FO7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| BR1 | C3 | sing | 1.89Å | 1.91Å | |
| C3 | C2 | doub | 1.38Å | 1.35Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.38Å | Aromatic |
| C2 | C14 | sing | 1.51Å | 1.53Å | |
| C2 | C1 | sing | 1.38Å | 1.40Å | Aromatic |
| C14 | O4 | sing | 1.43Å | 1.41Å | |
| C4 | O3 | sing | 1.36Å | 1.37Å | |
| C4 | C5 | doub | 1.39Å | 1.35Å | Aromatic |
| O3 | C11 | sing | 1.36Å | 1.37Å | |
| C11 | C10 | doub | 1.39Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.37Å | Aromatic |
| C9 | CL1 | sing | 1.74Å | 1.76Å | |
| C9 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | F3 | sing | 1.35Å | 1.37Å | |
| C13 | C8 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.37Å | Aromatic |
| C6 | C1 | doub | 1.38Å | 1.38Å | Aromatic |
| C1 | S1 | sing | 1.76Å | 1.64Å | |
| S1 | O1 | doub | 1.42Å | 1.43Å | |
| S1 | O2 | doub | 1.42Å | 1.45Å | |
| S1 | C7 | sing | 1.81Å | 1.68Å | |
| C7 | F1 | sing | 1.40Å | 1.37Å | |
| C7 | F2 | sing | 1.40Å | 1.34Å | |
| C14 | H1 | sing | 1.09Å | 1.10Å | |
| C14 | H2 | sing | 1.09Å | 1.10Å | |
| O4 | H3 | sing | 0.97Å | 0.95Å | |
| C10 | H4 | sing | 1.08Å | 1.08Å | |
| C12 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| C5 | H7 | sing | 1.08Å | 1.08Å | |
| C6 | H8 | sing | 1.08Å | 1.08Å | |
| C7 | H11 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| BR1 | C3 | C2 | 120.7° | 120.0° |
| BR1 | C3 | C4 | 120.1° | 120.0° |
| C2 | C3 | C4 | 119.1° | 119.9° |
| C3 | C2 | C14 | 119.5° | 120.0° |
| C3 | C2 | C1 | 116.5° | 120.1° |
| C3 | C4 | O3 | 115.4° | 120.0° |
| C3 | C4 | C5 | 125.1° | 119.9° |
| C14 | C2 | C1 | 123.9° | 119.9° |
| C2 | C14 | O4 | 103.1° | 109.5° |
| C2 | C14 | H1 | 111.0° | 109.5° |
| C2 | C14 | H2 | 111.1° | 109.5° |
| C2 | C1 | C6 | 123.7° | 120.1° |
| C2 | C1 | S1 | 122.3° | 120.0° |
| O4 | C14 | H1 | 111.0° | 109.5° |
| O4 | C14 | H2 | 111.0° | 109.5° |
| C14 | O4 | H3 | 109.5° | 114.1° |
| O3 | C4 | C5 | 119.3° | 120.1° |
| C4 | O3 | C11 | 121.9° | 118.0° |
| C4 | C5 | C6 | 116.9° | 119.9° |
| C4 | C5 | H7 | 121.5° | 120.0° |
| O3 | C11 | C10 | 117.0° | 120.1° |
| O3 | C11 | C12 | 122.8° | 120.0° |
| C10 | C11 | C12 | 120.2° | 119.9° |
| C11 | C10 | C9 | 116.3° | 120.0° |
| C11 | C10 | H4 | 121.9° | 119.9° |
| C11 | C12 | C13 | 121.2° | 119.9° |
| C11 | C12 | H5 | 119.4° | 120.0° |
| C10 | C9 | CL1 | 114.1° | 120.0° |
| C10 | C9 | C8 | 125.8° | 120.1° |
| C9 | C10 | H4 | 121.9° | 120.1° |
