A1EIW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C26 | sing | 1.53Å | 1.52Å | |
| O10 | C24 | doub | 1.21Å | 1.22Å | |
| C26 | C25 | sing | 1.53Å | 1.52Å | |
| C24 | O8 | sing | 1.35Å | 1.36Å | |
| C24 | C25 | sing | 1.51Å | 1.38Å | |
| O8 | C23 | sing | 1.45Å | 1.42Å | |
| C25 | O9 | sing | 1.43Å | 1.39Å | |
| C25 | C21 | sing | 1.51Å | 1.36Å | |
| C23 | C22 | sing | 1.51Å | 1.36Å | |
| C21 | C22 | doub | 1.36Å | 1.36Å | |
| C21 | C20 | sing | 1.40Å | 1.39Å | |
| C22 | C28 | sing | 1.41Å | 1.36Å | |
| C20 | C6A | doub | 1.38Å | 1.33Å | |
| C28 | O11 | doub | 1.22Å | 1.22Å | |
| C28 | N1 | sing | 1.35Å | 1.29Å | |
| C6A | N1 | sing | 1.37Å | 1.31Å | |
| C6A | C7 | sing | 1.48Å | 1.33Å | |
| N1 | C5A | sing | 1.47Å | 1.41Å | |
| C7 | N2 | doub | 1.32Å | 1.33Å | Aromatic |
| C7 | C4A | sing | 1.41Å | 1.33Å | Aromatic |
| C5A | C4A | sing | 1.51Å | 1.37Å | |
| N2 | C8 | sing | 1.33Å | 1.32Å | Aromatic |
| C4A | C3A | doub | 1.36Å | 1.31Å | Aromatic |
| C8 | C19 | sing | 1.41Å | 1.37Å | Aromatic |
| C8 | C9 | doub | 1.42Å | 1.37Å | Aromatic |
| C19 | C18 | doub | 1.36Å | 1.38Å | Aromatic |
| C3A | C9 | sing | 1.41Å | 1.38Å | Aromatic |
| C3A | C2A | sing | 1.51Å | 1.38Å | |
| C9 | C10 | sing | 1.40Å | 1.38Å | Aromatic |
| C2A | C1A | sing | 1.53Å | 1.50Å | |
| C18 | C11 | sing | 1.40Å | 1.38Å | Aromatic |
| C10 | C11 | doub | 1.37Å | 1.38Å | Aromatic |
| C11 | O1 | sing | 1.36Å | 1.36Å | |
| O1 | C1 | sing | 1.43Å | 1.42Å | |
| C1 | O5 | sing | 1.43Å | 1.41Å | |
| C1 | C2 | sing | 1.53Å | 1.50Å | |
| O2 | C2 | sing | 1.43Å | 1.41Å | |
| O5 | C5 | sing | 1.43Å | 1.42Å | |
| C2 | C3 | sing | 1.53Å | 1.47Å | |
| C5 | C6 | sing | 1.51Å | 1.52Å | |
| C5 | C4 | sing | 1.53Å | 1.51Å | |
| C3 | C4 | sing | 1.53Å | 1.49Å | |
| C3 | O3 | sing | 1.43Å | 1.42Å | |
| C6 | O6A | doub | 1.21Å | 1.25Å | |
| C6 | O6B | sing | 1.34Å | 1.25Å | |
| C4 | O4 | sing | 1.43Å | 1.43Å | |
| C1A | H1A | sing | 1.09Å | 1.10Å | |
| C1A | H2A | sing | 1.09Å | 1.10Å | |
| C1A | H3A | sing | 1.09Å | 1.10Å | |
| C2A | H4A | sing | 1.09Å | 1.10Å | |
| C2A | H5A | sing | 1.09Å | 1.10Å | |
| C5A | H6 | sing | 1.09Å | 1.10Å | |
| O3 | HO3 | sing | 0.97Å | 0.95Å | |
| O4 | HO4 | sing | 0.97Å | 0.95Å | |
| O6B | HO6B | sing | 0.97Å | 0.95Å | |
| C23 | H11 | sing | 1.09Å | 1.10Å | |
| C23 | H12 | sing | 1.09Å | 1.10Å | |
