MEV
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C8 | O8 | sing | 1.43Å | 1.43Å | |
| C8 | C2 | sing | 1.53Å | 1.54Å | |
| C8 | H81 | sing | 1.09Å | 1.11Å | |
| C8 | H82 | sing | 1.09Å | 1.12Å | |
| O8 | HX2 | sing | 0.97Å | 0.95Å | |
| C2 | C3 | sing | 1.53Å | 1.55Å | |
| C2 | H21 | sing | 1.09Å | 1.12Å | |
| C2 | H22 | sing | 1.09Å | 1.11Å | |
| C3 | O7 | sing | 1.43Å | 1.43Å | |
| C3 | C4 | sing | 1.53Å | 1.55Å | |
| C3 | C6 | sing | 1.53Å | 1.54Å | |
| O7 | HX | sing | 0.97Å | 0.95Å | |
| C4 | C5 | sing | 1.51Å | 1.53Å | |
| C4 | H41 | sing | 1.09Å | 1.11Å | |
| C4 | H42 | sing | 1.09Å | 1.11Å | |
| C5 | O3 | doub | 1.28Å | 1.25Å | |
| C5 | O4 | sing | 1.28Å | 1.25Å | |
| C6 | H61 | sing | 1.09Å | 1.12Å | |
| C6 | H62 | sing | 1.09Å | 1.11Å | |
| C6 | H63 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O8 | C8 | C2 | 110.0° | 109.5° |
| O8 | C8 | H81 | 112.0° | 109.5° |
| O8 | C8 | H82 | 112.0° | 109.5° |
| C8 | O8 | HX2 | 110.1° | 106.8° |
| C2 | C8 | H81 | 112.0° | 109.4° |
| C2 | C8 | H82 | 112.0° | 109.5° |
| C8 | C2 | C3 | 114.1° | 109.5° |
| C8 | C2 | H21 | 110.5° | 109.4° |
| C8 | C2 | H22 | 110.5° | 109.5° |
| H81 | C8 | H82 | 98.4° | 109.5° |
| C3 | C2 | H21 | 110.5° | 109.5° |
| C3 | C2 | H22 | 110.5° | 109.5° |
| C2 | C3 | O7 | 109.7° | 109.4° |
| C2 | C3 | C4 | 107.0° | 109.5° |
| C2 | C3 | C6 | 109.0° | 109.5° |
| H21 | C2 | H22 | 99.8° | 109.4° |
| O7 | C3 | C4 | 111.0° | 109.5° |
| O7 | C3 | C6 | 108.0° | 109.4° |
| C3 | O7 | HX | 109.7° | 106.8° |
| C4 | C3 | C6 | 112.1° | 109.4° |
| C3 | C4 | C5 | 116.9° | 109.5° |
| C3 | C4 | H41 | 109.5° | 109.4° |
| C3 | C4 | H42 | 109.5° | 109.5° |
| C3 | C6 | H61 | 109.0° | 109.5° |
| C3 | C6 | H62 | 112.4° | 109.5° |
| C3 | C6 | H63 | 112.4° | 109.5° |
| C5 | C4 | H41 | 109.5° | 109.5° |
| C5 | C4 | H42 | 109.5° | 109.5° |
| C4 | C5 | O3 | 119.8° | 120.0° |
| C4 | C5 | O4 | 118.3° | 120.0° |
| H41 | C4 | H42 | 100.7° | 109.5° |
| O3 | C5 | O4 | 121.9° | 120.0° |
| H61 | C6 | H62 | 112.4° | 109.4° |
| H61 | C6 | H63 | 112.3° | 109.5° |
| H62 | C6 | H63 | 98.0° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O8 | C8 | C2 | H81 | 125.3° | 120.0° |
| O8 | C8 | C2 | H82 | 125.3° | 120.0° |
| O8 | C8 | H81 | H82 | 117.9° | 120.0° |
| O8 | C8 | C2 | C3 | 145.3° | 180.0° |
| O8 | C8 | C2 | H21 | 20.1° | 60.0° |
| O8 | C8 | C2 | H22 | 89.4° | 60.0° |
| C2 | C8 | H81 | H82 | 117.9° | 120.0° |
| C2 | C8 | O8 | HX2 | 180.0° | 180.0° |
