3EQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C1 | H1B | sing | 1.09Å | 1.10Å | |
| C2 | C3 | sing | 1.53Å | 1.51Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H2A | sing | 1.09Å | 1.10Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H3A | sing | 1.09Å | 1.10Å | |
| N5 | C4 | sing | 1.47Å | 1.49Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H4A | sing | 1.09Å | 1.10Å | |
| C6 | N5 | sing | 1.40Å | 1.45Å | |
| N5 | S21 | sing | 1.66Å | 1.71Å | |
| C11 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.38Å | Aromatic |
| C8 | C7 | doub | 1.38Å | 1.38Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C9 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C10 | C9 | doub | 1.39Å | 1.38Å | Aromatic |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C13 | C10 | sing | 1.48Å | 1.46Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| C12 | C11 | sing | 1.51Å | 1.50Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C12 | H12B | sing | 1.09Å | 1.10Å | |
| C14 | C13 | doub | 1.39Å | 1.38Å | Aromatic |
| C20 | C13 | sing | 1.39Å | 1.38Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.38Å | Aromatic |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C16 | C15 | doub | 1.39Å | 1.38Å | Aromatic |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| S17 | C16 | sing | 1.76Å | 1.78Å | |
| C16 | C19 | sing | 1.39Å | 1.38Å | Aromatic |
| C18 | S17 | sing | 1.81Å | 1.80Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C18 | H18B | sing | 1.09Å | 1.10Å | |
| C19 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C24 | S21 | sing | 1.76Å | 1.79Å | |
| S21 | O22 | doub | 1.42Å | 1.45Å | |
| S21 | O23 | doub | 1.42Å | 1.45Å | |
| C38 | C24 | doub | 1.41Å | 1.38Å | Aromatic |
| C24 | C25 | sing | 1.36Å | 1.38Å | Aromatic |
| C26 | C25 | doub | 1.39Å | 1.38Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C27 | C26 | sing | 1.37Å | 1.38Å | Aromatic |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C33 | C27 | doub | 1.41Å | 1.38Å | Aromatic |
| O28 | C27 | sing | 1.36Å | 1.39Å | |
| O28 | C29 | sing | 1.43Å | 1.43Å | |
| C29 | C30 | sing | 1.51Å | 1.53Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C30 | O31 | doub | 1.21Å | 1.26Å | |
| C30 | O32 | sing | 1.34Å | 1.26Å | |
| O32 | HO32 | sing | 0.97Å | 0.95Å | |
| C34 | C33 | sing | 1.40Å | 1.38Å | Aromatic |
| C33 | C38 | sing | 1.42Å | 1.39Å | Aromatic |
