A1BM9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O2 | C1 | doub | 1.21Å | 1.26Å | |
| O1 | C1 | sing | 1.34Å | 1.26Å | |
| C1 | C2 | sing | 1.51Å | 1.52Å | |
| F29 | C16 | sing | 1.40Å | 1.36Å | |
| F4 | C3 | sing | 1.40Å | 1.36Å | |
| F2 | C2 | sing | 1.40Å | 1.36Å | |
| F27 | C15 | sing | 1.40Å | 1.37Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| C2 | F1 | sing | 1.40Å | 1.37Å | |
| C16 | F30 | sing | 1.40Å | 1.36Å | |
| C16 | F31 | sing | 1.40Å | 1.36Å | |
| C16 | C15 | sing | 1.53Å | 1.54Å | |
| F3 | C3 | sing | 1.40Å | 1.36Å | |
| C3 | C4 | sing | 1.53Å | 1.52Å | |
| C15 | F28 | sing | 1.40Å | 1.37Å | |
| C15 | C14 | sing | 1.53Å | 1.54Å | |
| F26 | C14 | sing | 1.40Å | 1.36Å | |
| F8 | C5 | sing | 1.40Å | 1.37Å | |
| F6 | C4 | sing | 1.40Å | 1.36Å | |
| C4 | C5 | sing | 1.53Å | 1.52Å | |
| C4 | F5 | sing | 1.40Å | 1.36Å | |
| C14 | F25 | sing | 1.40Å | 1.37Å | |
| C14 | C13 | sing | 1.53Å | 1.54Å | |
| F24 | C13 | sing | 1.40Å | 1.36Å | |
| C5 | F7 | sing | 1.40Å | 1.36Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| C13 | F23 | sing | 1.40Å | 1.37Å | |
| C13 | C12 | sing | 1.53Å | 1.53Å | |
| F22 | C12 | sing | 1.40Å | 1.36Å | |
| F10 | C6 | sing | 1.40Å | 1.37Å | |
| C6 | F9 | sing | 1.40Å | 1.37Å | |
| C6 | C7 | sing | 1.53Å | 1.53Å | |
| C12 | C11 | sing | 1.53Å | 1.52Å | |
| C12 | F21 | sing | 1.40Å | 1.35Å | |
| F20 | C11 | sing | 1.40Å | 1.36Å | |
| F11 | C7 | sing | 1.40Å | 1.36Å | |
| C11 | F19 | sing | 1.40Å | 1.36Å | |
| C11 | C10 | sing | 1.53Å | 1.54Å | |
| C7 | F12 | sing | 1.40Å | 1.36Å | |
| C7 | C8 | sing | 1.53Å | 1.53Å | |
| F14 | C8 | sing | 1.40Å | 1.36Å | |
| C8 | C9 | sing | 1.53Å | 1.53Å | |
| C8 | F13 | sing | 1.40Å | 1.36Å | |
| C10 | F18 | sing | 1.40Å | 1.36Å | |
| C10 | C9 | sing | 1.53Å | 1.54Å | |
| C10 | F17 | sing | 1.40Å | 1.36Å | |
| C9 | F15 | sing | 1.40Å | 1.37Å | |
| C9 | F16 | sing | 1.40Å | 1.36Å | |
| O1 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O2 | C1 | O1 | 120.3° | 120.0° |
| O2 | C1 | C2 | 119.3° | 120.0° |
| O1 | C1 | C2 | 120.4° | 120.0° |
| C1 | O1 | H1 | 109.5° | 117.0° |
| C1 | C2 | F2 | 110.2° | 109.5° |
| C1 | C2 | C3 | 108.5° | 109.5° |
| C1 | C2 | F1 | 109.2° | 109.5° |
| F29 | C16 | F30 | 108.2° | 109.5° |
