FPF
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | sing | 1.43Å | 1.43Å | |
| C1 | C2 | sing | 1.51Å | 1.51Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| P1 | O1 | sing | 1.61Å | 1.61Å | |
| C3 | C2 | doub | 1.31Å | 1.31Å | |
| C2 | F | sing | 1.35Å | 1.24Å | |
| C4 | C3 | sing | 1.51Å | 1.51Å | |
| C3 | C5 | sing | 1.51Å | 1.51Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C4 | H4B | sing | 1.09Å | 1.10Å | |
| C6 | C5 | sing | 1.53Å | 1.65Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C5 | H5A | sing | 1.09Å | 1.10Å | |
| C7 | C6 | sing | 1.51Å | 1.51Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H6A | sing | 1.09Å | 1.10Å | |
| C8 | C7 | doub | 1.31Å | 1.31Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C9 | C8 | sing | 1.51Å | 1.51Å | |
| C8 | C10 | sing | 1.51Å | 1.51Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C10 | H10B | sing | 1.09Å | 1.10Å | |
| C11 | C9 | sing | 1.53Å | 1.53Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C11 | C12 | sing | 1.51Å | 1.51Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C13 | C12 | doub | 1.31Å | 1.31Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C15 | C13 | sing | 1.51Å | 1.51Å | |
| C13 | C14 | sing | 1.51Å | 1.51Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C14 | H14B | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C15 | H15B | sing | 1.09Å | 1.10Å | |
| O1A | P1 | doub | 1.48Å | 1.48Å | |
| O2A | P1 | sing | 1.61Å | 1.61Å | |
| P1 | O3A | sing | 1.61Å | 1.61Å | |
| O2A | HO2A | sing | 0.97Å | 0.95Å | |
| P2 | O3A | sing | 1.61Å | 1.61Å | |
| O3B | P2 | doub | 1.48Å | 1.61Å | |
| P2 | O1B | sing | 1.61Å | 1.48Å | |
| P2 | O2B | sing | 1.61Å | 1.61Å | |
| O1B | HO1B | sing | 0.97Å | 0.95Å | |
| O2B | HO2B | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | C2 | 109.4° | 109.5° |
| O1 | C1 | H1 | 109.5° | 109.5° |
| O1 | C1 | H1A | 109.5° | 109.5° |
| C1 | O1 | P1 | 106.8° | 123.0° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.5° | 109.5° |
| C1 | C2 | C3 | 120.0° | 120.0° |
| C1 | C2 | F | 130.8° | 120.0° |
| H1 | C1 | H1A | 109.4° | 109.4° |
| O1 | P1 | O1A | 109.5° | 109.5° |
| O1 | P1 | O2A | 109.3° | 109.5° |
| O1 | P1 | O3A | 109.5° | 109.5° |
| C3 | C2 | F | 109.1° | 120.0° |
| C2 | C3 | C4 | 120.0° | 120.0° |