| C35 | C34 | doub | 1.36Å | 1.38Å | Aromatic |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | C36 | sing | 1.39Å | 1.38Å | Aromatic |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C36 | C37 | doub | 1.36Å | 1.38Å | Aromatic |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C37 | C38 | sing | 1.41Å | 1.38Å | Aromatic |
| C37 | H37 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H1A | 109.4° | 109.5° |
| C2 | C1 | H1B | 109.5° | 109.5° |
| C1 | C2 | C3 | 112.1° | 109.5° |
| C1 | C2 | H2 | 108.6° | 109.4° |
| C1 | C2 | H2A | 108.6° | 109.4° |
| H1 | C1 | H1A | 109.5° | 109.5° |
| H1 | C1 | H1B | 109.5° | 109.5° |
| H1A | C1 | H1B | 109.5° | 109.4° |
| C3 | C2 | H2 | 108.6° | 109.5° |
| C3 | C2 | H2A | 108.6° | 109.5° |
| C2 | C3 | C4 | 108.1° | 109.4° |
| C2 | C3 | H3 | 109.9° | 109.5° |
| C2 | C3 | H3A | 109.9° | 109.5° |
| H2 | C2 | H2A | 110.3° | 109.5° |
| C4 | C3 | H3 | 109.9° | 109.5° |
| C4 | C3 | H3A | 109.9° | 109.5° |
| C3 | C4 | N5 | 113.9° | 109.4° |
| C3 | C4 | H4 | 108.0° | 109.5° |
| C3 | C4 | H4A | 108.0° | 109.5° |
| H3 | C3 | H3A | 109.0° | 109.5° |
| N5 | C4 | H4 | 108.0° | 109.5° |
| N5 | C4 | H4A | 108.0° | 109.5° |
| C4 | N5 | C6 | 113.9° | 120.0° |
| C4 | N5 | S21 | 111.1° | 120.0° |
| H4 | C4 | H4A | 110.9° | 109.5° |
| C6 | N5 | S21 | 119.1° | 120.0° |
| N5 | C6 | C11 | 118.8° | 120.0° |
| N5 | C6 | C7 | 121.0° | 120.0° |
| N5 | S21 | C24 | 108.2° | 107.2° |
| N5 | S21 | O22 | 107.4° | 106.4° |
| N5 | S21 | O23 | 110.1° | 106.4° |
| C11 | C6 | C7 | 120.1° | 120.0° |
| C6 | C11 | C10 | 120.3° | 119.8° |
| C6 | C11 | C12 | 118.3° | 120.1° |
| C6 | C7 | C8 | 120.0° | 120.2° |
| C6 | C7 | H7 | 120.0° | 119.9° |
| C8 | C7 | H7 | 120.0° | 119.9° |
| C7 | C8 | C9 | 119.6° | 120.2° |
| C7 | C8 | H8 | 120.2° | 119.9° |
| C9 | C8 | H8 | 120.2° | 119.9° |
| C8 | C9 | C10 | 121.6° | 120.1° |
| C8 | C9 | H9 | 119.2° | 120.0° |
| C10 | C9 | H9 | 119.2° | 120.0° |
| C9 | C10 | C13 | 117.6° | 120.1° |
| C9 | C10 | C11 | 118.4° | 119.8° |
| C13 | C10 | C11 | 124.0° | 120.1° |
| C10 | C13 | C14 | 121.8° | 120.0° |
| C10 | C13 | C20 | 120.6° | 120.0° |
| C10 | C11 | C12 | 121.4° | 120.1° |
| C11 | C12 | H12 | 109.5° | 109.5° |
| C11 | C12 | H12A | 109.5° | 109.5° |
| C11 | C12 | H12B | 109.5° | 109.5° |
| H12 | C12 | H12A | 109.5° | 109.4° |
| H12 | C12 | H12B | 109.4° | 109.5° |
| H12A | C12 | H12B | 109.5° | 109.5° |