| C26 | H13 | sing | 1.09Å | 1.10Å | |
| C26 | H14 | sing | 1.09Å | 1.10Å | |
| C27 | H15 | sing | 1.09Å | 1.10Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| O9 | H18 | sing | 0.97Å | 0.95Å | |
| C20 | H19 | sing | 1.08Å | 1.08Å | |
| C19 | H20 | sing | 1.08Å | 1.08Å | |
| C18 | H21 | sing | 1.08Å | 1.08Å | |
| C10 | H22 | sing | 1.08Å | 1.08Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| O2 | HO2 | sing | 0.97Å | 0.95Å | |
| C5A | H29 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C27 | C26 | C25 | 109.0° | 109.5° |
| C27 | C26 | H13 | 109.6° | 109.5° |
| C27 | C26 | H14 | 109.6° | 109.5° |
| C26 | C27 | H15 | 109.5° | 109.5° |
| C26 | C27 | H16 | 109.5° | 109.5° |
| C26 | C27 | H17 | 109.5° | 109.5° |
| O10 | C24 | O8 | 121.9° | 121.6° |
| O10 | C24 | C25 | 119.5° | 121.6° |
| C26 | C25 | C24 | 111.5° | 109.6° |
| C26 | C25 | O9 | 106.2° | 109.6° |
| C26 | C25 | C21 | 109.9° | 109.5° |
| C25 | C26 | H13 | 109.6° | 109.5° |
| C25 | C26 | H14 | 109.6° | 109.5° |
| O8 | C24 | C25 | 118.5° | 116.8° |
| C24 | O8 | C23 | 119.8° | 114.8° |
| C24 | C25 | O9 | 108.7° | 109.5° |
| C24 | C25 | C21 | 111.5° | 109.1° |
| O8 | C23 | C22 | 108.4° | 110.7° |
| O8 | C23 | H11 | 109.7° | 109.2° |
| O8 | C23 | H12 | 109.7° | 109.2° |
| O9 | C25 | C21 | 108.9° | 109.5° |
| C25 | O9 | H18 | 109.5° | 114.0° |
| C25 | C21 | C22 | 119.2° | 121.8° |
| C25 | C21 | C20 | 120.7° | 118.7° |
| C23 | C22 | C21 | 120.5° | 122.5° |
| C23 | C22 | C28 | 120.8° | 118.4° |
| C22 | C23 | H11 | 109.7° | 109.2° |
| C22 | C23 | H12 | 109.8° | 109.3° |
| C22 | C21 | C20 | 120.1° | 119.5° |
| C21 | C22 | C28 | 118.6° | 119.1° |
| C21 | C20 | C6A | 118.8° | 120.3° |
| C21 | C20 | H19 | 120.6° | 119.8° |
| C22 | C28 | O11 | 122.3° | 119.6° |
| C22 | C28 | N1 | 117.8° | 120.8° |
| C20 | C6A | N1 | 118.4° | 119.8° |
| C20 | C6A | C7 | 133.2° | 130.4° |
| C6A | C20 | H19 | 120.6° | 119.9° |
| O11 | C28 | N1 | 119.9° | 119.6° |
| C28 | N1 | C6A | 126.3° | 120.6° |
| C28 | N1 | C5A | 123.9° | 130.8° |
| N1 | C6A | C7 | 108.3° | 109.8° |
| C6A | N1 | C5A | 109.8° | 108.7° |
| C6A | C7 | N2 | 129.9° | 131.1° |
| C6A | C7 | C4A | 109.3° | 108.2° |
| N1 | C5A | C4A | 103.2° | 106.5° |
| N1 | C5A | H6 | 111.0° | 110.0° |
| N1 | C5A | H29 | 111.0° | 110.1° |
| N2 | C7 | C4A | 120.7° | 120.8° |
| C7 | N2 | C8 | 120.2° | 121.5° |
| C7 | C4A | C5A | 109.3° | 106.8° |
