K20
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | O1 | sing | 1.44Å | 1.45Å | |
| C1 | O2 | sing | 1.44Å | 1.43Å | |
| O1 | C2 | sing | 1.37Å | 1.38Å | |
| C2 | C3 | doub | 1.39Å | 1.38Å | Aromatic |
| C2 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| O2 | C3 | sing | 1.37Å | 1.38Å | |
| C3 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.38Å | 1.40Å | Aromatic |
| C5 | S8 | sing | 1.76Å | 1.62Å | |
| C6 | C7 | doub | 1.38Å | 1.41Å | Aromatic |
| S8 | O9 | doub | 1.42Å | 1.42Å | |
| S8 | O10 | doub | 1.42Å | 1.46Å | |
| S8 | N11 | sing | 1.66Å | 1.62Å | |
| N11 | C12 | sing | 1.46Å | 1.48Å | |
| N11 | C16 | sing | 1.46Å | 1.48Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | C15 | sing | 1.53Å | 1.53Å | |
| C15 | C18 | sing | 1.53Å | 1.51Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C17 | O18 | sing | 1.43Å | 1.43Å | |
| C17 | C19 | sing | 1.53Å | 1.52Å | |
| C19 | N20 | sing | 1.47Å | 1.44Å | |
| C19 | C32 | sing | 1.53Å | 1.53Å | |
| N20 | C21 | sing | 1.35Å | 1.32Å | |
| C21 | O22 | doub | 1.22Å | 1.23Å | |
| C21 | O23 | sing | 1.35Å | 1.43Å | |
| O23 | C24 | sing | 1.45Å | 1.42Å | |
| C24 | C25 | sing | 1.54Å | 1.51Å | |
| C24 | C31 | sing | 1.54Å | 1.52Å | |
| C25 | O26 | sing | 1.43Å | 1.43Å | |
| O26 | C27 | sing | 1.44Å | 1.42Å | |
| C27 | O28 | sing | 1.43Å | 1.42Å | |
| C27 | C31 | sing | 1.56Å | 1.52Å | |
| O28 | C29 | sing | 1.43Å | 1.43Å | |
| C29 | C30 | sing | 1.54Å | 1.53Å | |
| C30 | C31 | sing | 1.55Å | 1.52Å | |
| C32 | C38 | sing | 1.51Å | 1.52Å | |
| C33 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | C38 | sing | 1.38Å | 1.39Å | Aromatic |
| C34 | C35 | sing | 1.38Å | 1.38Å | Aromatic |
| C35 | C36 | doub | 1.38Å | 1.38Å | Aromatic |
| C36 | C37 | sing | 1.38Å | 1.39Å | Aromatic |
| C37 | C38 | doub | 1.38Å | 1.39Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H1A | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C14 | H14B | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C18 | H18A | sing | 1.09Å | 1.10Å | |
| C18 | H18B | sing | 1.09Å | 1.10Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| N20 | HN20 | sing | 0.97Å | 1.00Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H25A | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H29A | sing | 1.09Å | 1.10Å | |
| C30 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H30A | sing | 1.09Å | 1.10Å | |
| C31 | H31 | sing | 1.09Å | 1.10Å | |
| C32 | H32 | sing | 1.09Å | 1.10Å | |
| C32 | H32A | sing | 1.09Å | 1.10Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C37 | H37 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | O2 | 105.8° | 103.7° |
| C1 | O1 | C2 | 107.0° | 105.5° |
| O1 | C1 | H1 | 110.7° | 110.6° |