| C14 | C13 | C20 | 117.6° | 119.9° |
| C13 | C14 | C15 | 121.4° | 120.0° |
| C13 | C14 | H14 | 119.3° | 120.0° |
| C13 | C20 | C19 | 121.1° | 119.9° |
| C13 | C20 | H20 | 119.5° | 120.0° |
| C15 | C14 | H14 | 119.3° | 120.0° |
| C14 | C15 | C16 | 120.8° | 120.0° |
| C14 | C15 | H15 | 119.6° | 120.0° |
| C16 | C15 | H15 | 119.6° | 120.0° |
| C15 | C16 | S17 | 119.9° | 120.0° |
| C15 | C16 | C19 | 118.2° | 120.1° |
| S17 | C16 | C19 | 122.0° | 119.9° |
| C16 | S17 | C18 | 99.2° | 103.0° |
| C16 | C19 | C20 | 121.0° | 120.0° |
| C16 | C19 | H19 | 119.5° | 120.0° |
| S17 | C18 | H18 | 109.5° | 109.4° |
| S17 | C18 | H18A | 109.5° | 109.5° |
| S17 | C18 | H18B | 109.4° | 109.4° |
| H18 | C18 | H18A | 109.5° | 109.5° |
| H18 | C18 | H18B | 109.5° | 109.5° |
| H18A | C18 | H18B | 109.5° | 109.5° |
| C20 | C19 | H19 | 119.5° | 120.0° |
| C19 | C20 | H20 | 119.4° | 120.1° |
| C24 | S21 | O22 | 105.8° | 106.4° |
| C24 | S21 | O23 | 107.6° | 106.4° |
| S21 | C24 | C38 | 123.4° | 120.1° |
| S21 | C24 | C25 | 115.9° | 120.1° |
| O22 | S21 | O23 | 117.3° | 123.2° |
| C38 | C24 | C25 | 120.7° | 119.7° |
| C24 | C38 | C33 | 118.9° | 119.4° |
| C24 | C38 | C37 | 122.2° | 121.3° |
| C24 | C25 | C26 | 120.3° | 121.1° |
| C24 | C25 | H25 | 119.9° | 119.5° |
| C26 | C25 | H25 | 119.9° | 119.5° |
| C25 | C26 | C27 | 119.7° | 120.9° |
| C25 | C26 | H26 | 120.1° | 119.5° |
| C27 | C26 | H26 | 120.1° | 119.5° |
| C26 | C27 | C33 | 120.0° | 119.5° |
| C26 | C27 | O28 | 121.6° | 120.3° |
| C33 | C27 | O28 | 118.4° | 120.2° |
| C27 | C33 | C34 | 119.7° | 121.3° |
| C27 | C33 | C38 | 120.5° | 119.3° |
| C27 | O28 | C29 | 109.8° | 117.0° |
| O28 | C29 | C30 | 112.8° | 109.5° |
| O28 | C29 | H29 | 108.4° | 109.5° |
| O28 | C29 | H29A | 108.4° | 109.5° |
| C30 | C29 | H29 | 108.4° | 109.4° |
| C30 | C29 | H29A | 108.4° | 109.5° |
| C29 | C30 | O31 | 113.5° | 120.0° |
| C29 | C30 | O32 | 118.2° | 120.0° |
| H29 | C29 | H29A | 110.5° | 109.5° |
| O31 | C30 | O32 | 128.3° | 120.0° |
| C30 | O32 | HO32 | 109.5° | 117.0° |
| C34 | C33 | C38 | 119.8° | 119.4° |
| C33 | C34 | C35 | 120.7° | 119.7° |
| C33 | C34 | H34 | 119.7° | 120.2° |
| C33 | C38 | C37 | 118.9° | 119.4° |
| C35 | C34 | H34 | 119.7° | 120.2° |
| C34 | C35 | C36 | 119.9° | 121.0° |
| C34 | C35 | H35 | 120.0° | 119.5° |
| C36 | C35 | H35 | 120.1° | 119.5° |
| C35 | C36 | C37 | 119.4° | 121.0° |
| C35 | C36 | H36 | 120.3° | 119.5° |
