F9X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3P | P | doub | 1.48Å | 1.51Å | |
| O2P | P | sing | 1.61Å | 1.51Å | |
| P | O1P | sing | 1.61Å | 1.50Å | |
| P | O4P | sing | 1.61Å | 1.61Å | |
| O4P | C5A | sing | 1.43Å | 1.43Å | |
| C5A | C5 | sing | 1.51Å | 1.49Å | |
| C5 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.49Å | Aromatic |
| C6 | N1 | sing | 1.32Å | 1.35Å | Aromatic |
| C4A | C4 | sing | 1.51Å | 1.50Å | |
| C4A | N | sing | 1.47Å | 1.47Å | |
| C4 | C3 | doub | 1.39Å | 1.48Å | Aromatic |
| N1 | C2 | doub | 1.32Å | 1.36Å | Aromatic |
| N | CA | sing | 1.47Å | 1.48Å | |
| CA | C | sing | 1.51Å | 1.49Å | |
| CA | CB | sing | 1.53Å | 1.52Å | |
| C3 | C2 | sing | 1.39Å | 1.49Å | Aromatic |
| C3 | O3 | sing | 1.36Å | 1.37Å | |
| C2 | C2A | sing | 1.51Å | 1.51Å | |
| O | C | doub | 1.21Å | 1.26Å | |
| CG | CB | sing | 1.53Å | 1.53Å | |
| CG | CD | sing | 1.53Å | 1.51Å | |
| C | OT | sing | 1.34Å | 1.25Å | |
| CB | OB | sing | 1.43Å | 1.42Å | |
| O1P | H1 | sing | 0.97Å | 0.95Å | |
| O2P | H2 | sing | 0.97Å | 0.95Å | |
| CA | H3 | sing | 1.09Å | 1.10Å | |
| CB | H4 | sing | 1.09Å | 1.10Å | |
| CG | H5 | sing | 1.09Å | 1.10Å | |
| CG | H6 | sing | 1.09Å | 1.10Å | |
| N | H7 | sing | 1.01Å | 1.00Å | |
| OB | H9 | sing | 0.97Å | 0.95Å | |
| CD | H10 | sing | 1.09Å | 1.10Å | |
| CD | H11 | sing | 1.09Å | 1.10Å | |
| CD | H12 | sing | 1.09Å | 1.10Å | |
| C2A | H13 | sing | 1.09Å | 1.10Å | |
| C2A | H14 | sing | 1.09Å | 1.10Å | |
| C2A | H15 | sing | 1.09Å | 1.10Å | |
| C4A | H16 | sing | 1.09Å | 1.10Å | |
| C4A | H17 | sing | 1.09Å | 1.10Å | |
| C5A | H18 | sing | 1.09Å | 1.10Å | |
| C5A | H19 | sing | 1.09Å | 1.10Å | |
| C6 | H20 | sing | 1.08Å | 1.08Å | |
| O3 | H21 | sing | 0.97Å | 0.95Å | |
| OT | H22 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3P | P | O2P | 112.4° | 109.5° |
| O3P | P | O1P | 110.1° | 109.5° |
| O3P | P | O4P | 108.4° | 109.5° |
| O2P | P | O1P | 111.1° | 109.4° |
| O2P | P | O4P | 106.7° | 109.4° |
| P | O2P | H2 | 109.5° | 114.0° |
| O1P | P | O4P | 107.9° | 109.5° |
| P | O1P | H1 | 109.5° | 114.0° |
| P | O4P | C5A | 119.1° | 123.0° |
| O4P | C5A | C5 | 105.4° | 109.5° |
| O4P | C5A | H18 | 110.5° | 109.4° |
| O4P | C5A | H19 | 110.5° | 109.5° |
| C5A | C5 | C6 | 118.4° | 120.4° |
| C5A | C5 | C4 | 121.5° | 120.4° |
| C5 | C5A | H18 | 110.5° | 109.5° |
| C5 | C5A | H19 | 110.5° | 109.5° |
| C6 | C5 | C4 | 120.1° | 119.3° |
| C5 | C6 | N1 | 121.5° | 120.9° |
| C5 | C6 | H20 | 119.3° | 119.6° |
| C5 | C4 | C4A | 122.7° | 120.8° |