| C2 | C3 | C5 | 120.0° | 120.0° |
| C4 | C3 | C5 | 120.0° | 120.0° |
| C3 | C4 | H4 | 109.5° | 109.5° |
| C3 | C4 | H4A | 109.5° | 109.5° |
| C3 | C4 | H4B | 109.4° | 109.5° |
| C3 | C5 | C6 | 105.4° | 109.5° |
| C3 | C5 | H5 | 110.9° | 109.5° |
| C3 | C5 | H5A | 111.8° | 109.5° |
| H4 | C4 | H4A | 109.5° | 109.5° |
| H4 | C4 | H4B | 109.4° | 109.5° |
| H4A | C4 | H4B | 109.5° | 109.4° |
| C6 | C5 | H5 | 110.9° | 109.5° |
| C6 | C5 | H5A | 111.7° | 109.5° |
| C5 | C6 | C7 | 141.8° | 109.5° |
| C5 | C6 | H6 | 99.8° | 109.5° |
| C5 | C6 | H6A | 92.9° | 109.4° |
| H5 | C5 | H5A | 106.3° | 109.4° |
| C7 | C6 | H6 | 99.8° | 109.5° |
| C7 | C6 | H6A | 92.9° | 109.5° |
| C6 | C7 | C8 | 120.1° | 120.0° |
| C6 | C7 | H7 | 120.0° | 120.0° |
| H6 | C6 | H6A | 139.8° | 109.5° |
| C8 | C7 | H7 | 120.0° | 120.0° |
| C7 | C8 | C9 | 120.0° | 120.0° |
| C7 | C8 | C10 | 120.1° | 119.9° |
| C9 | C8 | C10 | 119.9° | 120.0° |
| C8 | C9 | C11 | 109.5° | 109.5° |
| C8 | C9 | H9 | 109.4° | 109.5° |
| C8 | C9 | H9A | 109.5° | 109.5° |
| C8 | C10 | H10 | 109.5° | 109.5° |
| C8 | C10 | H10A | 109.5° | 109.4° |
| C8 | C10 | H10B | 109.5° | 109.5° |
| H10 | C10 | H10A | 109.5° | 109.5° |
| H10 | C10 | H10B | 109.4° | 109.5° |
| H10A | C10 | H10B | 109.5° | 109.5° |
| C11 | C9 | H9 | 109.5° | 109.4° |
| C11 | C9 | H9A | 109.5° | 109.5° |
| C9 | C11 | C12 | 109.5° | 109.5° |
| C9 | C11 | H11 | 109.5° | 109.5° |
| C9 | C11 | H11A | 109.5° | 109.4° |
| H9 | C9 | H9A | 109.5° | 109.4° |
| C12 | C11 | H11 | 109.5° | 109.5° |
| C12 | C11 | H11A | 109.5° | 109.5° |
| C11 | C12 | C13 | 119.9° | 120.0° |
| C11 | C12 | H12 | 120.0° | 120.0° |
| H11 | C11 | H11A | 109.5° | 109.5° |
| C13 | C12 | H12 | 120.1° | 120.0° |
| C12 | C13 | C15 | 120.0° | 120.0° |
| C12 | C13 | C14 | 120.0° | 120.0° |
| C15 | C13 | C14 | 120.0° | 120.0° |
| C13 | C15 | H15 | 109.5° | 109.4° |
| C13 | C15 | H15A | 109.5° | 109.5° |
| C13 | C15 | H15B | 109.5° | 109.5° |
| C13 | C14 | H14 | 109.5° | 109.5° |
| C13 | C14 | H14A | 109.4° | 109.5° |
| C13 | C14 | H14B | 109.5° | 109.5° |
| H14 | C14 | H14A | 109.5° | 109.4° |
| H14 | C14 | H14B | 109.5° | 109.5° |
| H14A | C14 | H14B | 109.5° | 109.5° |
| H15 | C15 | H15A | 109.4° | 109.5° |
| H15 | C15 | H15B | 109.5° | 109.5° |
| H15A | C15 | H15B | 109.5° | 109.5° |
| O1A | P1 | O2A | 109.5° | 109.5° |