| C37 | C36 | H36 | 120.3° | 119.5° |
| C36 | C37 | C38 | 121.3° | 119.6° |
| C36 | C37 | H37 | 119.3° | 120.2° |
| C38 | C37 | H37 | 119.4° | 120.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | H1 | H1A | 120.0° | 120.0° |
| C2 | C1 | H1 | H1B | 120.0° | 120.0° |
| C2 | C1 | H1A | H1B | 120.0° | 120.0° |
| C1 | C2 | C3 | H2 | 120.0° | 120.0° |
| C1 | C2 | C3 | H2A | 120.0° | 119.9° |
| C1 | C2 | H2 | H2A | 118.9° | 119.9° |
| C1 | C2 | C3 | C4 | 170.9° | 180.0° |
| C1 | C2 | C3 | H3 | 69.1° | 60.0° |
| C1 | C2 | C3 | H3A | 50.9° | 60.1° |
| H1 | C1 | H1A | H1B | 120.0° | 120.0° |
| H1 | C1 | C2 | C3 | 180.0° | 60.0° |
| H1 | C1 | C2 | H2 | 60.0° | 179.9° |
| H1 | C1 | C2 | H2A | 60.0° | 60.0° |
| H1A | C1 | C2 | C3 | 60.0° | 180.0° |
| H1A | C1 | C2 | H2 | 60.0° | 59.9° |
| H1A | C1 | C2 | H2A | 180.0° | 60.0° |
| H1B | C1 | C2 | C3 | 60.0° | 60.0° |
| H1B | C1 | C2 | H2 | 180.0° | 60.0° |
| H1B | C1 | C2 | H2A | 60.0° | 180.0° |
| C3 | C2 | H2 | H2A | 118.9° | 120.1° |
| C2 | C3 | C4 | H3 | 120.0° | 120.0° |
| C2 | C3 | C4 | H3A | 120.0° | 120.0° |
| C2 | C3 | H3 | H3A | 120.5° | 120.0° |
| C2 | C3 | C4 | N5 | 170.3° | 180.0° |
| C2 | C3 | C4 | H4 | 69.7° | 60.0° |
| C2 | C3 | C4 | H4A | 50.3° | 60.0° |
| H2 | C2 | C3 | C4 | 50.9° | 60.0° |
| H2 | C2 | C3 | H3 | 170.9° | 180.0° |
| H2 | C2 | C3 | H3A | 69.1° | 59.9° |
| H2A | C2 | C3 | C4 | 69.1° | 60.0° |
| H2A | C2 | C3 | H3 | 50.9° | 60.0° |
| H2A | C2 | C3 | H3A | 170.9° | 180.0° |
| C4 | C3 | H3 | H3A | 120.6° | 120.0° |
| C3 | C4 | N5 | H4 | 120.0° | 120.0° |
| C3 | C4 | N5 | H4A | 120.0° | 120.0° |
| C3 | C4 | H4 | H4A | 118.2° | 120.0° |
| C3 | C4 | N5 | C6 | 67.6° | 63.7° |
| C3 | C4 | N5 | S21 | 70.3° | 116.3° |
| H3 | C3 | C4 | N5 | 50.3° | 60.0° |
| H3 | C3 | C4 | H4 | 170.3° | 180.0° |
| H3 | C3 | C4 | H4A | 69.7° | 60.0° |
| H3A | C3 | C4 | N5 | 69.7° | 60.0° |
| H3A | C3 | C4 | H4 | 50.3° | 60.0° |
| H3A | C3 | C4 | H4A | 170.3° | 180.0° |
| N5 | C4 | H4 | H4A | 118.2° | 120.0° |
| C4 | N5 | C6 | S21 | 134.2° | 180.0° |
| C4 | N5 | C6 | C11 | 77.7° | 94.5° |
| C4 | N5 | C6 | C7 | 100.3° | 85.8° |
| C4 | N5 | S21 | C24 | 155.3° | 100.6° |
| C4 | N5 | S21 | O22 | 41.5° | 145.9° |
| C4 | N5 | S21 | O23 | 87.3° | 13.0° |
| H4 | C4 | N5 | C6 | 172.4° | 176.3° |
| H4 | C4 | N5 | S21 | 49.7° | 3.7° |
| H4A | C4 | N5 | C6 | 52.4° | 56.3° |
| H4A | C4 | N5 | S21 | 169.7° | 123.7° |