| F29 | C16 | F31 | 109.0° | 109.5° |
| F29 | C16 | C15 | 109.5° | 109.5° |
| F4 | C3 | C2 | 109.6° | 109.5° |
| F4 | C3 | F3 | 109.8° | 109.5° |
| F4 | C3 | C4 | 109.8° | 109.5° |
| F2 | C2 | C3 | 109.4° | 109.4° |
| F2 | C2 | F1 | 110.1° | 109.5° |
| F27 | C15 | C16 | 108.5° | 109.5° |
| F27 | C15 | F28 | 107.4° | 109.5° |
| F27 | C15 | C14 | 107.6° | 109.5° |
| C3 | C2 | F1 | 109.4° | 109.5° |
| C2 | C3 | F3 | 109.1° | 109.5° |
| C2 | C3 | C4 | 109.3° | 109.4° |
| F30 | C16 | F31 | 108.9° | 109.4° |
| F30 | C16 | C15 | 112.1° | 109.5° |
| F31 | C16 | C15 | 109.0° | 109.4° |
| C16 | C15 | F28 | 108.7° | 109.5° |
| C16 | C15 | C14 | 115.2° | 109.5° |
| F3 | C3 | C4 | 109.3° | 109.5° |
| C3 | C4 | F6 | 109.5° | 109.5° |
| C3 | C4 | C5 | 108.6° | 109.4° |
| C3 | C4 | F5 | 109.9° | 109.5° |
| F28 | C15 | C14 | 109.1° | 109.4° |
| C15 | C14 | F26 | 108.6° | 109.5° |
| C15 | C14 | F25 | 107.2° | 109.4° |
| C15 | C14 | C13 | 117.6° | 109.4° |
| F26 | C14 | F25 | 107.4° | 109.5° |
| F26 | C14 | C13 | 107.6° | 109.5° |
| F8 | C5 | C4 | 110.1° | 109.5° |
| F8 | C5 | F7 | 109.6° | 109.5° |
| F8 | C5 | C6 | 109.3° | 109.5° |
| F6 | C4 | C5 | 110.6° | 109.4° |
| F6 | C4 | F5 | 108.9° | 109.5° |
| C5 | C4 | F5 | 109.4° | 109.5° |
| C4 | C5 | F7 | 108.6° | 109.5° |
| C4 | C5 | C6 | 108.5° | 109.5° |
| F25 | C14 | C13 | 108.0° | 109.5° |
| C14 | C13 | F24 | 111.9° | 109.4° |
| C14 | C13 | F23 | 106.4° | 109.5° |
| C14 | C13 | C12 | 114.1° | 109.4° |
| F24 | C13 | F23 | 107.0° | 109.5° |
| F24 | C13 | C12 | 109.8° | 109.4° |
| F7 | C5 | C6 | 110.8° | 109.5° |
| C5 | C6 | F10 | 109.1° | 109.5° |
| C5 | C6 | F9 | 108.9° | 109.5° |
| C5 | C6 | C7 | 111.2° | 109.5° |
| F23 | C13 | C12 | 107.2° | 109.5° |
| C13 | C12 | F22 | 112.8° | 109.5° |
| C13 | C12 | C11 | 108.1° | 109.5° |
| C13 | C12 | F21 | 107.3° | 109.4° |
| F22 | C12 | C11 | 108.4° | 109.5° |
| F22 | C12 | F21 | 111.0° | 109.5° |
| F10 | C6 | F9 | 109.2° | 109.5° |
| F10 | C6 | C7 | 109.5° | 109.4° |
| F9 | C6 | C7 | 109.0° | 109.5° |
| C6 | C7 | F11 | 110.8° | 109.5° |
| C6 | C7 | F12 | 109.0° | 109.4° |
| C6 | C7 | C8 | 108.6° | 109.4° |
| C11 | C12 | F21 | 109.2° | 109.5° |
| C12 | C11 | F20 | 107.0° | 109.5° |
| C12 | C11 | F19 | 105.4° | 109.4° |