| C7 | C4A | C3A | 121.2° | 120.5° |
| C5A | C4A | C3A | 129.4° | 132.7° |
| C4A | C5A | H6 | 111.0° | 110.1° |
| C4A | C5A | H29 | 111.0° | 110.1° |
| N2 | C8 | C19 | 119.7° | 120.8° |
| N2 | C8 | C9 | 119.9° | 120.1° |
| C4A | C3A | C9 | 119.2° | 118.1° |
| C4A | C3A | C2A | 119.4° | 120.9° |
| C19 | C8 | C9 | 120.4° | 119.0° |
| C8 | C19 | C18 | 119.3° | 119.8° |
| C8 | C19 | H20 | 120.3° | 120.1° |
| C8 | C9 | C3A | 118.7° | 119.0° |
| C8 | C9 | C10 | 120.6° | 119.7° |
| C19 | C18 | C11 | 120.4° | 121.0° |
| C18 | C19 | H20 | 120.3° | 120.1° |
| C19 | C18 | H21 | 119.8° | 119.5° |
| C9 | C3A | C2A | 121.4° | 120.9° |
| C3A | C9 | C10 | 120.7° | 121.3° |
| C3A | C2A | C1A | 112.4° | 109.5° |
| C3A | C2A | H4A | 108.8° | 109.5° |
| C3A | C2A | H5A | 108.8° | 109.5° |
| C9 | C10 | C11 | 119.3° | 119.6° |
| C9 | C10 | H22 | 120.3° | 120.2° |
| C2A | C1A | H1A | 109.5° | 109.4° |
| C2A | C1A | H2A | 109.5° | 109.5° |
| C2A | C1A | H3A | 109.5° | 109.5° |
| C1A | C2A | H4A | 108.7° | 109.5° |
| C1A | C2A | H5A | 108.7° | 109.5° |
| C18 | C11 | C10 | 120.0° | 120.7° |
| C18 | C11 | O1 | 119.3° | 119.6° |
| C11 | C18 | H21 | 119.8° | 119.5° |
| C10 | C11 | O1 | 120.7° | 119.7° |
| C11 | C10 | H22 | 120.3° | 120.2° |
| C11 | O1 | C1 | 113.7° | 117.0° |
| O1 | C1 | O5 | 107.9° | 109.5° |
| O1 | C1 | C2 | 108.6° | 109.5° |
| O1 | C1 | H1 | 111.4° | 109.5° |
| O5 | C1 | C2 | 106.9° | 109.4° |
| C1 | O5 | C5 | 109.7° | 114.1° |
| O5 | C1 | H1 | 111.5° | 109.5° |
| C1 | C2 | O2 | 109.7° | 109.5° |
| C1 | C2 | C3 | 107.6° | 109.2° |
| C2 | C1 | H1 | 110.3° | 109.5° |
| C1 | C2 | H2 | 110.2° | 109.5° |
| O2 | C2 | C3 | 106.9° | 109.5° |
| O2 | C2 | H2 | 111.6° | 109.6° |
| C2 | O2 | HO2 | 109.5° | 114.0° |
| O5 | C5 | C6 | 108.3° | 109.5° |
| O5 | C5 | C4 | 110.0° | 109.4° |
| O5 | C5 | H5 | 111.1° | 109.5° |
| C2 | C3 | C4 | 106.5° | 109.0° |
| C2 | C3 | O3 | 107.9° | 109.5° |
| C2 | C3 | H3 | 110.7° | 109.6° |
| C3 | C2 | H2 | 110.6° | 109.6° |
| C6 | C5 | C4 | 107.7° | 109.5° |
| C5 | C6 | O6A | 116.2° | 120.0° |
| C5 | C6 | O6B | 117.3° | 120.0° |
| C6 | C5 | H5 | 109.7° | 109.5° |
| C5 | C4 | C3 | 109.2° | 109.2° |
| C5 | C4 | O4 | 108.8° | 109.6° |
| C4 | C5 | H5 | 109.9° | 109.4° |
| C5 | C4 | H4 | 109.5° | 109.5° |
| C4 | C3 | O3 | 109.9° | 109.5° |
| C3 | C4 | O4 | 109.1° | 109.5° |
