12W
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C25 | O27 | sing | 1.35Å | 1.36Å | |
| C25 | O26 | doub | 1.21Å | 1.23Å | |
| O27 | C28 | sing | 1.45Å | 1.46Å | |
| C29 | C28 | sing | 1.54Å | 1.54Å | |
| C29 | C30 | sing | 1.55Å | 1.53Å | |
| C28 | C32 | sing | 1.54Å | 1.52Å | |
| C30 | C31 | sing | 1.55Å | 1.52Å | |
| C31 | C32 | sing | 1.54Å | 1.51Å | |
| C28 | H26 | sing | 1.09Å | 1.10Å | |
| C29 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H28 | sing | 1.09Å | 1.10Å | |
| C30 | H29 | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H33 | sing | 1.09Å | 1.10Å | |
| C32 | H34 | sing | 1.09Å | 1.10Å | |
| C25 | OXT | sing | 1.35Å | 56.66Å | |
| OXT | HXT | sing | 0.97Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O27 | C25 | O26 | 125.8° | 120.0° |
| C25 | O27 | C28 | 116.6° | 117.0° |
| O27 | C25 | OXT | 48.3° | 120.0° |
| O26 | C25 | OXT | 85.8° | 120.0° |
| O27 | C28 | C29 | 112.4° | 110.0° |
| O27 | C28 | C32 | 110.9° | 110.0° |
| O27 | C28 | H26 | 110.8° | 110.0° |
| C28 | C29 | C30 | 105.3° | 104.2° |
| C29 | C28 | C32 | 102.7° | 106.6° |
| C29 | C28 | H26 | 109.7° | 110.1° |
| C28 | C29 | H27 | 110.5° | 110.5° |
| C28 | C29 | H28 | 110.5° | 110.5° |
| C29 | C30 | C31 | 106.2° | 102.8° |
| C30 | C29 | H27 | 110.5° | 110.4° |
| C30 | C29 | H28 | 110.5° | 110.5° |
| C29 | C30 | H29 | 110.3° | 110.8° |
| C29 | C30 | H30 | 110.3° | 110.8° |
| C28 | C32 | C31 | 102.3° | 106.6° |
| C32 | C28 | H26 | 110.0° | 110.0° |
| C28 | C32 | H33 | 111.2° | 110.0° |
| C28 | C32 | H34 | 111.3° | 110.1° |
| C30 | C31 | C32 | 103.3° | 104.2° |
| C31 | C30 | H29 | 110.3° | 110.8° |
| C31 | C30 | H30 | 110.3° | 110.7° |
| C30 | C31 | H31 | 111.0° | 110.4° |
| C30 | C31 | H32 | 111.0° | 110.5° |
| C32 | C31 | H31 | 111.0° | 110.5° |
| C32 | C31 | H32 | 111.0° | 110.5° |
| C31 | C32 | H33 | 111.2° | 110.0° |
| C31 | C32 | H34 | 111.2° | 110.0° |
| H27 | C29 | H28 | 109.5° | 110.6° |
| H29 | C30 | H30 | 109.5° | 110.8° |
| H31 | C31 | H32 | 109.5° | 110.6° |
| H33 | C32 | H34 | 109.5° | 110.1° |
| C25 | OXT | HXT | 90.0° | 117.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O27 | C25 | O26 | OXT | 29.0° | 179.8° |
| C25 | O27 | C28 | C29 | 145.8° | 92.8° |
| C25 | O27 | C28 | C32 | 99.9° | 150.0° |
| C25 | O27 | C28 | H26 | 22.6° | 28.7° |
| O27 | C25 | OXT | HXT | 90.0° | 180.0° |
| O26 | C25 | O27 | C28 | 1.6° | 0.0° |
| O26 | C25 | OXT | HXT | 90.0° | 0.3° |
| O27 | C28 | C29 | C32 | 119.3° | 119.2° |
| O27 | C28 | C29 | H26 | 123.8° | 121.5° |
| O27 | C28 | C29 | C30 | 91.9° | 142.9° |
| O27 | C28 | C32 | H26 | 123.0° | 121.4° |
| O27 | C28 | C32 | C31 | 76.8° | 119.3° |