| N5 | C6 | C11 | C7 | 178.1° | 179.7° |
| N5 | C6 | C7 | C8 | 179.0° | 180.0° |
| N5 | C6 | C7 | H7 | 0.9° | 0.0° |
| N5 | C6 | C11 | C10 | 178.4° | 179.8° |
| N5 | C6 | C11 | C12 | 1.3° | 0.2° |
| C6 | N5 | S21 | C24 | 69.3° | 79.4° |
| C6 | N5 | S21 | O22 | 176.9° | 34.1° |
| C6 | N5 | S21 | O23 | 48.1° | 167.0° |
| S21 | N5 | C6 | C11 | 148.1° | 85.5° |
| S21 | N5 | C6 | C7 | 33.9° | 94.2° |
| N5 | S21 | C24 | O22 | 114.8° | 113.5° |
| N5 | S21 | C24 | O23 | 119.0° | 113.5° |
| N5 | S21 | O22 | O23 | 124.6° | 122.9° |
| N5 | S21 | C24 | C38 | 59.4° | 72.8° |
| N5 | S21 | C24 | C25 | 121.9° | 107.5° |
| C11 | C6 | C7 | C8 | 1.0° | 0.3° |
| C11 | C6 | C7 | H7 | 179.0° | 179.8° |
| C6 | C11 | C10 | C9 | 0.4° | 0.5° |
| C6 | C11 | C10 | C13 | 178.1° | 179.7° |
| C6 | C11 | C10 | C12 | 179.6° | 179.5° |
| C6 | C11 | C12 | H12 | 89.8° | 96.5° |
| C6 | C11 | C12 | H12A | 150.2° | 23.4° |
| C6 | C11 | C12 | H12B | 30.2° | 143.4° |
| C6 | C7 | C8 | H7 | 180.0° | 179.9° |
| C6 | C7 | C8 | C9 | 1.0° | 0.0° |
| C6 | C7 | C8 | H8 | 179.0° | 180.0° |
| C7 | C6 | C11 | C10 | 0.3° | 0.5° |
| C7 | C6 | C11 | C12 | 179.4° | 179.9° |
| C7 | C8 | C9 | H8 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 0.3° | 0.1° |
| C7 | C8 | C9 | H9 | 179.7° | 180.0° |
| H7 | C7 | C8 | C9 | 179.0° | 179.9° |
| H7 | C7 | C8 | H8 | 1.0° | 0.0° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C8 | C9 | C10 | C13 | 178.1° | 180.0° |
| C8 | C9 | C10 | C11 | 0.4° | 0.2° |
| H8 | C8 | C9 | C10 | 179.7° | 180.0° |
| H8 | C8 | C9 | H9 | 0.3° | 0.0° |
| C9 | C10 | C13 | C11 | 178.5° | 179.8° |
| C9 | C10 | C11 | C12 | 180.0° | 180.0° |
| C9 | C10 | C13 | C14 | 47.7° | 50.0° |
| C9 | C10 | C13 | C20 | 130.7° | 129.7° |
| H9 | C9 | C10 | C13 | 1.9° | 0.0° |
| H9 | C9 | C10 | C11 | 179.6° | 179.8° |
| C13 | C10 | C11 | C12 | 1.6° | 0.2° |
| C10 | C13 | C14 | C20 | 178.4° | 179.7° |
| C10 | C13 | C14 | C15 | 178.8° | 179.9° |
| C10 | C13 | C14 | H14 | 1.2° | 0.1° |
| C10 | C13 | C20 | C19 | 179.1° | 179.8° |
| C10 | C13 | C20 | H20 | 0.9° | 0.3° |
| C10 | C11 | C12 | H12 | 89.8° | 83.9° |
| C10 | C11 | C12 | H12A | 30.2° | 156.1° |
| C10 | C11 | C12 | H12B | 150.2° | 36.1° |
| C11 | C10 | C13 | C14 | 133.8° | 130.2° |
| C11 | C10 | C13 | C20 | 47.8° | 50.1° |
| C11 | C12 | H12 | H12A | 120.0° | 120.0° |
| C11 | C12 | H12 | H12B | 120.0° | 120.0° |
| C11 | C12 | H12A | H12B | 120.0° | 120.0° |