| O1 | C1 | H1A | 110.7° | 110.6° |
| C1 | O2 | C3 | 108.2° | 105.5° |
| O2 | C1 | H1 | 110.7° | 110.6° |
| O2 | C1 | H1A | 110.7° | 110.6° |
| O1 | C2 | C3 | 110.0° | 108.6° |
| O1 | C2 | C7 | 130.0° | 131.6° |
| C3 | C2 | C7 | 120.1° | 119.8° |
| C2 | C3 | O2 | 108.9° | 108.6° |
| C2 | C3 | C4 | 121.4° | 119.9° |
| C2 | C7 | C6 | 118.5° | 120.0° |
| C2 | C7 | H7 | 120.7° | 120.0° |
| O2 | C3 | C4 | 129.7° | 131.5° |
| C3 | C4 | C5 | 120.2° | 120.0° |
| C3 | C4 | H4 | 119.9° | 120.0° |
| C4 | C5 | C6 | 117.5° | 120.1° |
| C4 | C5 | S8 | 121.4° | 119.9° |
| C5 | C4 | H4 | 119.9° | 120.0° |
| C6 | C5 | S8 | 121.2° | 119.9° |
| C5 | C6 | C7 | 122.4° | 120.2° |
| C5 | C6 | H6 | 118.8° | 119.9° |
| C5 | S8 | O9 | 110.8° | 106.4° |
| C5 | S8 | O10 | 111.1° | 106.4° |
| C5 | S8 | N11 | 110.1° | 107.2° |
| C7 | C6 | H6 | 118.8° | 119.9° |
| C6 | C7 | H7 | 120.8° | 120.0° |
| O9 | S8 | O10 | 112.3° | 123.2° |
| O9 | S8 | N11 | 105.8° | 106.4° |
| O10 | S8 | N11 | 106.6° | 106.4° |
| S8 | N11 | C12 | 113.6° | 120.0° |
| S8 | N11 | C16 | 113.4° | 120.0° |
| C12 | N11 | C16 | 112.9° | 120.0° |
| N11 | C12 | C13 | 114.1° | 109.5° |
| N11 | C12 | H12 | 108.0° | 109.5° |
| N11 | C12 | H12A | 108.0° | 109.5° |
| N11 | C16 | C17 | 108.8° | 109.4° |
| N11 | C16 | H16 | 109.7° | 109.5° |
| N11 | C16 | H16A | 109.7° | 109.5° |
| C12 | C13 | C14 | 114.0° | 109.4° |
| C12 | C13 | C15 | 109.1° | 109.5° |
| C13 | C12 | H12 | 108.0° | 109.4° |
| C13 | C12 | H12A | 108.0° | 109.5° |
| C12 | C13 | H13 | 107.1° | 109.5° |
| C14 | C13 | C15 | 110.9° | 109.5° |
| C14 | C13 | H13 | 105.1° | 109.5° |
| C13 | C14 | H14 | 109.5° | 109.5° |
| C13 | C14 | H14A | 109.5° | 109.5° |
| C13 | C14 | H14B | 109.5° | 109.4° |
| C13 | C15 | C18 | 113.8° | 109.5° |
| C15 | C13 | H13 | 110.4° | 109.5° |
| C13 | C15 | H15 | 108.1° | 109.5° |
| C13 | C15 | H15A | 108.0° | 109.5° |
| C18 | C15 | H15 | 108.0° | 109.5° |
| C18 | C15 | H15A | 108.0° | 109.4° |
| C15 | C18 | H18 | 109.5° | 109.5° |
| C15 | C18 | H18A | 109.4° | 109.5° |
| C15 | C18 | H18B | 109.5° | 109.5° |
| C16 | C17 | O18 | 111.3° | 109.5° |
| C16 | C17 | C19 | 112.7° | 109.5° |
| C17 | C16 | H16 | 109.7° | 109.5° |
| C17 | C16 | H16A | 109.7° | 109.5° |
| C16 | C17 | H17 | 106.0° | 109.5° |
| O18 | C17 | C19 | 109.4° | 109.4° |
| O18 | C17 | H17 | 109.4° | 109.5° |
| C17 | O18 | HO18 | 109.5° | 114.0° |
| C17 | C19 | N20 | 107.9° | 109.5° |
| C17 | C19 | C32 | 115.1° | 109.5° |
| C19 | C17 | H17 | 108.0° | 109.5° |
| C17 | C19 | H19 | 106.4° | 109.4° |
| N20 | C19 | C32 | 108.4° | 109.5° |
| C19 | N20 | C21 | 124.3° | 120.0° |
| N20 | C19 | H19 | 113.3° | 109.5° |
| C19 | N20 | HN20 | 117.8° | 120.0° |