| C12 | C11 | C10 | 113.0° | 109.4° |
| F20 | C11 | F19 | 109.6° | 109.5° |
| F20 | C11 | C10 | 115.3° | 109.5° |
| F11 | C7 | F12 | 109.0° | 109.5° |
| F11 | C7 | C8 | 110.2° | 109.5° |
| F19 | C11 | C10 | 106.1° | 109.5° |
| C11 | C10 | F18 | 107.8° | 109.5° |
| C11 | C10 | C9 | 122.6° | 109.4° |
| C11 | C10 | F17 | 106.8° | 109.5° |
| F12 | C7 | C8 | 109.3° | 109.5° |
| C7 | C8 | F14 | 110.7° | 109.5° |
| C7 | C8 | C9 | 109.5° | 109.4° |
| C7 | C8 | F13 | 108.3° | 109.5° |
| F14 | C8 | C9 | 112.5° | 109.5° |
| F14 | C8 | F13 | 108.0° | 109.5° |
| C9 | C8 | F13 | 107.9° | 109.5° |
| C8 | C9 | C10 | 121.7° | 109.5° |
| C8 | C9 | F15 | 107.6° | 109.4° |
| C8 | C9 | F16 | 105.4° | 109.5° |
| F18 | C10 | C9 | 105.5° | 109.4° |
| F18 | C10 | F17 | 106.8° | 109.5° |
| C9 | C10 | F17 | 106.4° | 109.5° |
| C10 | C9 | F15 | 107.5° | 109.5° |
| C10 | C9 | F16 | 105.7° | 109.5° |
| F15 | C9 | F16 | 108.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O2 | C1 | O1 | C2 | 179.4° | 180.0° |
| O2 | C1 | C2 | F2 | 108.3° | 95.0° |
| O2 | C1 | C2 | C3 | 11.4° | 25.0° |
| O2 | C1 | C2 | F1 | 130.6° | 145.0° |
| O2 | C1 | O1 | H1 | 0.0° | 0.0° |
| O1 | C1 | C2 | F2 | 72.2° | 85.0° |
| O1 | C1 | C2 | C3 | 168.1° | 155.0° |
| O1 | C1 | C2 | F1 | 48.9° | 35.0° |
| C1 | C2 | C3 | F4 | 72.3° | 60.0° |
| C1 | C2 | F2 | C3 | 119.2° | 120.0° |
| C1 | C2 | F2 | F1 | 120.6° | 120.0° |
| C1 | C2 | C3 | F1 | 119.1° | 120.0° |
| C1 | C2 | C3 | F3 | 48.0° | 60.0° |
| C1 | C2 | C3 | C4 | 167.4° | 180.0° |
| C2 | C1 | O1 | H1 | 179.4° | 180.0° |
| F29 | C16 | C15 | F27 | 21.6° | 180.0° |
| F29 | C16 | F30 | F31 | 118.3° | 120.0° |
| F29 | C16 | F30 | C15 | 120.9° | 120.1° |
| F29 | C16 | F31 | C15 | 119.5° | 120.0° |
| F29 | C16 | C15 | F28 | 94.9° | 60.0° |
| F29 | C16 | C15 | C14 | 142.3° | 60.0° |
| F4 | C3 | C2 | F2 | 48.0° | 60.0° |
| F4 | C3 | C2 | F3 | 120.2° | 120.0° |
| F4 | C3 | C2 | C4 | 120.4° | 120.0° |
| F4 | C3 | C2 | F1 | 168.7° | NaN° |
| F4 | C3 | F3 | C4 | 120.5° | 120.0° |
| F4 | C3 | C4 | F6 | 26.2° | 60.0° |
| F4 | C3 | C4 | C5 | 94.6° | 60.0° |
| F4 | C3 | C4 | F5 | 145.8° | 180.0° |
| F2 | C2 | C3 | F1 | 120.7° | 120.0° |
| F2 | C2 | C3 | F3 | 168.2° | 180.0° |
| F2 | C2 | C3 | C4 | 72.4° | 60.0° |
| F27 | C15 | C16 | F30 | 98.6° | 60.0° |