| C3 | C4 | H4 | 109.7° | 109.5° |
| C4 | C3 | H3 | 110.3° | 109.5° |
| C3 | O3 | HO3 | 109.5° | 114.0° |
| O3 | C3 | H3 | 111.3° | 109.7° |
| O6A | C6 | O6B | 126.4° | 120.0° |
| C6 | O6B | HO6B | 109.5° | 117.0° |
| C4 | O4 | HO4 | 109.5° | 114.0° |
| O4 | C4 | H4 | 110.6° | 109.5° |
| H1A | C1A | H2A | 109.4° | 109.5° |
| H1A | C1A | H3A | 109.5° | 109.4° |
| H2A | C1A | H3A | 109.5° | 109.5° |
| H4A | C2A | H5A | 109.5° | 109.5° |
| H6 | C5A | H29 | 109.5° | 110.0° |
| H11 | C23 | H12 | 109.4° | 109.3° |
| H13 | C26 | H14 | 109.5° | 109.5° |
| H15 | C27 | H16 | 109.4° | 109.4° |
| H15 | C27 | H17 | 109.5° | 109.5° |
| H16 | C27 | H17 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C27 | C26 | C25 | H13 | 119.9° | 120.0° |
| C27 | C26 | C25 | H14 | 119.9° | 120.0° |
| C27 | C26 | C25 | C24 | 63.7° | 60.2° |
| C27 | C26 | C25 | O9 | 54.5° | 60.0° |
| C27 | C26 | C25 | C21 | 172.1° | 179.9° |
| C27 | C26 | H13 | H14 | 120.2° | 120.0° |
| C26 | C27 | H15 | H16 | 120.0° | 120.0° |
| C26 | C27 | H15 | H17 | 120.0° | 120.0° |
| C26 | C27 | H16 | H17 | 120.0° | 120.0° |
| O10 | C24 | C25 | C26 | 96.2° | 101.3° |
| O10 | C24 | O8 | C25 | 174.4° | 179.9° |
| O10 | C24 | O8 | C23 | 177.8° | 119.4° |
| O10 | C24 | C25 | O9 | 20.5° | 18.9° |
| O10 | C24 | C25 | C21 | 140.5° | 138.8° |
| C26 | C25 | C24 | O8 | 89.3° | 78.8° |
| C26 | C25 | C24 | O9 | 116.7° | 120.2° |
| C26 | C25 | C24 | C21 | 123.3° | 119.9° |
| C26 | C25 | O9 | C21 | 118.3° | 120.1° |
| C26 | C25 | C21 | C22 | 87.7° | 107.6° |
| C26 | C25 | C21 | C20 | 91.4° | 71.7° |
| C25 | C26 | H13 | H14 | 120.3° | 120.0° |
| C25 | C26 | C27 | H15 | 180.0° | 60.0° |
| C25 | C26 | C27 | H16 | 60.0° | 60.0° |
| C25 | C26 | C27 | H17 | 60.0° | 180.0° |
| C26 | C25 | O9 | H18 | 110.3° | 59.8° |
| O8 | C24 | C25 | O9 | 154.0° | 161.0° |
| O8 | C24 | C25 | C21 | 34.0° | 41.1° |
| C24 | O8 | C23 | C22 | 37.9° | 45.0° |
| C24 | O8 | C23 | H11 | 157.8° | 165.3° |
| C24 | O8 | C23 | H12 | 82.0° | 75.3° |
| C25 | C24 | O8 | C23 | 3.5° | 60.5° |
| C24 | C25 | O9 | C21 | 121.7° | 119.6° |
| C24 | C25 | C21 | C22 | 36.5° | 12.3° |
| C24 | C25 | C21 | C20 | 144.5° | 168.4° |
| C24 | C25 | C26 | H13 | 56.2° | 179.8° |
| C24 | C25 | C26 | H14 | 176.4° | 59.8° |
| C24 | C25 | O9 | H18 | 9.7° | 60.5° |
| O8 | C23 | C22 | H11 | 119.8° | 120.2° |
| O8 | C23 | C22 | H12 | 119.8° | 120.3° |