| C19 | C32 | C38 | 110.5° | 109.5° |
| C32 | C19 | H19 | 105.8° | 109.5° |
| C19 | C32 | H32 | 109.1° | 109.5° |
| C19 | C32 | H32A | 109.1° | 109.5° |
| N20 | C21 | O22 | 129.6° | 120.0° |
| N20 | C21 | O23 | 111.0° | 120.0° |
| C21 | N20 | HN20 | 117.8° | 120.0° |
| O22 | C21 | O23 | 119.4° | 120.0° |
| C21 | O23 | C24 | 116.3° | 117.0° |
| O23 | C24 | C25 | 103.0° | 110.4° |
| O23 | C24 | C31 | 110.5° | 110.3° |
| O23 | C24 | H24 | 111.1° | 110.3° |
| C25 | C24 | C31 | 103.0° | 104.8° |
| C24 | C25 | O26 | 102.2° | 107.4° |
| C25 | C24 | H24 | 117.7° | 110.4° |
| C24 | C25 | H25 | 112.0° | 109.9° |
| C24 | C25 | H25A | 112.0° | 109.9° |
| C24 | C31 | C27 | 103.2° | 102.7° |
| C24 | C31 | C30 | 117.4° | 108.9° |
| C31 | C24 | H24 | 111.0° | 110.5° |
| C24 | C31 | H31 | 106.8° | 113.8° |
| C25 | O26 | C27 | 108.3° | 107.9° |
| O26 | C25 | H25 | 112.0° | 109.8° |
| O26 | C25 | H25A | 112.0° | 109.8° |
| O26 | C27 | O28 | 109.1° | 108.8° |
| O26 | C27 | C31 | 107.0° | 104.0° |
| O26 | C27 | H27 | 111.4° | 112.5° |
| O28 | C27 | C31 | 109.6° | 105.1° |
| C27 | O28 | C29 | 109.6° | 110.4° |
| O28 | C27 | H27 | 108.9° | 112.5° |
| C27 | C31 | C30 | 103.4° | 101.2° |
| C31 | C27 | H27 | 110.9° | 113.2° |
| C27 | C31 | H31 | 120.1° | 114.3° |
| O28 | C29 | C30 | 105.9° | 107.7° |
| O28 | C29 | H29 | 110.7° | 109.9° |
| O28 | C29 | H29A | 110.7° | 109.8° |
| C29 | C30 | C31 | 104.9° | 102.6° |
| C30 | C29 | H29 | 110.7° | 109.8° |
| C30 | C29 | H29A | 110.6° | 109.8° |
| C29 | C30 | H30 | 111.0° | 110.8° |
| C29 | C30 | H30A | 111.0° | 110.8° |
| C31 | C30 | H30 | 111.1° | 110.8° |
| C31 | C30 | H30A | 111.0° | 110.8° |
| C30 | C31 | H31 | 106.7° | 114.7° |
| C32 | C38 | C33 | 121.1° | 120.0° |
| C32 | C38 | C37 | 120.6° | 120.0° |
| C38 | C32 | H32 | 109.1° | 109.5° |
| C38 | C32 | H32A | 109.1° | 109.4° |
| C34 | C33 | C38 | 120.6° | 120.0° |
| C33 | C34 | C35 | 120.6° | 120.0° |
| C34 | C33 | H33 | 119.7° | 120.0° |
| C33 | C34 | H34 | 119.7° | 120.0° |
| C33 | C38 | C37 | 118.3° | 120.0° |
| C38 | C33 | H33 | 119.7° | 120.0° |
| C34 | C35 | C36 | 119.4° | 120.0° |
| C35 | C34 | H34 | 119.7° | 120.0° |
| C34 | C35 | H35 | 120.3° | 120.1° |
| C35 | C36 | C37 | 119.9° | 120.0° |
| C36 | C35 | H35 | 120.3° | 119.9° |
| C35 | C36 | H36 | 120.1° | 120.0° |
| C36 | C37 | C38 | 121.2° | 120.0° |
| C37 | C36 | H36 | 120.1° | 120.0° |
| C36 | C37 | H37 | 119.4° | 120.0° |
| C38 | C37 | H37 | 119.4° | 120.0° |
| H1 | C1 | H1A | 108.2° | 110.6° |
| H12 | C12 | H12A | 110.9° | 109.5° |
| H14 | C14 | H14A | 109.5° | 109.5° |
| H14 | C14 | H14B | 109.5° | 109.5° |
| H14A | C14 | H14B | 109.5° | 109.5° |
| H15 | C15 | H15A | 110.9° | 109.5° |
| H16 | C16 | H16A | 109.2° | 109.5° |