| F27 | C15 | C16 | F31 | 140.7° | 60.0° |
| F27 | C15 | C16 | F28 | 116.5° | 120.0° |
| F27 | C15 | C16 | C14 | 120.7° | 120.0° |
| F27 | C15 | F28 | C14 | 116.3° | 120.0° |
| F27 | C15 | C14 | F26 | 44.7° | 180.0° |
| F27 | C15 | C14 | F25 | 71.1° | 60.0° |
| F27 | C15 | C14 | C13 | 167.1° | 59.9° |
| C2 | C3 | F3 | C4 | 119.4° | 120.0° |
| C2 | C3 | C4 | F6 | 94.1° | 60.0° |
| C2 | C3 | C4 | C5 | 145.1° | 180.0° |
| C2 | C3 | C4 | F5 | 25.5° | 60.0° |
| F1 | C2 | C3 | F3 | 71.1° | 60.0° |
| F1 | C2 | C3 | C4 | 48.3° | 60.0° |
| F30 | C16 | F31 | C15 | 122.6° | 119.9° |
| F30 | C16 | C15 | F28 | 144.9° | 60.1° |
| F30 | C16 | C15 | C14 | 22.2° | 180.0° |
| F31 | C16 | C15 | F28 | 24.2° | 180.0° |
| F31 | C16 | C15 | C14 | 98.5° | 60.1° |
| C16 | C15 | F28 | C14 | 126.4° | 120.0° |
| C16 | C15 | C14 | F26 | 76.6° | 59.9° |
| C16 | C15 | C14 | F25 | 167.6° | 60.0° |
| C16 | C15 | C14 | C13 | 45.9° | 180.0° |
| F3 | C3 | C4 | F6 | 146.7° | 180.0° |
| F3 | C3 | C4 | C5 | 25.9° | 60.0° |
| F3 | C3 | C4 | F5 | 93.7° | 60.0° |
| C3 | C4 | C5 | F8 | 52.6° | 60.0° |
| C3 | C4 | F6 | C5 | 119.6° | 119.9° |
| C3 | C4 | F6 | F5 | 120.2° | 120.0° |
| C3 | C4 | C5 | F5 | 119.9° | 120.0° |
| C3 | C4 | C5 | F7 | 67.4° | 60.0° |
| C3 | C4 | C5 | C6 | 172.1° | 180.0° |
| F28 | C15 | C14 | F26 | 160.8° | 60.0° |
| F28 | C15 | C14 | F25 | 45.0° | 180.0° |
| F28 | C15 | C14 | C13 | 76.7° | 60.0° |
| C15 | C14 | F26 | F25 | 115.6° | 120.0° |
| C15 | C14 | F26 | C13 | 128.3° | 120.0° |
| C15 | C14 | F25 | C13 | 127.6° | 119.9° |
| C15 | C14 | C13 | F24 | 64.4° | 60.1° |
| C15 | C14 | C13 | F23 | 179.0° | 60.0° |
| C15 | C14 | C13 | C12 | 61.0° | 180.0° |
| F26 | C14 | F25 | C13 | 115.8° | 120.1° |
| F26 | C14 | C13 | F24 | 58.5° | 60.0° |
| F26 | C14 | C13 | F23 | 58.0° | 180.0° |
| F26 | C14 | C13 | C12 | 176.0° | 60.0° |
| F8 | C5 | C4 | F6 | 67.5° | 180.0° |
| F8 | C5 | C4 | F7 | 120.0° | 120.0° |
| F8 | C5 | C4 | C6 | 119.5° | 120.0° |
| F8 | C5 | C4 | F5 | 172.5° | 60.0° |
| F8 | C5 | F7 | C6 | 120.7° | 120.0° |
| F8 | C5 | C6 | F10 | 15.1° | 180.0° |
| F8 | C5 | C6 | F9 | 134.2° | 60.0° |
| F8 | C5 | C6 | C7 | 105.7° | 60.0° |
| F6 | C4 | C5 | F5 | 119.9° | 120.0° |
| F6 | C4 | C5 | F7 | 172.5° | 60.0° |