| H12 | C12 | H12A | H12B | 120.0° | 120.0° |
| C13 | C14 | C15 | H14 | 180.0° | 180.0° |
| C13 | C14 | C15 | C16 | 0.0° | 0.1° |
| C13 | C14 | C15 | H15 | 180.0° | 180.0° |
| C14 | C13 | C20 | C19 | 0.7° | 0.5° |
| C14 | C13 | C20 | H20 | 179.3° | 180.0° |
| C20 | C13 | C14 | C15 | 0.4° | 0.2° |
| C20 | C13 | C14 | H14 | 179.6° | 179.8° |
| C13 | C20 | C19 | C16 | 0.7° | 0.5° |
| C13 | C20 | C19 | H20 | 180.0° | 179.5° |
| C13 | C20 | C19 | H19 | 179.3° | 179.8° |
| C14 | C15 | C16 | H15 | 180.0° | 179.9° |
| C14 | C15 | C16 | S17 | 179.7° | 179.9° |
| C14 | C15 | C16 | C19 | 0.1° | 0.1° |
| H14 | C14 | C15 | C16 | 180.0° | 179.9° |
| H14 | C14 | C15 | H15 | 0.0° | 0.0° |
| C15 | C16 | S17 | C19 | 179.8° | 180.0° |
| C15 | C16 | S17 | C18 | 167.3° | 180.0° |
| C15 | C16 | C19 | C20 | 0.3° | 0.2° |
| C15 | C16 | C19 | H19 | 179.7° | 179.9° |
| H15 | C15 | C16 | S17 | 0.3° | 0.0° |
| H15 | C15 | C16 | C19 | 179.9° | 180.0° |
| C16 | S17 | C18 | H18 | 180.0° | 60.0° |
| C16 | S17 | C18 | H18A | 60.0° | 180.0° |
| C16 | S17 | C18 | H18B | 60.0° | 60.0° |
| S17 | C16 | C19 | C20 | 179.9° | 179.8° |
| S17 | C16 | C19 | H19 | 0.1° | 0.0° |
| C19 | C16 | S17 | C18 | 12.5° | 0.0° |
| C16 | C19 | C20 | H19 | 180.0° | 179.7° |
| C16 | C19 | C20 | H20 | 179.4° | 180.0° |
| S17 | C18 | H18 | H18A | 120.0° | 120.0° |
| S17 | C18 | H18 | H18B | 120.0° | 119.9° |
| S17 | C18 | H18A | H18B | 120.0° | 120.0° |
| H18 | C18 | H18A | H18B | 120.0° | 120.0° |
| H19 | C19 | C20 | H20 | 0.6° | 0.3° |
| C24 | S21 | O22 | O23 | 120.0° | 123.0° |
| S21 | C24 | C38 | C25 | 178.7° | 179.6° |
| S21 | C24 | C25 | C26 | 179.0° | 180.0° |
| S21 | C24 | C25 | H25 | 1.0° | 0.1° |
| S21 | C24 | C38 | C33 | 178.6° | 179.8° |
| S21 | C24 | C38 | C37 | 1.3° | 0.6° |
| O22 | S21 | C24 | C38 | 55.5° | 173.7° |
| O22 | S21 | C24 | C25 | 123.3° | 6.0° |
| O23 | S21 | C24 | C38 | 178.3° | 40.7° |
| O23 | S21 | C24 | C25 | 2.9° | 138.9° |
| C38 | C24 | C25 | C26 | 0.2° | 0.4° |
| C38 | C24 | C25 | H25 | 179.7° | 179.7° |
| C24 | C38 | C33 | C27 | 0.4° | 0.5° |
| C24 | C38 | C33 | C34 | 179.9° | 179.7° |
| C24 | C38 | C33 | C37 | 180.0° | 179.2° |
| C24 | C38 | C37 | C36 | 179.8° | 179.7° |
| C24 | C38 | C37 | H37 | 0.2° | 0.6° |
| C24 | C25 | C26 | H25 | 180.0° | 179.9° |
| C24 | C25 | C26 | C27 | 0.3° | 0.1° |
| C24 | C25 | C26 | H26 | 179.7° | 179.9° |
| C25 | C24 | C38 | C33 | 0.1° | 0.6° |