| H18 | C18 | H18A | 109.5° | 109.5° |
| H18 | C18 | H18B | 109.4° | 109.5° |
| H18A | C18 | H18B | 109.5° | 109.5° |
| H25 | C25 | H25A | 106.8° | 109.9° |
| H29 | C29 | H29A | 108.2° | 109.8° |
| H30 | C30 | H30A | 107.9° | 110.8° |
| H32 | C32 | H32A | 109.8° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | O2 | H1 | 120.0° | 118.6° |
| O1 | C1 | O2 | H1A | 120.0° | 118.6° |
| C1 | O1 | C2 | C3 | 0.9° | 17.2° |
| C1 | O1 | C2 | C7 | 178.4° | 162.7° |
| O1 | C1 | O2 | C3 | 4.1° | 27.1° |
| O1 | C1 | H1 | H1A | 121.5° | 122.9° |
| O2 | C1 | O1 | C2 | 3.0° | 27.1° |
| C1 | O2 | C3 | C2 | 3.6° | 17.3° |
| C1 | O2 | C3 | C4 | 179.2° | 162.7° |
| O2 | C1 | H1 | H1A | 121.5° | 122.8° |
| O1 | C2 | C3 | C7 | 179.4° | 179.9° |
| O1 | C2 | C3 | O2 | 1.7° | 0.1° |
| O1 | C2 | C3 | C4 | 179.2° | 180.0° |
| O1 | C2 | C7 | C6 | 179.7° | 179.9° |
| C2 | O1 | C1 | H1 | 123.1° | 145.7° |
| C2 | O1 | C1 | H1A | 117.0° | 91.5° |
| O1 | C2 | C7 | H7 | 0.3° | 0.0° |
| C2 | C3 | O2 | C4 | 177.2° | 180.0° |
| C2 | C3 | C4 | C5 | 2.4° | 0.0° |
| C3 | C2 | C7 | C6 | 0.5° | 0.0° |
| C2 | C3 | C4 | H4 | 177.6° | 179.9° |
| C3 | C2 | C7 | H7 | 179.5° | 179.9° |
| C7 | C2 | C3 | O2 | 178.9° | 180.0° |
| C7 | C2 | C3 | C4 | 1.5° | 0.0° |
| C2 | C7 | C6 | C5 | 0.4° | 0.0° |
| C2 | C7 | C6 | H7 | 180.0° | 179.9° |
| C2 | C7 | C6 | H6 | 179.6° | 180.0° |
| O2 | C3 | C4 | C5 | 179.3° | 180.0° |
| C3 | O2 | C1 | H1 | 124.1° | 145.7° |
| C3 | O2 | C1 | H1A | 115.9° | 91.5° |
| O2 | C3 | C4 | H4 | 0.8° | 0.0° |
| C3 | C4 | C5 | H4 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 2.2° | 0.0° |
| C3 | C4 | C5 | S8 | 176.4° | 180.0° |
| C4 | C5 | C6 | S8 | 178.6° | 180.0° |
| C4 | C5 | C6 | C7 | 1.2° | 0.1° |
| C4 | C5 | S8 | O9 | 154.2° | 156.5° |
| C4 | C5 | S8 | O10 | 28.7° | 23.5° |
| C4 | C5 | S8 | N11 | 89.2° | 90.0° |
| C4 | C5 | C6 | H6 | 178.8° | 180.0° |
| C5 | C6 | C7 | H6 | 180.0° | 179.9° |
| C6 | C5 | S8 | O9 | 27.3° | 23.5° |
| C6 | C5 | S8 | O10 | 152.8° | 156.4° |
| C6 | C5 | S8 | N11 | 89.4° | 90.0° |
| C6 | C5 | C4 | H4 | 177.8° | 180.0° |
| C5 | C6 | C7 | H7 | 179.6° | 180.0° |
| S8 | C5 | C6 | C7 | 177.4° | 179.9° |
| C5 | S8 | O9 | O10 | 124.9° | 123.0° |
| C5 | S8 | O9 | N11 | 119.3° | 114.1° |
| C5 | S8 | O10 | N11 | 119.9° | 114.1° |
| C5 | S8 | N11 | C12 | 51.7° | 90.0° |
| C5 | S8 | N11 | C16 | 79.0° | 90.1° |
| S8 | C5 | C4 | H4 | 3.6° | 0.0° |
| S8 | C5 | C6 | H6 | 2.6° | 0.0° |
| O9 | S8 | O10 | N11 | 115.4° | 123.0° |
| O9 | S8 | N11 | C12 | 171.5° | 23.5° |
| O9 | S8 | N11 | C16 | 40.8° | 156.4° |
| O10 | S8 | N11 | C12 | 68.8° | 156.5° |
| O10 | S8 | N11 | C16 | 160.4° | 23.5° |
| S8 | N11 | C12 | C16 | 131.0° | 180.0° |