| F6 | C4 | C5 | C6 | 52.0° | 60.0° |
| C4 | C5 | F7 | C6 | 119.0° | 120.0° |
| C4 | C5 | C6 | F10 | 104.9° | 60.0° |
| C4 | C5 | C6 | F9 | 14.2° | 60.0° |
| C4 | C5 | C6 | C7 | 134.3° | 180.0° |
| F5 | C4 | C5 | F7 | 52.5° | 180.0° |
| F5 | C4 | C5 | C6 | 67.9° | 60.0° |
| F25 | C14 | C13 | F24 | 174.2° | 180.0° |
| F25 | C14 | C13 | F23 | 57.7° | 60.0° |
| F25 | C14 | C13 | C12 | 60.4° | 60.1° |
| C14 | C13 | F24 | F23 | 116.2° | 120.1° |
| C14 | C13 | F24 | C12 | 127.7° | 119.9° |
| C14 | C13 | F23 | C12 | 122.5° | 120.0° |
| C14 | C13 | C12 | F22 | 55.2° | 59.9° |
| C14 | C13 | C12 | C11 | 175.0° | 180.0° |
| C14 | C13 | C12 | F21 | 67.3° | 60.0° |
| F24 | C13 | F23 | C12 | 117.8° | 120.0° |
| F24 | C13 | C12 | F22 | 71.3° | 60.0° |
| F24 | C13 | C12 | C11 | 48.5° | 60.0° |
| F24 | C13 | C12 | F21 | 166.2° | 180.0° |
| F7 | C5 | C6 | F10 | 136.0° | 60.0° |
| F7 | C5 | C6 | F9 | 104.9° | 180.0° |
| F7 | C5 | C6 | C7 | 15.2° | 60.0° |
| C5 | C6 | F10 | F9 | 118.9° | 120.0° |
| C5 | C6 | F10 | C7 | 121.9° | 120.0° |
| C5 | C6 | F9 | C7 | 121.4° | 120.0° |
| C5 | C6 | C7 | F11 | 13.8° | 60.0° |
| C5 | C6 | C7 | F12 | 133.7° | 60.0° |
| C5 | C6 | C7 | C8 | 107.3° | 180.0° |
| F23 | C13 | C12 | F22 | 172.8° | 180.0° |
| F23 | C13 | C12 | C11 | 67.4° | 60.0° |
| F23 | C13 | C12 | F21 | 50.3° | 60.0° |
| C13 | C12 | F22 | C11 | 119.7° | 120.0° |
| C13 | C12 | F22 | F21 | 120.4° | 120.0° |
| C13 | C12 | C11 | F21 | 116.5° | 120.0° |
| C13 | C12 | C11 | F20 | 86.4° | 60.0° |
| C13 | C12 | C11 | F19 | 30.1° | 60.0° |
| C13 | C12 | C11 | C10 | 145.5° | 180.0° |
| F22 | C12 | C11 | F21 | 121.0° | 120.0° |
| F22 | C12 | C11 | F20 | 36.1° | 60.0° |
| F22 | C12 | C11 | F19 | 152.7° | 180.0° |
| F22 | C12 | C11 | C10 | 92.0° | 60.0° |
| F10 | C6 | F9 | C7 | 119.5° | 120.0° |
| F10 | C6 | C7 | F11 | 106.8° | 60.0° |
| F10 | C6 | C7 | F12 | 13.1° | 180.0° |
| F10 | C6 | C7 | C8 | 132.1° | 60.0° |
| F9 | C6 | C7 | F11 | 133.9° | 180.0° |
| F9 | C6 | C7 | F12 | 106.2° | 60.0° |
| F9 | C6 | C7 | C8 | 12.8° | 60.0° |
| C6 | C7 | F11 | F12 | 119.9° | 120.0° |
| C6 | C7 | F11 | C8 | 120.2° | 120.0° |
| C6 | C7 | F12 | C8 | 118.5° | 119.9° |
| C6 | C7 | C8 | F14 | 36.5° | 60.0° |
| C6 | C7 | C8 | C9 | 161.0° | 180.0° |