| C5 | C4 | C3 | 117.2° | 118.4° |
| C6 | N1 | C2 | 124.0° | 121.8° |
| N1 | C6 | H20 | 119.3° | 119.5° |
| C4 | C4A | N | 108.2° | 109.5° |
| C4A | C4 | C3 | 120.1° | 120.8° |
| C4 | C4A | H16 | 109.8° | 109.5° |
| C4 | C4A | H17 | 109.8° | 109.5° |
| C4A | N | CA | 111.5° | 111.0° |
| C4A | N | H7 | 109.0° | 111.0° |
| N | C4A | H16 | 109.8° | 109.4° |
| N | C4A | H17 | 109.8° | 109.5° |
| C4 | C3 | C2 | 116.7° | 119.0° |
| C4 | C3 | O3 | 122.2° | 120.5° |
| N1 | C2 | C3 | 120.5° | 120.7° |
| N1 | C2 | C2A | 119.8° | 119.7° |
| N | CA | C | 110.2° | 109.5° |
| N | CA | CB | 111.9° | 109.4° |
| N | CA | H3 | 109.2° | 109.4° |
| CA | N | H7 | 109.0° | 111.0° |
| C | CA | CB | 107.7° | 109.5° |
| CA | C | O | 118.6° | 120.0° |
| CA | C | OT | 115.8° | 120.0° |
| C | CA | H3 | 109.1° | 109.5° |
| CA | CB | CG | 112.2° | 109.5° |
| CA | CB | OB | 108.6° | 109.5° |
| CB | CA | H3 | 108.6° | 109.5° |
| CA | CB | H4 | 108.0° | 109.4° |
| C2 | C3 | O3 | 121.1° | 120.5° |
| C3 | C2 | C2A | 119.8° | 119.6° |
| C3 | O3 | H21 | 109.5° | 114.0° |
| C2 | C2A | H13 | 109.5° | 109.5° |
| C2 | C2A | H14 | 109.5° | 109.5° |
| C2 | C2A | H15 | 109.5° | 109.4° |
| O | C | OT | 125.6° | 120.0° |
| CB | CG | CD | 110.5° | 109.5° |
| CG | CB | OB | 110.8° | 109.5° |
| CG | CB | H4 | 107.9° | 109.5° |
| CB | CG | H5 | 109.2° | 109.5° |
| CB | CG | H6 | 109.2° | 109.5° |
| CD | CG | H5 | 109.2° | 109.4° |
| CD | CG | H6 | 109.2° | 109.5° |
| CG | CD | H10 | 109.5° | 109.5° |
| CG | CD | H11 | 109.4° | 109.4° |
| CG | CD | H12 | 109.5° | 109.5° |
| C | OT | H22 | 109.5° | 117.0° |
| OB | CB | H4 | 109.2° | 109.5° |
| CB | OB | H9 | 109.5° | 114.0° |
| H5 | CG | H6 | 109.5° | 109.5° |
| H10 | CD | H11 | 109.5° | 109.5° |
| H10 | CD | H12 | 109.4° | 109.5° |
| H11 | CD | H12 | 109.5° | 109.5° |
| H13 | C2A | H14 | 109.5° | 109.5° |
| H13 | C2A | H15 | 109.5° | 109.5° |
| H14 | C2A | H15 | 109.5° | 109.4° |
| H16 | C4A | H17 | 109.5° | 109.4° |
| H18 | C5A | H19 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3P | P | O2P | O1P | 123.9° | 120.0° |
| O3P | P | O2P | O4P | 118.8° | 120.1° |
| O3P | P | O1P | O4P | 118.1° | 120.1° |
| O3P | P | O4P | C5A | 142.3° | 55.0° |
| O3P | P | O1P | H1 | 0.0° | 180.0° |
| O3P | P | O2P | H2 | 0.0° | 59.9° |
| O2P | P | O1P | O4P | 116.7° | 119.9° |
| O2P | P | O4P | C5A | 21.0° | 175.0° |
| O2P | P | O1P | H1 | 125.2° | 60.0° |
| O1P | P | O4P | C5A | 98.5° | 65.1° |
| O1P | P | O2P | H2 | 123.9° | 60.0° |
| P | O4P | C5A | C5 | 176.8° | 180.0° |
| O4P | P | O1P | H1 | 118.1° | 59.9° |