| S8 | N11 | C12 | C13 | 150.8° | 93.3° |
| S8 | N11 | C16 | C17 | 122.7° | 94.1° |
| S8 | N11 | C12 | H12 | 30.8° | 146.7° |
| S8 | N11 | C12 | H12A | 89.2° | 26.6° |
| S8 | N11 | C16 | H16 | 117.2° | 145.9° |
| S8 | N11 | C16 | H16A | 2.7° | 25.9° |
| N11 | C12 | C13 | H12 | 120.0° | 120.0° |
| N11 | C12 | C13 | H12A | 120.0° | 120.0° |
| N11 | C12 | C13 | C14 | 62.6° | 65.3° |
| N11 | C12 | C13 | C15 | 172.7° | 174.7° |
| C12 | N11 | C16 | C17 | 106.2° | 85.9° |
| N11 | C12 | H12 | H12A | 118.1° | 120.0° |
| N11 | C12 | C13 | H13 | 53.2° | 54.7° |
| C12 | N11 | C16 | H16 | 13.8° | 34.1° |
| C12 | N11 | C16 | H16A | 133.8° | 154.1° |
| C16 | N11 | C12 | C13 | 78.2° | 86.6° |
| N11 | C16 | C17 | H16 | 120.0° | 120.0° |
| N11 | C16 | C17 | H16A | 120.0° | 120.0° |
| N11 | C16 | C17 | O18 | 167.5° | 65.0° |
| N11 | C16 | C17 | C19 | 69.2° | 175.0° |
| C16 | N11 | C12 | H12 | 161.8° | 33.3° |
| C16 | N11 | C12 | H12A | 41.8° | 153.4° |
| N11 | C16 | H16 | H16A | 120.3° | 120.0° |
| N11 | C16 | C17 | H17 | 48.6° | 55.0° |
| C12 | C13 | C14 | C15 | 123.7° | 120.0° |
| C12 | C13 | C14 | H13 | 117.0° | 120.0° |
| C12 | C13 | C15 | H13 | 117.5° | 120.0° |
| C12 | C13 | C15 | C18 | 57.2° | 175.0° |
| C13 | C12 | H12 | H12A | 118.1° | 120.0° |
| C12 | C13 | C14 | H14 | 180.0° | 67.0° |
| C12 | C13 | C14 | H14A | 60.0° | 53.0° |
| C12 | C13 | C14 | H14B | 60.0° | 173.0° |
| C12 | C13 | C15 | H15 | 62.8° | 64.9° |
| C12 | C13 | C15 | H15A | 177.2° | 55.0° |
| C14 | C13 | C15 | H13 | 116.1° | 120.0° |
| C14 | C13 | C15 | C18 | 69.2° | 65.0° |
| C14 | C13 | C12 | H12 | 57.4° | 54.7° |
| C14 | C13 | C12 | H12A | 177.4° | 174.7° |
| C13 | C14 | H14 | H14A | 120.0° | 120.0° |
| C13 | C14 | H14 | H14B | 120.0° | 120.0° |
| C13 | C14 | H14A | H14B | 120.0° | 119.9° |
| C14 | C13 | C15 | H15 | 170.7° | 55.0° |
| C14 | C13 | C15 | H15A | 50.7° | 175.0° |
| C13 | C15 | C18 | H15 | 120.0° | 120.0° |
| C13 | C15 | C18 | H15A | 120.0° | 120.0° |
| C15 | C13 | C12 | H12 | 67.3° | 65.3° |
| C15 | C13 | C12 | H12A | 52.7° | 54.7° |
| C15 | C13 | C14 | H14 | 56.3° | 173.0° |
| C15 | C13 | C14 | H14A | 176.3° | 67.0° |
| C15 | C13 | C14 | H14B | 63.7° | 53.0° |
| C13 | C15 | H15 | H15A | 118.2° | 120.0° |
| C13 | C15 | C18 | H18 | 180.0° | 60.0° |
| C13 | C15 | C18 | H18A | 60.0° | 60.0° |
| C13 | C15 | C18 | H18B | 60.0° | 180.0° |
| C18 | C15 | C13 | H13 | 174.7° | 55.0° |
| C18 | C15 | H15 | H15A | 118.2° | 120.0° |
| C15 | C18 | H18 | H18A | 120.0° | 120.0° |
| C15 | C18 | H18 | H18B | 120.0° | 120.0° |
| C15 | C18 | H18A | H18B | 120.0° | 120.0° |
| C16 | C17 | O18 | C19 | 125.2° | 120.0° |
| C16 | C17 | O18 | H17 | 116.8° | 120.1° |
| C16 | C17 | C19 | H17 | 116.6° | 120.0° |