| C6 | C7 | C8 | F13 | 81.7° | 60.0° |
| C12 | C11 | F20 | F19 | 113.8° | 120.0° |
| C12 | C11 | F20 | C10 | 126.7° | 120.0° |
| C12 | C11 | F19 | C10 | 120.1° | 119.9° |
| C12 | C11 | C10 | F18 | 14.3° | 60.0° |
| C12 | C11 | C10 | C9 | 108.3° | NaN° |
| C12 | C11 | C10 | F17 | 128.8° | 60.0° |
| F21 | C12 | C11 | F20 | 157.1° | 180.0° |
| F21 | C12 | C11 | F19 | 86.4° | 60.0° |
| F21 | C12 | C11 | C10 | 29.0° | 60.0° |
| F20 | C11 | F19 | C10 | 125.1° | 120.0° |
| F20 | C11 | C10 | F18 | 137.9° | 60.0° |
| F20 | C11 | C10 | C9 | 15.3° | 60.0° |
| F20 | C11 | C10 | F17 | 107.6° | 180.0° |
| F11 | C7 | F12 | C8 | 120.4° | 120.0° |
| F11 | C7 | C8 | F14 | 85.0° | 60.0° |
| F11 | C7 | C8 | C9 | 39.5° | 60.0° |
| F11 | C7 | C8 | F13 | 156.8° | 180.0° |
| F19 | C11 | C10 | F18 | 100.7° | 180.0° |
| F19 | C11 | C10 | C9 | 136.7° | 60.1° |
| F19 | C11 | C10 | F17 | 13.8° | 60.0° |
| C11 | C10 | C9 | C8 | 20.9° | 180.0° |
| C11 | C10 | F18 | C9 | 132.6° | 120.0° |
| C11 | C10 | F18 | F17 | 114.5° | 120.0° |
| C11 | C10 | C9 | F17 | 123.1° | 120.0° |
| C11 | C10 | C9 | F15 | 103.7° | 60.0° |
| C11 | C10 | C9 | F16 | 140.7° | 60.0° |
| F12 | C7 | C8 | F14 | 155.2° | 180.0° |
| F12 | C7 | C8 | C9 | 80.3° | 60.0° |
| F12 | C7 | C8 | F13 | 37.1° | 60.0° |
| C7 | C8 | F14 | C9 | 122.8° | 120.0° |
| C7 | C8 | F14 | F13 | 118.3° | 120.0° |
| C7 | C8 | C9 | F13 | 117.6° | 120.0° |
| C7 | C8 | C9 | C10 | 99.5° | 180.0° |
| C7 | C8 | C9 | F15 | 25.0° | 60.0° |
| C7 | C8 | C9 | F16 | 140.5° | 60.0° |
| F14 | C8 | C9 | F13 | 119.0° | 120.0° |
| F14 | C8 | C9 | C10 | 23.9° | 60.0° |
| F14 | C8 | C9 | F15 | 148.5° | 180.0° |
| F14 | C8 | C9 | F16 | 96.0° | 60.0° |
| C8 | C9 | C10 | F18 | 144.6° | 60.0° |
| C8 | C9 | C10 | F15 | 124.6° | 120.0° |
| C8 | C9 | C10 | F16 | 119.8° | 120.0° |
| C8 | C9 | C10 | F17 | 102.1° | 60.0° |
| C8 | C9 | F15 | F16 | 113.5° | 120.0° |
| F13 | C8 | C9 | C10 | 142.9° | 60.0° |
| F13 | C8 | C9 | F15 | 92.6° | 60.0° |
| F13 | C8 | C9 | F16 | 22.9° | 180.0° |
| F18 | C10 | C9 | F17 | 113.3° | 120.0° |
| F18 | C10 | C9 | F15 | 20.0° | 180.0° |
| F18 | C10 | C9 | F16 | 95.6° | 60.0° |
| C10 | C9 | F15 | F16 | 113.8° | 120.0° |
| F17 | C10 | C9 | F15 | 133.2° | 60.0° |
| F17 | C10 | C9 | F16 | 17.7° | 180.0° |