| O8 | C23 | C22 | C21 | 36.0° | 16.9° |
| O8 | C23 | C22 | C28 | 145.3° | 163.8° |
| O8 | C23 | H11 | H12 | 120.5° | 119.4° |
| O9 | C25 | C21 | C22 | 156.4° | 132.2° |
| O9 | C25 | C21 | C20 | 24.6° | 48.5° |
| O9 | C25 | C26 | H13 | 174.4° | 60.0° |
| O9 | C25 | C26 | H14 | 65.4° | 180.0° |
| C25 | C21 | C22 | C23 | 0.2° | 2.6° |
| C25 | C21 | C22 | C20 | 179.1° | 179.3° |
| C25 | C21 | C22 | C28 | 178.6° | 178.1° |
| C25 | C21 | C20 | C6A | 179.5° | 178.8° |
| C21 | C25 | C26 | H13 | 68.0° | 60.2° |
| C21 | C25 | C26 | H14 | 52.2° | 59.9° |
| C21 | C25 | O9 | H18 | 131.3° | 179.9° |
| C25 | C21 | C20 | H19 | 0.5° | 1.3° |
| C23 | C22 | C21 | C28 | 178.8° | 179.2° |
| C23 | C22 | C21 | C20 | 179.3° | 178.1° |
| C23 | C22 | C28 | O11 | 1.4° | 1.9° |
| C23 | C22 | C28 | N1 | 179.4° | 178.1° |
| C22 | C23 | H11 | H12 | 120.5° | 119.5° |
| C22 | C21 | C20 | C6A | 1.4° | 0.5° |
| C21 | C22 | C28 | O11 | 179.8° | 178.8° |
| C21 | C22 | C28 | N1 | 0.6° | 1.1° |
| C21 | C22 | C23 | H11 | 155.8° | 137.1° |
| C21 | C22 | C23 | H12 | 83.9° | 103.4° |
| C22 | C21 | C20 | H19 | 178.6° | 179.4° |
| C20 | C21 | C22 | C28 | 0.5° | 1.1° |
| C21 | C20 | C6A | H19 | 180.0° | 180.0° |
| C21 | C20 | C6A | N1 | 3.2° | 0.1° |
| C21 | C20 | C6A | C7 | 178.6° | 180.0° |
| C22 | C28 | O11 | N1 | 179.2° | 180.0° |
| C22 | C28 | N1 | C6A | 1.3° | 0.5° |
| C22 | C28 | N1 | C5A | 179.8° | 179.4° |
| C28 | C22 | C23 | H11 | 25.4° | 43.6° |
| C28 | C22 | C23 | H12 | 94.9° | 75.9° |
| C20 | C6A | N1 | C28 | 3.3° | 0.1° |
| C20 | C6A | N1 | C7 | 176.5° | 179.9° |
| C20 | C6A | N1 | C5A | 177.7° | 179.9° |
| C20 | C6A | C7 | N2 | 4.1° | 0.1° |
| C20 | C6A | C7 | C4A | 175.3° | 179.9° |
| O11 | C28 | N1 | C6A | 177.9° | 179.5° |
| O11 | C28 | N1 | C5A | 1.0° | 0.6° |
| C28 | N1 | C6A | C5A | 179.0° | 179.9° |
| C28 | N1 | C6A | C7 | 179.8° | 179.9° |
| C28 | N1 | C5A | C4A | 178.6° | 179.7° |
| C28 | N1 | C5A | H6 | 62.4° | 61.0° |
| C28 | N1 | C5A | H29 | 59.6° | 60.4° |
| N1 | C6A | C7 | N2 | 179.8° | 179.8° |
| N1 | C6A | C7 | C4A | 0.5° | 0.2° |
| C6A | N1 | C5A | C4A | 2.3° | 0.2° |
| C6A | N1 | C5A | H6 | 116.6° | 119.1° |
| N1 | C6A | C20 | H19 | 176.9° | 179.9° |
| C6A | N1 | C5A | H29 | 121.4° | 119.5° |
| C7 | C6A | N1 | C5A | 1.2° | 0.0° |
| C6A | C7 | N2 | C4A | 179.3° | 180.0° |
| C6A | C7 | C4A | C5A | 2.0° | 0.3° |