| CL1 | C9 | C8 | 120.1° | 120.0° |
| C9 | C8 | C13 | 116.8° | 120.1° |
| C9 | C8 | H6 | 121.6° | 120.0° |
| C12 | C13 | F3 | 123.1° | 119.9° |
| C12 | C13 | C8 | 119.7° | 120.0° |
| C13 | C12 | H5 | 119.4° | 120.1° |
| F3 | C13 | C8 | 117.2° | 120.0° |
| C13 | C8 | H6 | 121.6° | 119.9° |
| C5 | C6 | C1 | 118.6° | 120.1° |
| C6 | C5 | H7 | 121.5° | 120.1° |
| C5 | C6 | H8 | 120.7° | 119.9° |
| C6 | C1 | S1 | 114.0° | 119.9° |
| C1 | C6 | H8 | 120.7° | 120.0° |
| C1 | S1 | O1 | 110.4° | 104.3° |
| C1 | S1 | O2 | 111.2° | 104.3° |
| C1 | S1 | C7 | 111.0° | 104.4° |
| O1 | S1 | O2 | 109.6° | 121.1° |
| O1 | S1 | C7 | 112.9° | 110.6° |
| O2 | S1 | C7 | 101.5° | 110.5° |
| S1 | C7 | F1 | 103.3° | 109.5° |
| S1 | C7 | F2 | 113.3° | 109.4° |
| S1 | C7 | H11 | 106.6° | 109.4° |
| F1 | C7 | F2 | 112.0° | 109.5° |
| F1 | C7 | H11 | 110.5° | 109.5° |
| F2 | C7 | H11 | 110.9° | 109.4° |
| H1 | C14 | H2 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| BR1 | C3 | C2 | C4 | 178.7° | 179.6° |
| BR1 | C3 | C2 | C14 | 1.4° | 0.0° |
| BR1 | C3 | C2 | C1 | 178.4° | 179.9° |
| BR1 | C3 | C4 | O3 | 6.4° | 0.2° |
| BR1 | C3 | C4 | C5 | 179.0° | 180.0° |
| C3 | C2 | C14 | C1 | 176.8° | 179.9° |
| C3 | C2 | C14 | O4 | 101.8° | 90.6° |
| C2 | C3 | C4 | O3 | 174.9° | 179.8° |
| C2 | C3 | C4 | C5 | 0.3° | 0.3° |
| C3 | C2 | C1 | C6 | 3.7° | 0.1° |
| C3 | C2 | C1 | S1 | 175.0° | 180.0° |
| C3 | C2 | C14 | H1 | 139.2° | 149.4° |
| C3 | C2 | C14 | H2 | 17.1° | 29.5° |
| C4 | C3 | C2 | C14 | 180.0° | 179.7° |
| C4 | C3 | C2 | C1 | 2.9° | 0.2° |
| C3 | C4 | O3 | C5 | 174.9° | 179.9° |
| C3 | C4 | O3 | C11 | 177.3° | 174.8° |
| C3 | C4 | C5 | C6 | 1.8° | 0.0° |
| C3 | C4 | C5 | H7 | 178.2° | 180.0° |
| C2 | C14 | O4 | H1 | 119.0° | 120.0° |
| C2 | C14 | O4 | H2 | 119.0° | 120.0° |
| C14 | C2 | C1 | C6 | 179.4° | 180.0° |
| C14 | C2 | C1 | S1 | 1.9° | 0.1° |
| C2 | C14 | H1 | H2 | 123.0° | 120.0° |
| C2 | C14 | O4 | H3 | 180.0° | 180.0° |
| C1 | C2 | C14 | O4 | 81.4° | 89.3° |
| C2 | C1 | C6 | C5 | 1.7° | 0.4° |
| C2 | C1 | C6 | S1 | 178.8° | 179.9° |
| C2 | C1 | S1 | O1 | 38.9° | 40.9° |
| C2 | C1 | S1 | O2 | 160.8° | 168.8° |
| C2 | C1 | S1 | C7 | 87.0° | 75.2° |
| C1 | C2 | C14 | H1 | 37.6° | 30.7° |
| C1 | C2 | C14 | H2 | 159.7° | 150.6° |
| C2 | C1 | C6 | H8 | 178.3° | 180.0° |
| O4 | C14 | H1 | H2 | 122.9° | 120.0° |
| C4 | O3 | C11 | C10 | 82.2° | 76.1° |
| C4 | O3 | C11 | C12 | 96.7° | 104.2° |
| O3 | C4 | C5 | C6 | 172.6° | 179.9° |
