FM4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| P | O1P | sing | 1.61Å | 1.46Å | |
| P | O2P | sing | 1.61Å | 1.66Å | |
| C1 | O | sing | 1.43Å | 1.49Å | |
| C1 | P | sing | 1.82Å | 1.85Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | O | sing | 1.43Å | 1.39Å | |
| C2 | C1 | sing | 1.53Å | 1.59Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O2 | P2 | doub | 1.48Å | 1.62Å | |
| P2 | O3 | sing | 1.61Å | 1.59Å | |
| C3 | C2 | sing | 1.53Å | 1.58Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| C3 | H3B | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| O4 | P2 | sing | 1.61Å | 1.58Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| O1P | HO1P | sing | 0.97Å | 0.95Å | |
| O2P | P2 | sing | 1.61Å | 1.72Å | |
| O3P | P | doub | 1.48Å | 1.59Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1P | P | O2P | 108.6° | 109.5° |
| O1P | P | C1 | 97.4° | 109.4° |
| P | O1P | HO1P | 109.5° | 114.0° |
| O1P | P | O3P | 112.4° | 109.5° |
| O2P | P | C1 | 115.9° | 109.4° |
| P | O2P | P2 | 151.3° | 134.0° |
| O2P | P | O3P | 112.3° | 109.5° |
| O | C1 | P | 113.2° | 117.8° |
| O | C1 | H1 | 147.5° | 117.8° |
| C1 | O | C2 | 67.0° | 64.7° |
| O | C1 | C2 | 53.6° | 57.6° |
| P | C1 | H1 | 86.6° | 115.7° |
| P | C1 | C2 | 133.5° | 117.8° |
| C1 | P | O3P | 109.4° | 109.4° |
| H1 | C1 | C2 | 129.5° | 117.8° |
| O | C2 | C1 | 59.4° | 57.6° |
| O | C2 | H2 | 142.2° | 117.7° |
| O | C2 | C3 | 122.5° | 117.8° |
| C1 | C2 | H2 | 130.2° | 117.8° |
| C1 | C2 | C3 | 135.8° | 117.8° |
| H2 | C2 | C3 | 78.0° | 115.7° |
| O2 | P2 | O3 | 109.8° | 109.5° |
| O2 | P2 | O4 | 110.3° | 109.5° |
| O2 | P2 | O2P | 123.0° | 109.4° |
| P2 | O3 | HO3 | 109.5° | 114.0° |
| O3 | P2 | O4 | 113.3° | 109.5° |
| O3 | P2 | O2P | 115.3° | 109.5° |
| C2 | C3 | H3 | 109.5° | 109.4° |
| C2 | C3 | H3A | 109.4° | 109.4° |
| C2 | C3 | H3B | 109.5° | 109.4° |
| H3 | C3 | H3A | 109.5° | 109.5° |
| H3 | C3 | H3B | 109.4° | 109.5° |
| H3A | C3 | H3B | 109.5° | 109.5° |
| P2 | O4 | HO4 | 109.5° | 114.0° |
| O4 | P2 | O2P | 82.0° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1P | P | O2P | C1 | 108.3° | 120.0° |
| O1P | P | O2P | O3P | 125.0° | 120.1° |
| O1P | P | C1 | O | 21.3° | 8.6° |
| O1P | P | C1 | O3P | 117.0° | 120.0° |
| O1P | P | C1 | H1 | 174.6° | 155.6° |
| O1P | P | C1 | C2 | 39.9° | 57.4° |
| O1P | P | O2P | P2 | 114.4° | 60.0° |
| O2P | P | C1 | O | 93.6° | 111.4° |
| O2P | P | C1 | O3P | 128.2° | 120.0° |
| O2P | P | C1 | H1 | 59.8° | 35.5° |
| O2P | P | C1 | C2 | 154.7° | 177.4° |
| P | O2P | P2 | O2 | 33.8° | 45.0° |
| P | O2P | P2 | O3 | 105.1° | 75.0° |
| P | O2P | P2 | O4 | 142.8° | 165.0° |
| O2P | P | O1P | HO1P | 124.9° | 60.0° |
| O | C1 | P | H1 | 153.4° | 147.0° |
| O | C1 | P | C2 | 61.2° | 66.0° |
| O | C1 | H1 | C2 | 82.2° | 66.0° |
| O | C1 | C2 | H2 | 134.6° | 106.8° |
| C1 | O | C2 | C3 | 127.6° | 106.9° |
| O | C1 | P | O3P | 138.2° | 128.6° |
| P | C1 | H1 | C2 | 147.8° | 147.0° |
| P | C1 | C2 | H2 | 136.7° | 146.3° |
| P | C1 | C2 | C3 | 18.1° | 0.0° |
| C1 | P | O1P | HO1P | 114.6° | 60.0° |
| C1 | P | O2P | P2 | 137.4° | 180.0° |
| H1 | C1 | C2 | H2 | 4.0° | 0.0° |
| H1 | C1 | C2 | C3 | 114.6° | 146.4° |
| H1 | C1 | P | O3P | 68.4° | 84.4° |
| O | C2 | H2 | C3 | 128.6° | 146.9° |
| O | C2 | C3 | H3 | 180.0° | 8.7° |
| O | C2 | C3 | H3A | 60.0° | 128.6° |
| O | C2 | C3 | H3B | 60.0° | 111.4° |
| C1 | C2 | H2 | C3 | 141.3° | 147.1° |
| C1 | C2 | C3 | H3 | 102.1° | 57.4° |
| C1 | C2 | C3 | H3A | 137.9° | 62.6° |
| C1 | C2 | C3 | H3B | 17.9° | 177.4° |
| C2 | C1 | P | O3P | 77.1° | 62.6° |
| H2 | C2 | C3 | H3 | 34.6° | 155.6° |
| H2 | C2 | C3 | H3A | 85.4° | 84.5° |
| H2 | C2 | C3 | H3B | 154.6° | 35.5° |
| O2 | P2 | O3 | O4 | 123.8° | 120.0° |
| O2 | P2 | O3 | O2P | 144.1° | 119.9° |
| O2 | P2 | O3 | HO3 | 0.0° | 180.0° |
| O2 | P2 | O4 | O2P | 122.3° | 120.0° |
| O2 | P2 | O4 | HO4 | 0.0° | 60.1° |
| O3 | P2 | O4 | O2P | 114.2° | 120.0° |
| O3 | P2 | O4 | HO4 | 123.5° | 59.9° |
| C2 | C3 | H3 | H3A | 120.0° | 119.9° |
| C2 | C3 | H3 | H3B | 120.0° | 120.0° |
| C2 | C3 | H3A | H3B | 120.0° | 120.0° |
| H3 | C3 | H3A | H3B | 120.0° | 120.1° |
| HO3 | O3 | P2 | O4 | 123.7° | 60.0° |
| HO3 | O3 | P2 | O2P | 144.1° | 60.0° |
| HO4 | O4 | P2 | O2P | 122.3° | 180.0° |
| HO1P | O1P | P | O3P | 0.0° | 180.0° |
| P2 | O2P | P | O3P | 10.6° | 60.1° |