| C25 | C24 | C38 | C37 | 180.0° | 179.7° |
| C25 | C26 | C27 | H26 | 180.0° | 180.0° |
| C25 | C26 | C27 | C33 | 0.0° | 0.0° |
| C25 | C26 | C27 | O28 | 179.6° | 179.9° |
| H25 | C25 | C26 | C27 | 179.7° | 180.0° |
| H25 | C25 | C26 | H26 | 0.3° | 0.0° |
| C26 | C27 | C33 | O28 | 179.6° | 179.9° |
| C26 | C27 | O28 | C29 | 14.0° | 0.1° |
| C26 | C27 | C33 | C34 | 179.9° | 180.0° |
| C26 | C27 | C33 | C38 | 0.3° | 0.2° |
| H26 | C26 | C27 | C33 | 180.0° | 180.0° |
| H26 | C26 | C27 | O28 | 0.4° | 0.1° |
| C33 | C27 | O28 | C29 | 166.5° | 180.0° |
| C27 | C33 | C34 | C38 | 179.8° | 179.7° |
| C27 | C33 | C34 | C35 | 179.7° | 180.0° |
| C27 | C33 | C34 | H34 | 0.3° | 0.0° |
| C27 | C33 | C38 | C37 | 179.7° | 179.7° |
| C27 | O28 | C29 | C30 | 94.7° | 179.9° |
| C27 | O28 | C29 | H29 | 145.3° | 60.0° |
| C27 | O28 | C29 | H29A | 25.3° | 60.0° |
| O28 | C27 | C33 | C34 | 0.3° | 0.1° |
| O28 | C27 | C33 | C38 | 179.9° | 179.7° |
| O28 | C29 | C30 | H29 | 120.0° | 120.0° |
| O28 | C29 | C30 | H29A | 120.0° | 120.0° |
| O28 | C29 | H29 | H29A | 118.7° | 120.0° |
| O28 | C29 | C30 | O31 | 171.0° | 0.0° |
| O28 | C29 | C30 | O32 | 10.2° | 180.0° |
| C30 | C29 | H29 | H29A | 118.7° | 120.0° |
| C29 | C30 | O31 | O32 | 178.7° | 180.0° |
| C29 | C30 | O32 | HO32 | 178.6° | 180.0° |
| H29 | C29 | C30 | O31 | 51.0° | 120.0° |
| H29 | C29 | C30 | O32 | 130.2° | 60.0° |
| H29A | C29 | C30 | O31 | 69.0° | 120.0° |
| H29A | C29 | C30 | O32 | 109.8° | 60.0° |
| O31 | C30 | O32 | HO32 | 0.0° | 0.0° |
| C33 | C34 | C35 | H34 | 180.0° | 180.0° |
| C33 | C34 | C35 | C36 | 0.1° | 0.0° |
| C33 | C34 | C35 | H35 | 179.9° | 179.9° |
| C34 | C33 | C38 | C37 | 0.1° | 0.6° |
| C38 | C33 | C34 | C35 | 0.1° | 0.3° |
| C38 | C33 | C34 | H34 | 180.0° | 179.8° |
| C33 | C38 | C37 | C36 | 0.2° | 0.6° |
| C33 | C38 | C37 | H37 | 179.8° | 179.7° |
| C34 | C35 | C36 | H35 | 180.0° | 179.9° |
| C34 | C35 | C36 | C37 | 0.1° | 0.0° |
| C34 | C35 | C36 | H36 | 179.9° | 180.0° |
| H34 | C34 | C35 | C36 | 179.9° | 180.0° |
| H34 | C34 | C35 | H35 | 0.1° | 0.1° |
| C35 | C36 | C37 | H36 | 180.0° | 180.0° |
| C35 | C36 | C37 | C38 | 0.2° | 0.3° |
| C35 | C36 | C37 | H37 | 179.8° | 180.0° |
| H35 | C35 | C36 | C37 | 179.9° | 179.9° |
| H35 | C35 | C36 | H36 | 0.1° | 0.1° |
| C36 | C37 | C38 | H37 | 180.0° | 179.7° |
| H36 | C36 | C37 | C38 | 179.8° | 179.7° |
| H36 | C36 | C37 | H37 | 0.2° | 0.0° |