| O3 | C4 | C5 | H7 | 7.4° | 0.1° |
| C5 | C4 | O3 | C11 | 2.4° | 5.3° |
| C4 | C5 | C6 | H7 | 180.0° | 180.0° |
| C4 | C5 | C6 | C1 | 1.0° | 0.3° |
| C4 | C5 | C6 | H8 | 179.0° | 180.0° |
| O3 | C11 | C10 | C12 | 179.0° | 179.7° |
| O3 | C11 | C10 | C9 | 177.5° | 180.0° |
| O3 | C11 | C12 | C13 | 178.9° | 180.0° |
| O3 | C11 | C10 | H4 | 2.5° | 0.0° |
| O3 | C11 | C12 | H5 | 1.0° | 0.0° |
| C11 | C10 | C9 | H4 | 180.0° | 180.0° |
| C11 | C10 | C9 | CL1 | 178.9° | 180.0° |
| C11 | C10 | C9 | C8 | 2.2° | 0.0° |
| C10 | C11 | C12 | C13 | 2.1° | 0.3° |
| C10 | C11 | C12 | H5 | 177.9° | 179.7° |
| C12 | C11 | C10 | C9 | 3.5° | 0.3° |
| C11 | C12 | C13 | H5 | 180.0° | 180.0° |
| C11 | C12 | C13 | F3 | 178.7° | 180.0° |
| C11 | C12 | C13 | C8 | 0.9° | 0.0° |
| C12 | C11 | C10 | H4 | 176.5° | 179.7° |
| C10 | C9 | CL1 | C8 | 179.0° | 179.9° |
| C10 | C9 | C8 | C13 | 0.7° | 0.2° |
| C10 | C9 | C8 | H6 | 179.3° | 180.0° |
| CL1 | C9 | C8 | C13 | 178.2° | 179.7° |
| CL1 | C9 | C10 | H4 | 1.1° | 0.1° |
| CL1 | C9 | C8 | H6 | 1.8° | 0.1° |
| C9 | C8 | C13 | C12 | 2.2° | 0.2° |
| C9 | C8 | C13 | F3 | 179.8° | 179.7° |
| C9 | C8 | C13 | H6 | 180.0° | 179.8° |
| C8 | C9 | C10 | H4 | 177.8° | 180.0° |
| C12 | C13 | F3 | C8 | 177.9° | 180.0° |
| C12 | C13 | C8 | H6 | 177.8° | 180.0° |
| F3 | C13 | C12 | H5 | 1.2° | 0.0° |
| F3 | C13 | C8 | H6 | 0.2° | 0.1° |
| C8 | C13 | C12 | H5 | 179.1° | 180.0° |
| C5 | C6 | C1 | H8 | 180.0° | 179.7° |
| C5 | C6 | C1 | S1 | 177.1° | 179.8° |
| C6 | C1 | S1 | O1 | 139.9° | 139.2° |
| C6 | C1 | S1 | O2 | 18.1° | 11.3° |
| C6 | C1 | S1 | C7 | 94.2° | 104.7° |
| C1 | C6 | C5 | H7 | 179.0° | 179.7° |
| C1 | S1 | O1 | O2 | 122.8° | 116.7° |
| C1 | S1 | O1 | C7 | 124.9° | 111.7° |
| C1 | S1 | O2 | C7 | 118.1° | 111.7° |
| C1 | S1 | C7 | F1 | 81.1° | 54.8° |
| C1 | S1 | C7 | F2 | 40.2° | 65.3° |
| S1 | C1 | C6 | H8 | 2.9° | 0.1° |
| C1 | S1 | C7 | H11 | 162.4° | 174.8° |
| O1 | S1 | O2 | C7 | 119.5° | 131.6° |
| O1 | S1 | C7 | F1 | 154.4° | 166.4° |
| O1 | S1 | C7 | F2 | 84.3° | 46.4° |
| O1 | S1 | C7 | H11 | 37.9° | 73.6° |
| O2 | S1 | C7 | F1 | 37.2° | 56.8° |
| O2 | S1 | C7 | F2 | 158.5° | 176.9° |
| O2 | S1 | C7 | H11 | 79.3° | 63.2° |
| S1 | C7 | F1 | F2 | 122.2° | 120.0° |
| S1 | C7 | F1 | H11 | 113.7° | 120.0° |
| S1 | C7 | F2 | H11 | 119.8° | 119.9° |
| F1 | C7 | F2 | H11 | 123.9° | 120.0° |
| H1 | C14 | O4 | H3 | 61.0° | 60.0° |
| H2 | C14 | O4 | H3 | 61.0° | 60.0° |
| H7 | C5 | C6 | H8 | 1.1° | 0.0° |
