119.6° |
| C22 | C12 | H9 | 120.6° | 120.2° |
| C22 | C23 | O13 | 123.5° | 119.9° |
| C22 | C23 | C17 | 119.1° | 119.3° |
| O13 | C23 | C17 | 117.4° | 120.7° |
| C12 | C15 | C11 | 121.8° | 120.3° |
| C12 | C15 | CL5 | 118.0° | 119.9° |
| C15 | C12 | H9 | 120.6° | 120.2° |
| C23 | C17 | C11 | 123.0° | 119.9° |
| C23 | C17 | CL6 | 116.2° | 120.0° |
| C11 | C15 | CL5 | 120.1° | 119.9° |
| C15 | C11 | C17 | 117.1° | 120.7° |
| C15 | C11 | H8 | 121.5° | 119.6° |
| C11 | C17 | CL6 | 120.8° | 120.0° |
| C17 | C11 | H8 | 121.4° | 119.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C14 | C16 | C08 | 14.8° | 0.1° |
| O01 | C14 | C16 | O03 | 173.9° | 180.0° |
| O01 | C14 | C16 | C07 | 164.1° | 180.0° |
| O01 | C14 | O03 | H3 | 0.0° | 0.0° |
| O04 | C19 | C21 | O02 | 0.7° | 0.1° |
| O04 | C19 | C21 | C20 | 177.0° | 178.9° |
| O04 | C19 | C20 | C18 | 3.1° | 0.5° |
| O04 | C19 | C21 | C22 | 178.7° | 180.0° |
| O04 | C19 | C20 | O13 | 178.2° | 180.0° |
| C10 | C08 | C16 | H6 | 180.0° | 180.0° |
| C10 | C08 | C16 | C14 | 178.4° | 180.0° |
| C08 | C10 | C18 | H1 | 180.0° | 179.7° |
| C10 | C08 | C16 | C07 | 0.5° | 0.0° |
| C08 | C10 | C18 | C20 | 178.0° | 179.7° |
| C08 | C10 | C18 | C09 | 1.8° | 0.3° |
| C08 | C16 | C14 | C07 | 178.9° | 180.0° |
| C08 | C16 | C14 | O03 | 171.3° | 180.0° |
| C16 | C08 | C10 | C18 | 1.1° | 0.0° |
| C08 | C16 | C07 | C09 | 1.5° | 0.3° |
| C16 | C08 | C10 | H1 | 178.9° | 179.7° |
| C08 | C16 | C07 | H5 | 178.5° | 179.7° |
| C14 | C16 | C07 | C09 | 177.3° | 179.7° |
| C16 | C14 | O03 | H3 | 173.5° | 180.0° |
| C14 | C16 | C07 | H5 | 2.7° | 0.3° |
| C14 | C16 | C08 | H6 | 1.6° | 0.0° |
| O03 | C14 | C16 | C07 | 9.8° | 0.0° |
| C10 | C18 | C20 | C19 | 16.3° | 132.5° |
| C10 | C18 | C20 | C09 | 179.8° | 179.9° |
| C10 | C18 | C09 | C07 | 0.8° | 0.6° |
| C10 | C18 | C20 | O13 | 162.4° | 48.0° |
| C18 | C10 | C08 | H6 | 178.9° | 180.0° |
| C10 | C18 | C09 | H7 | 179.2° | 179.5° |
| C16 | C07 | C09 | C18 | 0.9° | 0.6° |
| C16 | C07 | C09 | H5 | 180.0° | 179.4° |
| C07 | C16 | C08 | H6 | 179.5° | 180.0° |
| C16 | C07 | C09 | H7 | 179.1° | 179.5° |
| O02 | C21 | C19 | C22 | 179.3° | 179.9° |
| O02 | C21 | C19 | C20 | 177.7° | 179.0° |
| O02 | C21 | C22 | C12 | 0.1° | 0.0° |