| O1A | P1 | O3A | 109.5° | 109.5° |
| O2A | P1 | O3A | 109.5° | 109.5° |
| P1 | O2A | HO2A | 109.5° | 114.0° |
| P1 | O3A | P2 | 106.8° | 134.0° |
| O3A | P2 | O3B | 109.5° | 109.5° |
| O3A | P2 | O1B | 109.5° | 109.5° |
| O3A | P2 | O2B | 109.5° | 109.5° |
| O3B | P2 | O1B | 109.5° | 109.5° |
| O3B | P2 | O2B | 109.5° | 109.5° |
| O1B | P2 | O2B | 109.4° | 109.5° |
| P2 | O1B | HO1B | 109.5° | 114.0° |
| P2 | O2B | HO2B | 109.5° | 114.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | C2 | H1 | 120.0° | 120.0° |
| O1 | C1 | C2 | H1A | 120.0° | 120.0° |
| O1 | C1 | H1 | H1A | 120.0° | 120.0° |
| O1 | C1 | C2 | C3 | 109.9° | 115.8° |
| O1 | C1 | C2 | F | 66.1° | 64.2° |
| C1 | O1 | P1 | O1A | 79.2° | 55.0° |
| C1 | O1 | P1 | O2A | 160.9° | 65.0° |
| C1 | O1 | P1 | O3A | 40.9° | 175.0° |
| C2 | C1 | H1 | H1A | 120.1° | 120.0° |
| C2 | C1 | O1 | P1 | 153.1° | 180.0° |
| C1 | C2 | C3 | F | 176.8° | 180.0° |
| C1 | C2 | C3 | C4 | 2.3° | 4.5° |
| C1 | C2 | C3 | C5 | 177.7° | 175.5° |
| H1 | C1 | O1 | P1 | 33.1° | 60.0° |
| H1 | C1 | C2 | C3 | 10.1° | 4.2° |
| H1 | C1 | C2 | F | 173.9° | 175.8° |
| H1A | C1 | O1 | P1 | 86.9° | 60.0° |
| H1A | C1 | C2 | C3 | 130.0° | 124.2° |
| H1A | C1 | C2 | F | 53.9° | 55.8° |
| O1 | P1 | O1A | O2A | 119.9° | 120.0° |
| O1 | P1 | O1A | O3A | 120.1° | 120.0° |
| O1 | P1 | O2A | O3A | 120.0° | 120.0° |
| O1 | P1 | O2A | HO2A | 110.5° | 60.0° |
| O1 | P1 | O3A | P2 | 168.4° | 165.0° |
| C2 | C3 | C4 | C5 | 180.0° | 180.0° |
| C2 | C3 | C4 | H4 | 84.8° | 84.2° |
| C2 | C3 | C4 | H4A | 155.1° | 155.8° |
| C2 | C3 | C4 | H4B | 35.2° | 35.9° |
| C2 | C3 | C5 | C6 | 107.2° | 95.0° |
| C2 | C3 | C5 | H5 | 132.8° | 144.9° |
| C2 | C3 | C5 | H5A | 14.4° | 25.0° |
| F | C2 | C3 | C4 | 179.1° | 175.5° |
| F | C2 | C3 | C5 | 0.8° | 4.5° |
| C3 | C4 | H4 | H4A | 120.0° | 120.0° |
| C3 | C4 | H4 | H4B | 120.0° | 120.0° |
| C3 | C4 | H4A | H4B | 120.0° | 120.0° |
| C4 | C3 | C5 | C6 | 72.8° | 85.0° |
| C4 | C3 | C5 | H5 | 47.2° | 35.0° |
| C4 | C3 | C5 | H5A | 165.7° | 155.0° |
| C5 | C3 | C4 | H4 | 95.2° | 95.8° |
| C5 | C3 | C4 | H4A | 24.8° | 24.2° |
| C5 | C3 | C4 | H4B | 144.8° | 144.2° |
| C3 | C5 | C6 | H5 | 120.0° | 120.0° |
| C3 | C5 | C6 | H5A | 121.6° | 120.0° |
| C3 | C5 | H5 | H5A | 121.7° | 120.0° |