| C6A | C7 | N2 | C8 | 178.7° | 180.0° |
| C6A | C7 | C4A | C3A | 179.1° | 179.9° |
| C7 | C6A | C20 | H19 | 1.5° | 0.0° |
| N1 | C5A | C4A | C7 | 2.6° | 0.3° |
| N1 | C5A | C4A | H6 | 119.0° | 119.3° |
| N1 | C5A | C4A | H29 | 119.0° | 119.3° |
| N1 | C5A | C4A | C3A | 178.7° | 179.9° |
| N1 | C5A | H6 | H29 | 122.9° | 121.5° |
| N2 | C7 | C4A | C5A | 178.6° | 179.7° |
| N2 | C7 | C4A | C3A | 0.3° | 0.1° |
| C7 | N2 | C8 | C19 | 179.7° | 179.8° |
| C7 | N2 | C8 | C9 | 0.5° | 0.1° |
| C7 | C4A | C5A | C3A | 178.7° | 179.8° |
| C4A | C7 | N2 | C8 | 0.5° | 0.0° |
| C7 | C4A | C3A | C9 | 0.0° | 0.2° |
| C7 | C4A | C3A | C2A | 178.7° | 179.9° |
| C7 | C4A | C5A | H6 | 116.4° | 119.0° |
| C7 | C4A | C5A | H29 | 121.6° | 119.6° |
| C5A | C4A | C3A | C9 | 178.6° | 179.6° |
| C5A | C4A | C3A | C2A | 2.7° | 0.3° |
| C4A | C5A | H6 | H29 | 122.9° | 121.5° |
| N2 | C8 | C19 | C9 | 179.8° | 180.0° |
| N2 | C8 | C19 | C18 | 179.9° | 180.0° |
| N2 | C8 | C9 | C3A | 0.3° | 0.1° |
| N2 | C8 | C9 | C10 | 179.7° | 179.9° |
| N2 | C8 | C19 | H20 | 0.1° | 0.0° |
| C4A | C3A | C9 | C8 | 0.0° | 0.1° |
| C4A | C3A | C9 | C2A | 178.7° | 179.9° |
| C4A | C3A | C9 | C10 | 179.4° | 179.9° |
| C4A | C3A | C2A | C1A | 85.2° | 89.9° |
| C4A | C3A | C2A | H4A | 35.2° | 30.1° |
| C4A | C3A | C2A | H5A | 154.4° | 150.0° |
| C3A | C4A | C5A | H6 | 62.3° | 60.9° |
| C3A | C4A | C5A | H29 | 59.7° | 60.5° |
| C8 | C19 | C18 | H20 | 180.0° | 180.0° |
| C19 | C8 | C9 | C3A | 180.0° | 179.9° |
| C19 | C8 | C9 | C10 | 0.6° | 0.1° |
| C8 | C19 | C18 | C11 | 0.3° | 0.0° |
| C8 | C19 | C18 | H21 | 179.7° | 180.0° |
| C9 | C8 | C19 | C18 | 0.3° | 0.0° |
| C8 | C9 | C3A | C10 | 179.4° | 180.0° |
| C8 | C9 | C3A | C2A | 178.7° | 180.0° |
| C8 | C9 | C10 | C11 | 0.8° | 0.1° |
| C9 | C8 | C19 | H20 | 179.7° | 179.9° |
| C8 | C9 | C10 | H22 | 179.2° | 179.9° |
| C19 | C18 | C11 | H21 | 180.0° | 180.0° |
| C19 | C18 | C11 | C10 | 0.5° | 0.0° |
| C19 | C18 | C11 | O1 | 179.8° | 180.0° |
| C9 | C3A | C2A | C1A | 96.1° | 89.9° |
| C3A | C9 | C10 | C11 | 179.8° | 179.9° |
| C9 | C3A | C2A | H4A | 143.4° | 150.1° |
| C9 | C3A | C2A | H5A | 24.3° | 30.1° |
| C3A | C9 | C10 | H22 | 0.2° | 0.1° |
| C2A | C3A | C9 | C10 | 0.7° | 0.0° |
| C3A | C2A | C1A | H4A | 120.5° | 120.0° |
| C3A | C2A | C1A | H5A | 120.4° | 120.0° |
| C3A | C2A | C1A | H1A | 180.0° | 180.0° |
