LVW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C5 | C4 | doub | 1.31Å | 1.29Å | |
| C4 | C3 | sing | 1.51Å | 1.48Å | |
| C3 | O1 | sing | 1.43Å | 1.42Å | |
| O1 | C2 | sing | 1.43Å | 1.42Å | |
| C1 | SE | sing | 1.96Å | 1.97Å | |
| C1 | C | sing | 1.53Å | 1.52Å | |
| C2 | C | sing | 1.53Å | 1.51Å | |
| C | O | sing | 1.43Å | 1.43Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| SE | H4 | sing | 1.56Å | 1.46Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C1 | H6 | sing | 1.09Å | 1.10Å | |
| C | H7 | sing | 1.09Å | 1.10Å | |
| O | H8 | sing | 0.97Å | 0.95Å | |
| C2 | H9 | sing | 1.09Å | 1.10Å | |
| C2 | H10 | sing | 1.09Å | 1.10Å | |
| C3 | H11 | sing | 1.09Å | 1.10Å | |
| C3 | H12 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C5 | C4 | C3 | 126.2° | 120.0° |
| C5 | C4 | H1 | 116.9° | 120.0° |
| C4 | C5 | H2 | 120.0° | 120.0° |
| C4 | C5 | H3 | 120.0° | 120.0° |
| C4 | C3 | O1 | 110.0° | 109.5° |
| C3 | C4 | H1 | 116.9° | 120.0° |
| C4 | C3 | H11 | 109.4° | 109.5° |
| C4 | C3 | H12 | 109.4° | 109.5° |
| C3 | O1 | C2 | 113.7° | 114.0° |
| O1 | C3 | H11 | 109.3° | 109.5° |
| O1 | C3 | H12 | 109.3° | 109.5° |
| O1 | C2 | C | 111.0° | 109.5° |
| O1 | C2 | H9 | 109.1° | 109.5° |
| O1 | C2 | H10 | 109.1° | 109.4° |
| SE | C1 | C | 97.7° | 109.5° |
| C1 | SE | H4 | 109.5° | 101.0° |
| SE | C1 | H5 | 112.3° | 109.5° |
| SE | C1 | H6 | 112.3° | 109.5° |
| C1 | C | C2 | 112.5° | 109.5° |
| C1 | C | O | 104.3° | 109.4° |
| C | C1 | H5 | 112.3° | 109.4° |
| C | C1 | H6 | 112.3° | 109.5° |
| C1 | C | H7 | 109.8° | 109.5° |
| C2 | C | O | 109.2° | 109.5° |
| C2 | C | H7 | 109.9° | 109.5° |
| C | C2 | H9 | 109.1° | 109.5° |
| C | C2 | H10 | 109.1° | 109.5° |
| O | C | H7 | 111.1° | 109.4° |
| C | O | H8 | 109.5° | 114.0° |
| H2 | C5 | H3 | 119.9° | 120.0° |
| H5 | C1 | H6 | 109.5° | 109.5° |
| H9 | C2 | H10 | 109.5° | 109.4° |
| H11 | C3 | H12 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C5 | C4 | C3 | H1 | 180.0° | 179.7° |
| C5 | C4 | C3 | O1 | 33.0° | 134.7° |
| C4 | C5 | H2 | H3 | 180.0° | 179.9° |
| C5 | C4 | C3 | H11 | 87.0° | 105.3° |
| C5 | C4 | C3 | H12 | 153.1° | 14.7° |
| C4 | C3 | O1 | H11 | 120.1° | 120.0° |
| C4 | C3 | O1 | H12 | 120.1° | 120.0° |
| C4 | C3 | O1 | C2 | 173.1° | 180.0° |
| C3 | C4 | C5 | H2 | 180.0° | 180.0° |
| C3 | C4 | C5 | H3 | 0.0° | 0.0° |
| C4 | C3 | H11 | H12 | 119.8° | 120.0° |
| C3 | O1 | C2 | C | 102.8° | 180.0° |
| O1 | C3 | C4 | H1 | 147.0° | 45.0° |
| C3 | O1 | C2 | H9 | 137.0° | 60.0° |
| C3 | O1 | C2 | H10 | 17.4° | 60.0° |
| O1 | C3 | H11 | H12 | 119.7° | 120.0° |
| O1 | C2 | C | C1 | 40.0° | 175.0° |
| O1 | C2 | C | H9 | 120.3° | 120.0° |
| O1 | C2 | C | H10 | 120.2° | 120.0° |
| O1 | C2 | C | O | 155.3° | 65.0° |
| O1 | C2 | C | H7 | 82.6° | 55.0° |
| O1 | C2 | H9 | H10 | 119.3° | 119.9° |
| C2 | O1 | C3 | H11 | 66.8° | 60.0° |
| C2 | O1 | C3 | H12 | 53.0° | 60.0° |
| SE | C1 | C | H5 | 118.1° | 119.9° |
| SE | C1 | C | H6 | 118.0° | 120.1° |
| SE | C1 | C | C2 | 163.5° | 175.0° |
| SE | C1 | C | O | 78.2° | 65.0° |
| SE | C1 | H5 | H6 | 125.5° | 120.1° |
| SE | C1 | C | H7 | 40.8° | 54.9° |
| C1 | C | C2 | O | 115.3° | 120.0° |
| C1 | C | C2 | H7 | 122.6° | 120.0° |
| C1 | C | O | H7 | 118.2° | 120.0° |
| C | C1 | SE | H4 | 180.0° | 180.0° |
| C | C1 | H5 | H6 | 125.5° | 120.0° |
| C1 | C | O | H8 | 180.0° | 60.1° |
| C1 | C | C2 | H9 | 160.2° | 55.0° |
| C1 | C | C2 | H10 | 80.2° | 65.0° |
| C2 | C | O | H7 | 121.4° | 120.0° |
| C2 | C | C1 | H5 | 45.5° | 55.0° |
| C2 | C | C1 | H6 | 78.4° | 65.0° |
| C2 | C | O | H8 | 59.5° | 60.0° |
| C | C2 | H9 | H10 | 119.3° | 120.0° |
| O | C | C1 | H5 | 163.7° | 175.1° |
| O | C | C1 | H6 | 39.8° | 55.1° |
| O | C | C2 | H9 | 84.4° | 175.0° |
| O | C | C2 | H10 | 35.1° | 55.0° |
| H1 | C4 | C5 | H2 | 0.0° | 0.3° |
| H1 | C4 | C5 | H3 | 180.0° | 179.7° |
| H1 | C4 | C3 | H11 | 93.0° | 75.1° |
| H1 | C4 | C3 | H12 | 26.9° | 164.9° |
| H4 | SE | C1 | H5 | 62.0° | 60.1° |
| H4 | SE | C1 | H6 | 61.9° | 60.0° |
| H5 | C1 | C | H7 | 77.2° | 65.0° |
| H6 | C1 | C | H7 | 158.9° | 175.0° |
| H7 | C | O | H8 | 61.8° | 180.0° |
| H7 | C | C2 | H9 | 37.6° | 65.0° |
| H7 | C | C2 | H10 | 157.1° | 175.0° |