| C16 | C17 | C19 | N20 | 167.5° | 175.0° |
| C16 | C17 | C19 | C32 | 71.4° | 65.0° |
| C17 | C16 | H16 | H16A | 120.3° | 120.0° |
| C16 | C17 | O18 | HO18 | 180.0° | 59.9° |
| C16 | C17 | C19 | H19 | 45.5° | 55.0° |
| O18 | C17 | C19 | H17 | 119.0° | 120.0° |
| O18 | C17 | C19 | N20 | 68.2° | 65.0° |
| O18 | C17 | C19 | C32 | 53.0° | 55.0° |
| O18 | C17 | C16 | H16 | 47.5° | 55.0° |
| O18 | C17 | C16 | H16A | 72.5° | 175.0° |
| O18 | C17 | C19 | H19 | 169.9° | 175.0° |
| C17 | C19 | N20 | C32 | 125.3° | 120.0° |
| C17 | C19 | N20 | H19 | 117.5° | 120.0° |
| C17 | C19 | C32 | H19 | 117.2° | 120.0° |
| C17 | C19 | N20 | C21 | 108.8° | 155.0° |
| C17 | C19 | C32 | C38 | 179.8° | 175.0° |
| C19 | C17 | C16 | H16 | 170.8° | 65.0° |
| C19 | C17 | C16 | H16A | 50.8° | 55.0° |
| C19 | C17 | O18 | HO18 | 54.9° | 60.1° |
| C17 | C19 | N20 | HN20 | 71.2° | 25.0° |
| C17 | C19 | C32 | H32 | 59.8° | 65.0° |
| C17 | C19 | C32 | H32A | 60.2° | 55.0° |
| N20 | C19 | C32 | H19 | 121.9° | 120.0° |
| C19 | N20 | C21 | HN20 | 180.0° | 180.0° |
| C19 | N20 | C21 | O22 | 0.4° | 0.0° |
| C19 | N20 | C21 | O23 | 178.6° | 180.0° |
| N20 | C19 | C32 | C38 | 58.9° | 65.0° |
| N20 | C19 | C17 | H17 | 50.8° | 55.0° |
| N20 | C19 | C32 | H32 | 61.1° | 55.0° |
| N20 | C19 | C32 | H32A | 178.9° | 175.0° |
| C32 | C19 | N20 | C21 | 126.0° | 85.0° |
| C19 | C32 | C38 | H32 | 120.0° | 120.0° |
| C19 | C32 | C38 | H32A | 120.0° | 120.0° |
| C19 | C32 | C38 | C33 | 109.1° | 90.0° |
| C19 | C32 | C38 | C37 | 70.3° | 90.0° |
| C32 | C19 | C17 | H17 | 172.0° | 175.0° |
| C32 | C19 | N20 | HN20 | 54.0° | 95.0° |
| C19 | C32 | H32 | H32A | 119.6° | 120.0° |
| N20 | C21 | O22 | O23 | 178.2° | 180.0° |
| N20 | C21 | O23 | C24 | 168.4° | 180.0° |
| C21 | N20 | C19 | H19 | 8.8° | 35.0° |
| O22 | C21 | O23 | C24 | 13.1° | 0.0° |
| O22 | C21 | N20 | HN20 | 179.7° | 180.0° |
| C21 | O23 | C24 | C25 | 146.2° | 91.5° |
| C21 | O23 | C24 | C31 | 104.3° | 153.2° |
| O23 | C21 | N20 | HN20 | 1.4° | 0.0° |
| C21 | O23 | C24 | H24 | 19.3° | 30.8° |
| O23 | C24 | C25 | C31 | 115.0° | 118.8° |
| O23 | C24 | C25 | H24 | 122.6° | 122.2° |
| O23 | C24 | C31 | H24 | 123.7° | 122.3° |
| O23 | C24 | C25 | O26 | 75.4° | 115.3° |
| O23 | C24 | C31 | C27 | 82.8° | 136.5° |
| O23 | C24 | C31 | C30 | 30.1° | 29.8° |
| O23 | C24 | C25 | H25 | 164.6° | 125.2° |
| O23 | C24 | C25 | H25A | 44.6° | 4.1° |
| O23 | C24 | C31 | H31 | 149.7° | 99.5° |
| C25 | C24 | C31 | H24 | 126.8° | 118.9° |
| C24 | C25 | O26 | H25 | 120.0° | 119.5° |
| C24 | C25 | O26 | H25A | 120.0° | 119.5° |
| C24 | C25 | O26 | C27 | 38.1° | 25.6° |
| C25 | C24 | C31 | C27 | 26.7° | 17.7° |
| C25 | C24 | C31 | C30 | 139.6° | 89.0° |