| C3A | C2A | C1A | H2A | 60.0° | 60.0° |
| C3A | C2A | C1A | H3A | 60.0° | 60.0° |
| C3A | C2A | H4A | H5A | 118.7° | 120.0° |
| C9 | C10 | C11 | C18 | 0.8° | 0.1° |
| C9 | C10 | C11 | H22 | 180.0° | 180.0° |
| C9 | C10 | C11 | O1 | 179.9° | 180.0° |
| C2A | C1A | H1A | H2A | 120.0° | 120.0° |
| C2A | C1A | H1A | H3A | 120.0° | 120.0° |
| C2A | C1A | H2A | H3A | 120.0° | 120.1° |
| C1A | C2A | H4A | H5A | 118.6° | 120.0° |
| C18 | C11 | C10 | O1 | 179.3° | 180.0° |
| C18 | C11 | O1 | C1 | 171.8° | 0.0° |
| C11 | C18 | C19 | H20 | 179.7° | 180.0° |
| C18 | C11 | C10 | H22 | 179.2° | 179.9° |
| C10 | C11 | O1 | C1 | 8.9° | 180.0° |
| C10 | C11 | C18 | H21 | 179.4° | 180.0° |
| C11 | O1 | C1 | O5 | 87.2° | 65.0° |
| C11 | O1 | C1 | C2 | 157.2° | 175.0° |
| O1 | C11 | C18 | H21 | 0.2° | 0.1° |
| O1 | C11 | C10 | H22 | 0.1° | 0.0° |
| C11 | O1 | C1 | H1 | 35.6° | 55.0° |
| O1 | C1 | O5 | C2 | 116.6° | 120.0° |
| O1 | C1 | O5 | H1 | 122.7° | 120.1° |
| O1 | C1 | C2 | H1 | 122.4° | 120.0° |
| O1 | C1 | C2 | O2 | 59.9° | 62.5° |
| O1 | C1 | O5 | C5 | 177.6° | 178.9° |
| O1 | C1 | C2 | C3 | 175.9° | 177.6° |
| O1 | C1 | C2 | H2 | 63.4° | 57.7° |
| O5 | C1 | C2 | H1 | 121.4° | 120.0° |
| O5 | C1 | C2 | O2 | 176.1° | 177.5° |
| O5 | C1 | C2 | C3 | 67.9° | 57.6° |
| C1 | O5 | C5 | C6 | 178.8° | 178.8° |
| C1 | O5 | C5 | C4 | 61.3° | 61.2° |
| C1 | O5 | C5 | H5 | 60.6° | 58.8° |
| O5 | C1 | C2 | H2 | 52.8° | 62.3° |
| C1 | C2 | O2 | C3 | 116.5° | 119.7° |
| C1 | C2 | O2 | H2 | 122.5° | 120.2° |
| C2 | C1 | O5 | C5 | 65.8° | 61.2° |
| C1 | C2 | C3 | H2 | 120.5° | 119.9° |
| C1 | C2 | C3 | C4 | 64.0° | 57.0° |
| C1 | C2 | C3 | O3 | 178.1° | 176.8° |
| C1 | C2 | C3 | H3 | 56.0° | 62.9° |
| C1 | C2 | O2 | HO2 | 180.0° | 60.0° |
| O2 | C2 | C3 | H2 | 121.7° | 120.2° |
| O2 | C2 | C3 | C4 | 178.3° | 176.9° |
| O2 | C2 | C3 | O3 | 60.3° | 63.3° |
| O2 | C2 | C1 | H1 | 62.5° | 57.5° |
| O2 | C2 | C3 | H3 | 61.8° | 57.0° |
| O5 | C5 | C6 | C4 | 119.0° | 120.0° |
| O5 | C5 | C6 | H5 | 121.4° | 120.1° |
| O5 | C5 | C4 | H5 | 122.6° | 120.0° |
| O5 | C5 | C4 | C3 | 57.4° | 57.6° |
| O5 | C5 | C6 | O6A | 27.6° | 4.9° |
| O5 | C5 | C6 | O6B | 154.4° | 175.1° |
| O5 | C5 | C4 | O4 | 176.3° | 177.5° |
| C5 | O5 | C1 | H1 | 54.9° | 58.8° |
| O5 | C5 | C4 | H4 | 62.7° | 62.3° |
| C2 | C3 | C4 | C5 | 58.6° | 57.0° |
