GXP
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C4 | doub | 1.21Å | 1.26Å | |
| O | C | doub | 1.21Å | 1.23Å | |
| C | C1 | sing | 1.51Å | 1.53Å | |
| C4 | O4 | sing | 1.35Å | 1.25Å | |
| C4 | C3 | sing | 1.49Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.53Å | |
| C2 | C3 | sing | 1.51Å | 1.53Å | |
| C1 | O1 | sing | 1.43Å | 1.45Å | |
| C | H1 | sing | 1.08Å | 1.08Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| O1 | H3 | sing | 0.97Å | 0.95Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| O4 | H7 | sing | 0.97Å | 0.95Å | |
| C3 | O2 | doub | 1.21Å | 44.38Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C4 | O4 | 123.8° | 120.0° |
| O3 | C4 | C3 | 119.5° | 120.0° |
| O | C | C1 | 122.5° | 120.0° |
| O | C | H1 | 118.8° | 120.0° |
| C | C1 | C2 | 110.3° | 109.5° |
| C | C1 | O1 | 112.6° | 109.5° |
| C1 | C | H1 | 118.8° | 120.0° |
| C | C1 | H2 | 107.8° | 109.5° |
| O4 | C4 | C3 | 116.6° | 120.0° |
| C4 | O4 | H7 | 109.5° | 117.0° |
| C4 | C3 | C2 | 114.9° | 120.0° |
| C4 | C3 | O2 | 163.8° | 120.0° |
| C1 | C2 | C3 | 113.3° | 109.5° |
| C2 | C1 | O1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 107.7° | 109.5° |
| C1 | C2 | H4 | 108.5° | 109.5° |
| C1 | C2 | H8 | 108.5° | 109.5° |
| C3 | C2 | H4 | 108.5° | 109.4° |
| C2 | C3 | O2 | 49.5° | 120.0° |
| C3 | C2 | H8 | 108.5° | 109.5° |
| O1 | C1 | H2 | 108.8° | 109.4° |
| C1 | O1 | H3 | 109.5° | 114.0° |
| H4 | C2 | H8 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C4 | O4 | C3 | 178.6° | 180.0° |
| O3 | C4 | C3 | C2 | 3.8° | 0.0° |
| O3 | C4 | O4 | H7 | 0.0° | 0.0° |
| O3 | C4 | C3 | O2 | 18.9° | 180.0° |
| O | C | C1 | H1 | 180.0° | 179.7° |
| O | C | C1 | C2 | 123.4° | 120.0° |
| O | C | C1 | O1 | 0.7° | 0.0° |
| O | C | C1 | H2 | 119.3° | 120.0° |
| C | C1 | C2 | O1 | 124.4° | 120.0° |
| C | C1 | C2 | H2 | 117.4° | 120.0° |
| C | C1 | C2 | C3 | 142.7° | 175.0° |
| C | C1 | O1 | H2 | 119.4° | 120.0° |
| C | C1 | O1 | H3 | 0.4° | 60.0° |
| C | C1 | C2 | H4 | 22.1° | 65.0° |
| C | C1 | C2 | H8 | 96.7° | 54.9° |
| O4 | C4 | C3 | C2 | 174.9° | 180.0° |
| O4 | C4 | C3 | O2 | 159.8° | 0.0° |
| C4 | C3 | C2 | C1 | 92.7° | 180.0° |
| C4 | C3 | C2 | O2 | 174.5° | 180.0° |
| C4 | C3 | C2 | H4 | 27.8° | 60.0° |
| C3 | C4 | O4 | H7 | 178.7° | 180.0° |
| C4 | C3 | C2 | H8 | 146.7° | 60.0° |
| C1 | C2 | C3 | H4 | 120.6° | 120.0° |
| C1 | C2 | C3 | H8 | 120.6° | 120.0° |
| C2 | C1 | O1 | H2 | 117.5° | 120.0° |
| C2 | C1 | C | H1 | 56.6° | 59.7° |
| C2 | C1 | O1 | H3 | 123.5° | 60.1° |
| C1 | C2 | H4 | H8 | 118.3° | 120.0° |
| C1 | C2 | C3 | O2 | 81.8° | 0.0° |
| C3 | C2 | C1 | O1 | 18.3° | 65.0° |
| C3 | C2 | C1 | H2 | 99.9° | 55.0° |
| C3 | C2 | H4 | H8 | 118.2° | 120.0° |
| O1 | C1 | C | H1 | 179.3° | 179.7° |
| O1 | C1 | C2 | H4 | 102.3° | 55.0° |
| O1 | C1 | C2 | H8 | 138.8° | 175.0° |
| H1 | C | C1 | H2 | 60.7° | 60.3° |
| H2 | C1 | O1 | H3 | 119.0° | 180.0° |
| H2 | C1 | C2 | H4 | 139.5° | 175.0° |
| H2 | C1 | C2 | H8 | 20.7° | 65.1° |
| H4 | C2 | C3 | O2 | 157.6° | 120.0° |
| O2 | C3 | C2 | H8 | 38.8° | 120.0° |