| C24 | C25 | H25 | H25A | 122.9° | 121.1° |
| C25 | C24 | C31 | H31 | 100.8° | 141.7° |
| C31 | C24 | C25 | O26 | 39.5° | 3.4° |
| C24 | C31 | C27 | O26 | 4.6° | 33.0° |
| C24 | C31 | C27 | O28 | 113.5° | 147.3° |
| C24 | C31 | C27 | C30 | 122.8° | 112.5° |
| C24 | C31 | C27 | H31 | 118.6° | 123.7° |
| C24 | C31 | C30 | C29 | 91.6° | 140.8° |
| C24 | C31 | C30 | H31 | 119.7° | 128.8° |
| C31 | C24 | C25 | H25 | 80.5° | 116.0° |
| C31 | C24 | C25 | H25A | 159.5° | 122.9° |
| C24 | C31 | C27 | H27 | 126.3° | 89.5° |
| C24 | C31 | C30 | H30 | 148.4° | 100.9° |
| C24 | C31 | C30 | H30A | 28.4° | 22.5° |
| C25 | O26 | C27 | O28 | 139.6° | 148.6° |
| C25 | O26 | C27 | C31 | 21.2° | 36.9° |
| O26 | C25 | C24 | H24 | 162.0° | 122.4° |
| O26 | C25 | H25 | H25A | 123.0° | 121.0° |
| C25 | O26 | C27 | H27 | 100.2° | 86.0° |
| O26 | C27 | O28 | C31 | 116.8° | 111.0° |
| O26 | C27 | O28 | H27 | 121.7° | 125.4° |
| O26 | C27 | C31 | H27 | 121.6° | 122.5° |
| O26 | C27 | O28 | C29 | 109.3° | 88.1° |
| O26 | C27 | C31 | C30 | 127.4° | 79.5° |
| C27 | O26 | C25 | H25 | 81.9° | 93.9° |
| C27 | O26 | C25 | H25A | 158.1° | 145.1° |
| O26 | C27 | C31 | H31 | 114.0° | 156.8° |
| O28 | C27 | C31 | H27 | 120.2° | 123.2° |
| C27 | O28 | C29 | C30 | 21.1° | 0.9° |
| O28 | C27 | C31 | C30 | 9.3° | 34.9° |
| C27 | O28 | C29 | H29 | 141.1° | 120.5° |
| C27 | O28 | C29 | H29A | 98.9° | 118.6° |
| O28 | C27 | C31 | H31 | 127.9° | 88.9° |
| C31 | C27 | O28 | C29 | 7.4° | 22.9° |
| C27 | C31 | C30 | C29 | 21.2° | 33.1° |
| C27 | C31 | C30 | H31 | 127.6° | 123.5° |
| C27 | C31 | C24 | H24 | 153.6° | 101.3° |
| C27 | C31 | C30 | H30 | 98.8° | 151.4° |
| C27 | C31 | C30 | H30A | 141.2° | 85.2° |
| O28 | C29 | C30 | H29 | 120.0° | 119.6° |
| O28 | C29 | C30 | H29A | 120.0° | 119.6° |
| O28 | C29 | C30 | C31 | 26.3° | 21.3° |
| C29 | O28 | C27 | H27 | 128.9° | 146.5° |
| O28 | C29 | H29 | H29A | 121.5° | 120.9° |
| O28 | C29 | C30 | H30 | 93.7° | 139.6° |
| O28 | C29 | C30 | H30A | 146.3° | 97.0° |
| C29 | C30 | C31 | H30 | 120.0° | 118.3° |
| C29 | C30 | C31 | H30A | 120.0° | 118.3° |
| C30 | C29 | H29 | H29A | 121.4° | 120.9° |
| C29 | C30 | H30 | H30A | 121.9° | 123.4° |
| C29 | C30 | C31 | H31 | 148.7° | 90.3° |
| C30 | C31 | C24 | H24 | 93.5° | 152.1° |
| C30 | C31 | C27 | H27 | 110.9° | 158.0° |
| C31 | C30 | C29 | H29 | 146.4° | 98.3° |
| C31 | C30 | C29 | H29A | 93.7° | 140.9° |
| C31 | C30 | H30 | H30A | 121.9° | 123.4° |
| C32 | C38 | C33 | C34 | 179.2° | 180.0° |
| C32 | C38 | C33 | C37 | 179.4° | 179.9° |
| C32 | C38 | C37 | C36 | 179.0° | 180.0° |
| C38 | C32 | C19 | H19 | 63.0° | 55.0° |
| C38 | C32 | H32 | H32A | 119.6° | 119.9° |
| C32 | C38 | C33 | H33 | 0.8° | 0.4° |