| C2 | C3 | C4 | O3 | 116.7° | 119.8° |
| C2 | C3 | C4 | H3 | 120.2° | 119.9° |
| C2 | C3 | O3 | H3 | 121.7° | 120.3° |
| C2 | C3 | C4 | O4 | 177.3° | 176.9° |
| C2 | C3 | O3 | HO3 | 180.0° | 60.1° |
| C3 | C2 | C1 | H1 | 53.5° | 62.3° |
| C2 | C3 | C4 | H4 | 61.4° | 63.0° |
| C3 | C2 | O2 | HO2 | 63.6° | 179.7° |
| C6 | C5 | C4 | H5 | 119.5° | 120.0° |
| C6 | C5 | C4 | C3 | 175.2° | 177.6° |
| C5 | C6 | O6A | O6B | 177.8° | 180.0° |
| C6 | C5 | C4 | O4 | 65.8° | 62.5° |
| C5 | C6 | O6B | HO6B | 177.8° | 180.0° |
| C6 | C5 | C4 | H4 | 55.2° | 57.7° |
| C5 | C4 | C3 | O4 | 118.7° | 119.9° |
| C5 | C4 | C3 | H4 | 119.9° | 119.9° |
| C5 | C4 | C3 | O3 | 175.3° | 176.8° |
| C4 | C5 | C6 | O6A | 91.4° | 115.0° |
| C4 | C5 | C6 | O6B | 86.6° | 65.0° |
| C5 | C4 | O4 | H4 | 120.3° | 120.2° |
| C5 | C4 | O4 | HO4 | 180.0° | 60.2° |
| C5 | C4 | C3 | H3 | 61.6° | 62.9° |
| C4 | C3 | O3 | H3 | 122.6° | 120.2° |
| C3 | C4 | O4 | H4 | 120.7° | 120.1° |
| C4 | C3 | O3 | HO3 | 64.2° | 179.6° |
| C3 | C4 | O4 | HO4 | 61.0° | 179.9° |
| C3 | C4 | C5 | H5 | 65.3° | 62.4° |
| C4 | C3 | C2 | H2 | 56.5° | 62.9° |
| O3 | C3 | C4 | O4 | 66.0° | 63.2° |
| O3 | C3 | C4 | H4 | 55.3° | 56.9° |
| O3 | C3 | C2 | H2 | 61.5° | 56.9° |
| O6A | C6 | O6B | HO6B | 0.0° | 0.0° |
| O6A | C6 | C5 | H5 | 149.0° | 125.0° |
| O6B | C6 | C5 | H5 | 32.9° | 55.0° |
| O4 | C4 | C5 | H5 | 53.6° | 57.5° |
| O4 | C4 | C3 | H3 | 57.2° | 57.1° |
| H1A | C1A | H2A | H3A | 120.0° | 119.9° |
| H1A | C1A | C2A | H4A | 59.6° | 60.0° |
| H1A | C1A | C2A | H5A | 59.5° | 60.0° |
| H2A | C1A | C2A | H4A | 179.5° | 60.0° |
| H2A | C1A | C2A | H5A | 60.4° | 180.0° |
| H3A | C1A | C2A | H4A | 60.5° | 180.0° |
| H3A | C1A | C2A | H5A | 179.5° | 60.0° |
| HO3 | O3 | C3 | H3 | 58.3° | 60.2° |
| HO4 | O4 | C4 | H4 | 59.7° | 59.9° |
| H13 | C26 | C27 | H15 | 60.1° | 180.0° |
| H13 | C26 | C27 | H16 | 59.9° | 60.0° |
| H13 | C26 | C27 | H17 | 179.9° | 60.0° |
| H14 | C26 | C27 | H15 | 60.1° | 60.0° |
| H14 | C26 | C27 | H16 | 179.9° | 180.0° |
| H14 | C26 | C27 | H17 | 59.9° | 60.0° |
| H15 | C27 | H16 | H17 | 120.0° | 120.0° |
| H20 | C19 | C18 | H21 | 0.3° | 0.0° |
| H1 | C1 | C2 | H2 | 174.2° | 177.7° |
| H5 | C5 | C4 | H4 | 174.6° | 177.7° |
| H4 | C4 | C3 | H3 | 178.5° | 177.2° |
| H3 | C3 | C2 | H2 | 176.5° | 177.2° |
| H2 | C2 | O2 | HO2 | 57.5° | 60.1° |