| C8 | C2 | C3 | H21 | 125.2° | 120.0° |
| C8 | C2 | C3 | H22 | 125.3° | 120.0° |
| C8 | C2 | H21 | H22 | 116.4° | 120.0° |
| C8 | C2 | C3 | O7 | 174.2° | 65.0° |
| C8 | C2 | C3 | C4 | 53.8° | 175.0° |
| C8 | C2 | C3 | C6 | 67.7° | 55.0° |
| H81 | C8 | O8 | HX2 | 54.7° | 60.0° |
| H81 | C8 | C2 | C3 | 89.4° | 60.0° |
| H81 | C8 | C2 | H21 | 145.4° | 180.0° |
| H81 | C8 | C2 | H22 | 35.9° | 60.1° |
| H82 | C8 | O8 | HX2 | 54.7° | 60.0° |
| H82 | C8 | C2 | C3 | 20.1° | 60.0° |
| H82 | C8 | C2 | H21 | 105.2° | 60.0° |
| H82 | C8 | C2 | H22 | 145.3° | 180.0° |
| C3 | C2 | H21 | H22 | 116.4° | 120.0° |
| C2 | C3 | O7 | C4 | 118.0° | 120.0° |
| C2 | C3 | O7 | C6 | 118.7° | 120.0° |
| C2 | C3 | C4 | C6 | 119.5° | 120.1° |
| C2 | C3 | O7 | HX | 180.0° | 60.0° |
| C2 | C3 | C4 | C5 | 171.7° | 180.0° |
| C2 | C3 | C4 | H41 | 63.1° | 59.9° |
| C2 | C3 | C4 | H42 | 46.4° | 60.0° |
| C2 | C3 | C6 | H61 | 180.0° | 180.0° |
| C2 | C3 | C6 | H62 | 54.7° | 60.0° |
| C2 | C3 | C6 | H63 | 54.8° | 59.9° |
| H21 | C2 | C3 | O7 | 60.5° | 175.0° |
| H21 | C2 | C3 | C4 | 179.0° | 55.0° |
| H21 | C2 | C3 | C6 | 57.5° | 65.0° |
| H22 | C2 | C3 | O7 | 49.0° | 55.0° |
| H22 | C2 | C3 | C4 | 71.5° | 65.0° |
| H22 | C2 | C3 | C6 | 167.0° | 175.0° |
| O7 | C3 | C4 | C6 | 120.9° | 119.9° |
| O7 | C3 | C4 | C5 | 68.7° | 60.0° |
| O7 | C3 | C4 | H41 | 56.5° | 60.0° |
| O7 | C3 | C4 | H42 | 166.1° | 180.0° |
| O7 | C3 | C6 | H61 | 60.9° | 60.0° |
| O7 | C3 | C6 | H62 | 173.8° | 180.0° |
| O7 | C3 | C6 | H63 | 64.3° | 60.0° |
| C4 | C3 | O7 | HX | 62.0° | 60.0° |
| C3 | C4 | C5 | H41 | 125.2° | 120.0° |
| C3 | C4 | C5 | H42 | 125.2° | 120.0° |
| C3 | C4 | H41 | H42 | 115.3° | 119.9° |
| C3 | C4 | C5 | O3 | 46.3° | 0.0° |
| C3 | C4 | C5 | O4 | 134.9° | 180.0° |
| C4 | C3 | C6 | H61 | 61.7° | 59.9° |
| C4 | C3 | C6 | H62 | 63.6° | 60.0° |
| C4 | C3 | C6 | H63 | 173.1° | 180.0° |
| C6 | C3 | O7 | HX | 61.3° | 180.0° |
| C6 | C3 | C4 | C5 | 52.1° | 60.0° |
| C6 | C3 | C4 | H41 | 177.4° | 180.0° |
| C6 | C3 | C4 | H42 | 73.1° | 60.1° |
| C3 | C6 | H61 | H62 | 125.3° | 120.0° |
| C3 | C6 | H61 | H63 | 125.2° | 120.1° |
| C3 | C6 | H62 | H63 | 118.3° | 120.0° |
| C5 | C4 | H41 | H42 | 115.3° | 120.0° |
| C4 | C5 | O3 | O4 | 178.7° | 179.9° |
| H41 | C4 | C5 | O3 | 78.9° | 120.0° |
| H41 | C4 | C5 | O4 | 99.9° | 60.1° |
| H42 | C4 | C5 | O3 | 171.6° | 120.0° |
| H42 | C4 | C5 | O4 | 9.7° | 59.9° |
| H61 | C6 | H62 | H63 | 118.2° | 120.0° |