| C32 | C38 | C37 | H37 | 1.0° | 0.0° |
| C34 | C33 | C38 | H33 | 180.0° | 179.6° |
| C33 | C34 | C35 | H34 | 180.0° | 180.0° |
| C33 | C34 | C35 | C36 | 1.6° | 0.0° |
| C34 | C33 | C38 | C37 | 0.2° | 0.0° |
| C33 | C34 | C35 | H35 | 178.4° | 179.9° |
| C38 | C33 | C34 | C35 | 0.9° | 0.0° |
| C33 | C38 | C37 | C36 | 0.4° | 0.1° |
| C33 | C38 | C32 | H32 | 10.9° | 30.1° |
| C33 | C38 | C32 | H32A | 130.9° | 150.0° |
| C38 | C33 | C34 | H34 | 179.1° | 180.0° |
| C33 | C38 | C37 | H37 | 179.6° | 180.0° |
| C34 | C35 | C36 | H35 | 180.0° | 179.9° |
| C34 | C35 | C36 | C37 | 1.7° | 0.0° |
| C35 | C34 | C33 | H33 | 179.1° | 179.6° |
| C34 | C35 | C36 | H36 | 178.3° | 179.9° |
| C35 | C36 | C37 | H36 | 180.0° | 179.9° |
| C35 | C36 | C37 | C38 | 1.1° | 0.1° |
| C36 | C35 | C34 | H34 | 178.4° | 180.0° |
| C35 | C36 | C37 | H37 | 178.9° | 180.0° |
| C36 | C37 | C38 | H37 | 180.0° | 179.9° |
| C37 | C36 | C35 | H35 | 178.3° | 179.9° |
| C37 | C38 | C32 | H32 | 169.7° | 150.0° |
| C37 | C38 | C32 | H32A | 49.7° | 30.0° |
| C37 | C38 | C33 | H33 | 179.8° | 179.7° |
| C38 | C37 | C36 | H36 | 178.9° | 180.0° |
| H6 | C6 | C7 | H7 | 0.4° | 0.1° |
| H12 | C12 | C13 | H13 | 173.2° | 174.7° |
| H12A | C12 | C13 | H13 | 66.8° | 65.3° |
| H13 | C13 | C14 | H14 | 63.0° | 53.0° |
| H13 | C13 | C14 | H14A | 57.0° | 173.0° |
| H13 | C13 | C14 | H14B | 177.0° | 67.0° |
| H13 | C13 | C15 | H15 | 54.7° | 175.1° |
| H13 | C13 | C15 | H15A | 65.4° | 65.0° |
| H14 | C14 | H14A | H14B | 120.0° | 120.1° |
| H15 | C15 | C18 | H18 | 60.0° | 180.0° |
| H15 | C15 | C18 | H18A | 180.0° | 60.0° |
| H15 | C15 | C18 | H18B | 60.0° | 60.0° |
| H15A | C15 | C18 | H18 | 60.0° | 60.0° |
| H15A | C15 | C18 | H18A | 60.0° | 180.0° |
| H15A | C15 | C18 | H18B | 180.0° | 60.0° |
| H16 | C16 | C17 | H17 | 71.4° | 175.0° |
| H16A | C16 | C17 | H17 | 168.6° | 65.0° |
| H17 | C17 | O18 | HO18 | 63.2° | 180.0° |
| H17 | C17 | C19 | H19 | 71.1° | 65.0° |
| H18 | C18 | H18A | H18B | 120.0° | 120.0° |
| H19 | C19 | N20 | HN20 | 171.2° | 145.0° |
| H19 | C19 | C32 | H32 | 177.0° | 175.0° |
| H19 | C19 | C32 | H32A | 57.0° | 65.0° |
| H24 | C24 | C25 | H25 | 42.0° | 3.0° |
| H24 | C24 | C25 | H25A | 78.0° | 118.1° |
| H24 | C24 | C31 | H31 | 26.0° | 22.8° |
| H27 | C27 | C31 | H31 | 7.6° | 34.3° |
| H29 | C29 | C30 | H30 | 26.3° | 20.0° |
| H29 | C29 | C30 | H30A | 93.6° | 143.4° |
| H29A | C29 | C30 | H30 | 146.3° | 100.9° |
| H29A | C29 | C30 | H30A | 26.3° | 22.6° |
| H30 | C30 | C31 | H31 | 28.7° | 27.9° |
| H30A | C30 | C31 | H31 | 91.3° | 151.3° |
| H33 | C33 | C34 | H34 | 0.8° | 0.4° |
| H34 | C34 | C35 | H35 | 1.6° | 0.1° |
| H35 | C35 | C36 | H36 | 1.7° | 0.0° |
| H36 | C36 | C37 | H37 | 1.1° | 0.1° |