| O27 | C28 | C29 | H27 | 27.4° | 24.2° |
| O27 | C28 | C29 | H28 | 148.8° | 98.5° |
| O27 | C28 | C32 | H33 | 164.4° | 121.5° |
| O27 | C28 | C32 | H34 | 42.0° | 0.0° |
| C28 | O27 | C25 | OXT | 41.9° | 179.8° |
| C28 | C29 | C30 | H27 | 119.4° | 118.7° |
| C28 | C29 | C30 | H28 | 119.3° | 118.6° |
| C29 | C28 | C32 | H26 | 116.7° | 119.4° |
| C28 | C29 | C30 | C31 | 1.2° | 37.9° |
| C29 | C28 | C32 | C31 | 43.4° | 0.0° |
| C28 | C29 | H27 | H28 | 122.0° | 122.6° |
| C28 | C29 | C30 | H29 | 118.3° | 156.3° |
| C28 | C29 | C30 | H30 | 120.7° | 80.3° |
| C29 | C28 | C32 | H33 | 75.4° | 119.3° |
| C29 | C28 | C32 | H34 | 162.3° | 119.3° |
| C30 | C29 | C28 | C32 | 27.4° | 23.6° |
| C29 | C30 | C31 | H29 | 119.5° | 118.3° |
| C29 | C30 | C31 | H30 | 119.5° | 118.3° |
| C29 | C30 | C31 | C32 | 25.6° | 37.9° |
| C30 | C29 | C28 | H26 | 144.3° | 95.7° |
| C30 | C29 | H27 | H28 | 121.9° | 122.6° |
| C29 | C30 | H29 | H30 | 121.5° | 123.4° |
| C29 | C30 | C31 | H31 | 93.5° | 80.7° |
| C29 | C30 | C31 | H32 | 144.6° | 156.6° |
| C28 | C32 | C31 | C30 | 42.8° | 23.5° |
| C28 | C32 | C31 | H33 | 118.8° | 119.2° |
| C28 | C32 | C31 | H34 | 118.8° | 119.3° |
| C32 | C28 | C29 | H27 | 146.7° | 95.0° |
| C32 | C28 | C29 | H28 | 91.9° | 142.3° |
| C28 | C32 | C31 | H31 | 76.2° | 95.1° |
| C28 | C32 | C31 | H32 | 161.8° | 142.3° |
| C28 | C32 | H33 | H34 | 123.4° | 121.5° |
| C30 | C31 | C32 | H31 | 119.0° | 118.6° |
| C30 | C31 | C32 | H32 | 119.0° | 118.7° |
| C31 | C30 | C29 | H27 | 120.6° | 80.8° |
| C31 | C30 | C29 | H28 | 118.1° | 156.6° |
| C31 | C30 | H29 | H30 | 121.5° | 123.3° |
| C30 | C31 | H31 | H32 | 122.8° | 122.6° |
| C30 | C31 | C32 | H33 | 76.0° | 95.7° |
| C30 | C31 | C32 | H34 | 161.7° | 142.9° |
| C31 | C32 | C28 | H26 | 160.2° | 119.3° |
| C32 | C31 | C30 | H29 | 145.0° | 156.2° |
| C32 | C31 | C30 | H30 | 93.9° | 80.4° |
| C32 | C31 | H31 | H32 | 122.9° | 122.7° |
| C31 | C32 | H33 | H34 | 123.3° | 121.4° |
| H26 | C28 | C29 | H27 | 96.4° | 145.7° |
| H26 | C28 | C29 | H28 | 25.0° | 23.0° |
| H26 | C28 | C32 | H33 | 41.4° | 0.1° |
| H26 | C28 | C32 | H34 | 81.0° | 121.4° |
| H27 | C29 | C30 | H29 | 1.1° | 37.5° |
| H27 | C29 | C30 | H30 | 120.0° | 161.0° |
| H28 | C29 | C30 | H29 | 122.4° | 85.1° |
| H28 | C29 | C30 | H30 | 1.3° | 38.3° |
| H29 | C30 | C31 | H31 | 26.0° | 37.6° |
| H29 | C30 | C31 | H32 | 96.0° | 85.0° |
| H30 | C30 | C31 | H31 | 147.1° | 161.0° |
| H30 | C30 | C31 | H32 | 25.1° | 38.3° |
| H31 | C31 | C32 | H33 | 165.0° | 145.7° |
| H31 | C31 | C32 | H34 | 42.7° | 24.3° |
| H32 | C31 | C32 | H33 | 43.0° | 23.0° |
| H32 | C31 | C32 | H34 | 79.3° | 98.4° |