| O4P | P | O2P | H2 | 118.7° | 180.0° |
| P | O4P | C5A | H18 | 57.4° | 60.0° |
| P | O4P | C5A | H19 | 63.9° | 60.0° |
| O4P | C5A | C5 | H18 | 119.4° | 120.0° |
| O4P | C5A | C5 | H19 | 119.3° | 120.0° |
| O4P | C5A | C5 | C6 | 92.0° | 0.0° |
| O4P | C5A | C5 | C4 | 86.3° | 180.0° |
| O4P | C5A | H18 | H19 | 121.9° | 120.0° |
| C5A | C5 | C6 | C4 | 178.3° | 180.0° |
| C5A | C5 | C6 | N1 | 178.9° | 180.0° |
| C5A | C5 | C4 | C4A | 1.5° | 0.0° |
| C5A | C5 | C4 | C3 | 178.5° | 180.0° |
| C5 | C5A | H18 | H19 | 121.9° | 120.0° |
| C5A | C5 | C6 | H20 | 1.1° | 0.0° |
| C5 | C6 | N1 | H20 | 180.0° | 180.0° |
| C6 | C5 | C4 | C4A | 179.8° | 180.0° |
| C6 | C5 | C4 | C3 | 0.3° | 0.0° |
| C5 | C6 | N1 | C2 | 0.5° | 0.0° |
| C6 | C5 | C5A | H18 | 148.7° | 120.0° |
| C6 | C5 | C5A | H19 | 27.4° | 120.0° |
| C4 | C5 | C6 | N1 | 0.6° | 0.0° |
| C5 | C4 | C4A | C3 | 179.9° | 179.9° |
| C5 | C4 | C4A | N | 178.3° | 90.0° |
| C5 | C4 | C3 | C2 | 0.2° | 0.0° |
| C5 | C4 | C3 | O3 | 179.4° | 180.0° |
| C5 | C4 | C4A | H16 | 61.9° | 150.1° |
| C5 | C4 | C4A | H17 | 58.5° | 30.1° |
| C4 | C5 | C5A | H18 | 33.1° | 60.1° |
| C4 | C5 | C5A | H19 | 154.4° | 60.0° |
| C4 | C5 | C6 | H20 | 179.4° | 180.0° |
| C6 | N1 | C2 | C3 | 0.1° | 0.0° |
| C6 | N1 | C2 | C2A | 179.7° | 180.0° |
| C4 | C4A | N | H16 | 119.8° | 120.0° |
| C4 | C4A | N | H17 | 119.8° | 120.0° |
| C4 | C4A | N | CA | 164.1° | 180.0° |
| C4A | C4 | C3 | C2 | 179.7° | 180.0° |
| C4A | C4 | C3 | O3 | 0.6° | 0.1° |
| C4 | C4A | N | H7 | 43.8° | 56.0° |
| C4 | C4A | H16 | H17 | 120.5° | 120.0° |
| N | C4A | C4 | C3 | 1.7° | 90.0° |
| C4A | N | CA | H7 | 120.3° | 124.0° |
| C4A | N | CA | C | 136.1° | 85.0° |
| C4A | N | CA | CB | 104.1° | 155.0° |
| C4A | N | CA | H3 | 16.2° | 35.1° |
| N | C4A | H16 | H17 | 120.6° | 120.0° |
| C4 | C3 | C2 | N1 | 0.4° | 0.0° |
| C4 | C3 | C2 | O3 | 179.2° | 180.0° |
| C4 | C3 | C2 | C2A | 179.4° | 180.0° |
| C3 | C4 | C4A | H16 | 118.2° | 30.0° |
| C3 | C4 | C4A | H17 | 121.5° | 150.0° |
| C4 | C3 | O3 | H21 | 180.0° | 90.1° |
| N1 | C2 | C3 | C2A | 179.8° | 180.0° |
| N1 | C2 | C3 | O3 | 179.6° | 180.0° |
| N1 | C2 | C2A | H13 | 0.0° | 90.0° |
| N1 | C2 | C2A | H14 | 120.0° | 149.9° |
| N1 | C2 | C2A | H15 | 120.0° | 30.0° |
| C2 | N1 | C6 | H20 | 179.6° | 180.0° |
| N | CA | C | CB | 122.3° | 120.0° |
| N | CA | C | H3 | 119.9° | 120.0° |
| N | CA | CB | H3 | 120.7° | 119.9° |
| N | CA | C | O | 159.7° | 0.0° |
| N | CA | CB | CG | 149.5° | 55.0° |
| N | CA | C | OT | 22.0° | 180.0° |
| N | CA | CB | OB | 26.6° | 65.0° |