| C3 | C5 | C6 | C7 | 59.7° | 180.0° |
| C3 | C5 | C6 | H6 | 179.7° | 60.0° |
| C3 | C5 | C6 | H6A | 38.7° | 60.0° |
| H4 | C4 | H4A | H4B | 120.0° | 120.0° |
| C6 | C5 | H5 | H5A | 121.7° | 120.0° |
| C5 | C6 | C7 | H6 | 120.0° | 120.0° |
| C5 | C6 | C7 | H6A | 98.3° | 120.0° |
| C5 | C6 | H6 | H6A | 106.4° | 120.0° |
| C5 | C6 | C7 | C8 | 123.3° | 119.2° |
| C5 | C6 | C7 | H7 | 56.7° | 60.8° |
| H5 | C5 | C6 | C7 | 60.3° | 60.0° |
| H5 | C5 | C6 | H6 | 59.6° | 180.0° |
| H5 | C5 | C6 | H6A | 158.7° | 60.0° |
| H5A | C5 | C6 | C7 | 178.8° | 60.0° |
| H5A | C5 | C6 | H6 | 58.8° | 60.0° |
| H5A | C5 | C6 | H6A | 82.9° | 180.0° |
| C7 | C6 | H6 | H6A | 106.4° | 120.0° |
| C6 | C7 | C8 | H7 | 180.0° | 180.0° |
| C6 | C7 | C8 | C9 | 178.4° | 175.7° |
| C6 | C7 | C8 | C10 | 1.4° | 4.2° |
| H6 | C6 | C7 | C8 | 116.7° | 0.9° |
| H6 | C6 | C7 | H7 | 63.3° | 179.1° |
| H6A | C6 | C7 | C8 | 25.0° | 120.9° |
| H6A | C6 | C7 | H7 | 155.1° | 59.1° |
| C7 | C8 | C9 | C10 | 179.8° | 180.0° |
| C7 | C8 | C10 | H10 | 162.2° | 84.0° |
| C7 | C8 | C10 | H10A | 77.8° | 156.0° |
| C7 | C8 | C10 | H10B | 42.2° | 36.1° |
| C7 | C8 | C9 | C11 | 137.0° | 95.0° |
| C7 | C8 | C9 | H9 | 17.0° | 145.0° |
| C7 | C8 | C9 | H9A | 103.0° | 25.0° |
| H7 | C7 | C8 | C9 | 1.5° | 4.3° |
| H7 | C7 | C8 | C10 | 178.7° | 175.8° |
| C9 | C8 | C10 | H10 | 18.0° | 96.0° |
| C9 | C8 | C10 | H10A | 102.0° | 24.0° |
| C9 | C8 | C10 | H10B | 137.9° | 144.0° |
| C8 | C9 | C11 | H9 | 120.0° | 120.0° |
| C8 | C9 | C11 | H9A | 120.0° | 120.1° |
| C8 | C9 | H9 | H9A | 120.0° | 120.0° |
| C8 | C9 | C11 | C12 | 61.9° | 180.0° |
| C8 | C9 | C11 | H11 | 178.1° | 60.0° |
| C8 | C9 | C11 | H11A | 58.1° | 60.0° |
| C8 | C10 | H10 | H10A | 120.0° | 120.0° |
| C8 | C10 | H10 | H10B | 120.0° | 120.0° |
| C8 | C10 | H10A | H10B | 120.0° | 120.0° |
| C10 | C8 | C9 | C11 | 43.2° | 85.0° |
| C10 | C8 | C9 | H9 | 163.2° | 35.0° |
| C10 | C8 | C9 | H9A | 76.8° | 154.9° |
| H10 | C10 | H10A | H10B | 119.9° | 120.0° |
| C11 | C9 | H9 | H9A | 120.0° | 119.9° |
| C9 | C11 | C12 | H11 | 120.0° | 120.0° |
| C9 | C11 | C12 | H11A | 120.0° | 120.0° |
| C9 | C11 | H11 | H11A | 120.0° | 120.0° |
| C9 | C11 | C12 | C13 | 68.0° | 126.6° |
| C9 | C11 | C12 | H12 | 112.1° | 53.3° |
| H9 | C9 | C11 | C12 | 58.0° | 60.0° |
| H9 | C9 | C11 | H11 | 62.0° | 180.0° |