| O02 | C21 | C22 | C23 | 178.4° | 179.5° |
| C21 | C19 | C20 | C18 | 179.8° | 179.5° |
| C21 | C19 | C20 | O13 | 1.5° | 1.1° |
| C19 | C21 | C22 | C12 | 179.2° | 180.0° |
| C19 | C21 | C22 | C23 | 0.9° | 0.6° |
| C21 | C19 | O04 | H4 | 0.3° | 0.1° |
| C19 | C20 | C18 | O13 | 178.7° | 179.5° |
| C19 | C20 | C18 | C09 | 163.9° | 47.4° |
| C20 | C19 | C21 | C22 | 1.7° | 1.0° |
| C19 | C20 | O13 | C23 | 0.6° | 0.6° |
| C20 | C19 | O04 | H4 | 177.1° | 179.0° |
| C20 | C18 | C09 | C07 | 179.0° | 179.4° |
| C18 | C20 | O13 | C23 | 179.4° | 180.0° |
| C20 | C18 | C10 | H1 | 2.0° | 0.1° |
| C20 | C18 | C09 | H7 | 1.0° | 0.5° |
| C18 | C09 | C07 | H7 | 180.0° | 179.9° |
| C09 | C18 | C20 | O13 | 17.4° | 132.1° |
| C09 | C18 | C10 | H1 | 178.2° | 180.0° |
| C18 | C09 | C07 | H5 | 179.1° | 180.0° |
| C21 | C22 | C12 | C23 | 178.3° | 179.4° |
| C21 | C22 | C23 | O13 | 0.1° | 0.1° |
| C21 | C22 | C12 | C15 | 179.4° | 180.0° |
| C21 | C22 | C23 | C17 | 179.5° | 179.7° |
| C21 | C22 | C12 | H9 | 0.6° | 0.1° |
| C20 | O13 | C23 | C22 | 0.3° | 0.1° |
| C20 | O13 | C23 | C17 | 179.7° | 179.7° |
| C12 | C22 | C23 | O13 | 178.3° | 179.5° |
| C22 | C12 | C15 | H9 | 180.0° | 179.9° |
| C12 | C22 | C23 | C17 | 1.1° | 0.8° |
| C22 | C12 | C15 | C11 | 0.9° | 0.1° |
| C22 | C12 | C15 | CL5 | 177.1° | 179.7° |
| C22 | C23 | O13 | C17 | 179.4° | 179.6° |
| C23 | C22 | C12 | C15 | 1.1° | 0.6° |
| C22 | C23 | C17 | C11 | 0.9° | 0.5° |
| C22 | C23 | C17 | CL6 | 179.7° | 179.5° |
| C23 | C22 | C12 | H9 | 178.9° | 179.5° |
| O13 | C23 | C17 | C11 | 178.5° | 179.8° |
| O13 | C23 | C17 | CL6 | 0.9° | 0.2° |
| C12 | C15 | C11 | CL5 | 177.9° | 179.7° |
| C12 | C15 | C11 | C17 | 0.7° | 0.2° |
| C12 | C15 | C11 | H8 | 179.3° | 179.7° |
| C23 | C17 | C11 | C15 | 0.7° | 0.0° |
| C23 | C17 | C11 | CL6 | 179.4° | 180.0° |
| C23 | C17 | C11 | H8 | 179.3° | 180.0° |
| C15 | C11 | C17 | H8 | 180.0° | 180.0° |
| C15 | C11 | C17 | CL6 | 179.9° | 180.0° |
| C11 | C15 | C12 | H9 | 179.1° | 180.0° |
| CL5 | C15 | C11 | C17 | 177.3° | 180.0° |
| CL5 | C15 | C11 | H8 | 2.8° | 0.0° |
| CL5 | C15 | C12 | H9 | 2.9° | 0.2° |
| CL6 | C17 | C11 | H8 | 0.1° | 0.0° |
| H1 | C10 | C08 | H6 | 1.1° | 0.3° |
| H5 | C07 | C09 | H7 | 0.9° | 0.1° |