| N | CA | CB | H4 | 91.7° | 175.0° |
| CA | N | C4A | H16 | 76.1° | 60.0° |
| CA | N | C4A | H17 | 44.3° | 60.0° |
| C | CA | CB | H3 | 118.1° | 120.1° |
| CA | C | O | OT | 178.1° | 180.0° |
| C | CA | CB | CG | 89.3° | 175.0° |
| C | CA | CB | OB | 147.9° | 55.0° |
| C | CA | CB | H4 | 29.5° | 65.0° |
| C | CA | N | H7 | 103.6° | 151.1° |
| CA | C | OT | H22 | 178.1° | 180.0° |
| CB | CA | C | O | 78.0° | 120.0° |
| CA | CB | CG | OB | 121.6° | 120.0° |
| CA | CB | CG | H4 | 118.8° | 120.0° |
| CA | CB | CG | CD | 122.6° | 175.0° |
| CB | CA | C | OT | 100.2° | 60.0° |
| CA | CB | OB | H4 | 117.6° | 119.9° |
| CA | CB | CG | H5 | 2.4° | 55.1° |
| CA | CB | CG | H6 | 117.2° | 65.0° |
| CB | CA | N | H7 | 16.2° | 31.0° |
| CA | CB | OB | H9 | 180.0° | 60.0° |
| C3 | C2 | C2A | H13 | 179.8° | 90.0° |
| C3 | C2 | C2A | H14 | 60.2° | 30.1° |
| C3 | C2 | C2A | H15 | 59.8° | 150.0° |
| C2 | C3 | O3 | H21 | 0.9° | 90.0° |
| O3 | C3 | C2 | C2A | 0.2° | 0.0° |
| C2 | C2A | H13 | H14 | 120.0° | 120.1° |
| C2 | C2A | H13 | H15 | 120.0° | 120.0° |
| C2 | C2A | H14 | H15 | 120.0° | 119.9° |
| O | C | CA | H3 | 39.8° | 120.0° |
| O | C | OT | H22 | 0.0° | 0.0° |
| CB | CG | CD | H5 | 120.2° | 119.9° |
| CB | CG | CD | H6 | 120.2° | 120.0° |
| CG | CB | OB | H4 | 118.8° | 120.0° |
| CG | CB | CA | H3 | 28.8° | 65.0° |
| CB | CG | H5 | H6 | 119.5° | 120.1° |
| CG | CB | OB | H9 | 56.4° | 60.0° |
| CB | CG | CD | H10 | 180.0° | 180.0° |
| CB | CG | CD | H11 | 60.0° | 60.0° |
| CB | CG | CD | H12 | 60.0° | 59.9° |
| CD | CG | CB | OB | 115.8° | 65.0° |
| CD | CG | CB | H4 | 3.8° | 55.0° |
| CD | CG | H5 | H6 | 119.5° | 120.0° |
| CG | CD | H10 | H11 | 120.0° | 119.9° |
| CG | CD | H10 | H12 | 120.0° | 120.0° |
| CG | CD | H11 | H12 | 120.0° | 120.0° |
| OT | C | CA | H3 | 142.0° | 60.0° |
| OB | CB | CA | H3 | 94.0° | 175.0° |
| OB | CB | CG | H5 | 124.0° | 175.1° |
| OB | CB | CG | H6 | 4.4° | 55.0° |
| H3 | CA | CB | H4 | 147.6° | 55.1° |
| H3 | CA | N | H7 | 136.5° | 88.9° |
| H4 | CB | CG | H5 | 116.4° | 64.9° |
| H4 | CB | CG | H6 | 123.9° | 175.0° |
| H4 | CB | OB | H9 | 62.4° | 180.0° |
| H5 | CG | CD | H10 | 59.8° | 60.1° |
| H5 | CG | CD | H11 | 179.8° | 180.0° |
| H5 | CG | CD | H12 | 60.2° | 60.0° |
| H6 | CG | CD | H10 | 59.9° | 60.0° |
| H6 | CG | CD | H11 | 60.2° | 60.0° |
| H6 | CG | CD | H12 | 179.8° | 180.0° |
| H7 | N | C4A | H16 | 163.6° | 64.0° |
| H7 | N | C4A | H17 | 76.0° | 176.1° |
| H10 | CD | H11 | H12 | 120.0° | 120.1° |
| H13 | C2A | H14 | H15 | 120.0° | 120.0° |