| H9 | C9 | C11 | H11A | 178.0° | 60.0° |
| H9A | C9 | C11 | C12 | 178.1° | 59.9° |
| H9A | C9 | C11 | H11 | 58.1° | 60.1° |
| H9A | C9 | C11 | H11A | 61.9° | 179.9° |
| C12 | C11 | H11 | H11A | 120.0° | 120.0° |
| C11 | C12 | C13 | H12 | 180.0° | 180.0° |
| C11 | C12 | C13 | C15 | 1.5° | 172.4° |
| C11 | C12 | C13 | C14 | 178.7° | 7.6° |
| H11 | C11 | C12 | C13 | 52.0° | 6.6° |
| H11 | C11 | C12 | H12 | 127.9° | 173.3° |
| H11A | C11 | C12 | C13 | 172.0° | 113.4° |
| H11A | C11 | C12 | H12 | 7.9° | 66.7° |
| C12 | C13 | C15 | C14 | 179.8° | 179.9° |
| C12 | C13 | C14 | H14 | 61.7° | 5.5° |
| C12 | C13 | C14 | H14A | 178.3° | 125.5° |
| C12 | C13 | C14 | H14B | 58.3° | 114.5° |
| C12 | C13 | C15 | H15 | 89.6° | 90.0° |
| C12 | C13 | C15 | H15A | 30.3° | 149.9° |
| C12 | C13 | C15 | H15B | 150.4° | 30.0° |
| H12 | C12 | C13 | C15 | 178.5° | 7.6° |
| H12 | C12 | C13 | C14 | 1.3° | 172.4° |
| C15 | C13 | C14 | H14 | 118.1° | 174.4° |
| C15 | C13 | C14 | H14A | 1.9° | 54.4° |
| C15 | C13 | C14 | H14B | 121.9° | 65.6° |
| C13 | C15 | H15 | H15A | 120.0° | 120.0° |
| C13 | C15 | H15 | H15B | 120.0° | 120.0° |
| C13 | C15 | H15A | H15B | 120.0° | 120.0° |
| C13 | C14 | H14 | H14A | 120.0° | 120.0° |
| C13 | C14 | H14 | H14B | 120.0° | 120.0° |
| C13 | C14 | H14A | H14B | 120.0° | 120.0° |
| C14 | C13 | C15 | H15 | 90.1° | 90.0° |
| C14 | C13 | C15 | H15A | 149.9° | 30.0° |
| C14 | C13 | C15 | H15B | 29.8° | 150.0° |
| H14 | C14 | H14A | H14B | 120.0° | 120.0° |
| H15 | C15 | H15A | H15B | 120.0° | 120.1° |
| O1A | P1 | O2A | O3A | 120.1° | 120.0° |
| O1A | P1 | O2A | HO2A | 9.5° | 180.0° |
| O1A | P1 | O3A | P2 | 71.6° | 45.0° |
| O2A | P1 | O3A | P2 | 48.5° | 75.0° |
| O3A | P1 | O2A | HO2A | 129.6° | 60.0° |
| P1 | O3A | P2 | O3B | 44.7° | 39.9° |
| P1 | O3A | P2 | O1B | 75.3° | 80.1° |
| P1 | O3A | P2 | O2B | 164.7° | 160.0° |
| O3A | P2 | O3B | O1B | 120.0° | 120.0° |
| O3A | P2 | O3B | O2B | 120.0° | 120.0° |
| O3A | P2 | O1B | O2B | 120.0° | 120.0° |
| O3A | P2 | O1B | HO1B | 130.1° | 60.0° |
| O3A | P2 | O2B | HO2B | 41.7° | 179.9° |
| O3B | P2 | O1B | O2B | 120.0° | 120.0° |
| O3B | P2 | O1B | HO1B | 10.1° | 180.0° |
| O3B | P2 | O2B | HO2B | 161.7° | 60.0° |
| O1B | P2 | O2B | HO2B | 78.3° | 60.0° |
| O2B | P2 | O1B | HO1B | 109.9° | 60.0° |
