MZ6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O22 | C21 | doub | 1.21Å | 1.22Å | |
| C21 | C22 | sing | 1.48Å | 1.49Å | |
| C21 | N20 | sing | 1.35Å | 1.33Å | |
| C22 | C23 | doub | 1.40Å | 1.40Å | Aromatic |
| C22 | C27 | sing | 1.39Å | 1.38Å | Aromatic |
| C27 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C26 | C25 | sing | 1.39Å | 1.39Å | Aromatic |
| C26 | O27 | sing | 1.36Å | 1.35Å | |
| O27 | HO27 | sing | 0.97Å | 0.95Å | |
| C25 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C24 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C24 | H24 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| N20 | C19 | sing | 1.47Å | 1.45Å | |
| N20 | HN20 | sing | 0.97Å | 1.00Å | |
| C19 | C32 | sing | 1.53Å | 1.54Å | |
| C19 | C17 | sing | 1.53Å | 1.52Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C32 | C38 | sing | 1.51Å | 1.53Å | |
| C32 | H321 | sing | 1.09Å | 1.10Å | |
| C32 | H322 | sing | 1.09Å | 1.10Å | |
| C38 | C37 | doub | 1.38Å | 1.39Å | Aromatic |
| C38 | C33 | sing | 1.38Å | 1.39Å | Aromatic |
| C37 | C36 | sing | 1.38Å | 1.40Å | Aromatic |
| C37 | H37 | sing | 1.08Å | 1.08Å | |
| C36 | C35 | doub | 1.38Å | 1.39Å | Aromatic |
| C36 | H36 | sing | 1.08Å | 1.08Å | |
| C35 | C34 | sing | 1.38Å | 1.39Å | Aromatic |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C34 | C33 | doub | 1.38Å | 1.39Å | Aromatic |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C17 | C16 | sing | 1.53Å | 1.54Å | |
| C17 | O18 | sing | 1.43Å | 1.44Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å | |
| C16 | N11 | sing | 1.46Å | 1.49Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| N11 | S8 | sing | 1.66Å | 1.64Å | |
| N11 | C12 | sing | 1.47Å | 1.48Å | |
| C12 | C13 | sing | 1.53Å | 1.54Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | C15 | sing | 1.53Å | 1.54Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C15 | C18 | sing | 1.53Å | 1.52Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.09Å | 1.10Å | |
| C18 | H181 | sing | 1.09Å | 1.10Å | |
| C18 | H182 | sing | 1.09Å | 1.10Å | |
| C18 | H183 | sing | 1.09Å | 1.10Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.09Å | 1.10Å | |
| C14 | H143 | sing | 1.09Å | 1.10Å | |
| S8 | O9 | doub | 1.42Å | 1.44Å | |
| S8 | O10 | doub | 1.42Å | 1.43Å | |
| S8 | C5 | sing | 1.76Å | 1.64Å | |
| C5 | C4 | doub | 1.38Å | 1.42Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | C7 | doub | 1.36Å | 1.39Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | C2 | sing | 1.41Å | 1.39Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C2 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
| C2 | N1 | sing | 1.35Å | 1.35Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.42Å | Aromatic |
| C3 | S1 | sing | 1.76Å | 1.71Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| N1 | C1 | doub | 1.28Å | 1.35Å | Aromatic |
| C1 | S1 | sing | 1.71Å | 1.74Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O22 | C21 | C22 | 118.7° | 120.0° |
| O22 | C21 | N20 | 125.3° | 120.0° |
| C22 | C21 | N20 | 115.9° | 120.0° |
| C21 | C22 | C23 | 116.9° | 120.1° |
| C21 | C22 | C27 | 123.1° | 120.1° |
| C21 | N20 | C19 | 123.8° | 120.0° |
| C21 | N20 | HN20 | 118.1° | 120.0° |
| C23 | C22 | C27 | 119.9° | 119.8° |
| C22 | C23 | C24 | 121.1° | 119.9° |
| C22 | C23 | H23 | 119.4° | 120.0° |
| C22 | C27 | C26 | 118.9° | 119.8° |
| C22 | C27 | H27 | 120.5° | 120.1° |
| C26 | C27 | H27 | 120.6° | 120.1° |
| C27 | C26 | C25 | 121.4° | 120.0° |
| C27 | C26 | O27 | 119.2° | 120.0° |
| C25 | C26 | O27 | 119.4° | 120.0° |
| C26 | C25 | C24 | 119.8° | 120.2° |
| C26 | C25 | H25 | 120.1° | 119.9° |
| C26 | O27 | HO27 | 109.5° | 114.0° |
| C24 | C25 | H25 | 120.1° | 119.9° |
| C25 | C24 | C23 | 118.8° | 120.3° |
| C25 | C24 | H24 | 120.6° | 119.8° |
| C23 | C24 | H24 | 120.6° | 119.9° |
| C24 | C23 | H23 | 119.5° | 120.1° |
| C19 | N20 | HN20 | 118.1° | 120.0° |
| N20 | C19 | C32 | 102.3° | 109.5° |
| N20 | C19 | C17 | 112.2° | 109.5° |
| N20 | C19 | H19 | 114.4° | 109.5° |
| C32 | C19 | C17 | 114.9° | 109.5° |
| C32 | C19 | H19 | 111.8° | 109.4° |
| C19 | C32 | C38 | 110.2° | 109.5° |
| C19 | C32 | H321 | 109.2° | 109.4° |
| C19 | C32 | H322 | 109.1° | 109.5° |
| C17 | C19 | H19 | 101.8° | 109.5° |
| C19 | C17 | C16 | 111.1° | 109.5° |
| C19 | C17 | O18 | 109.4° | 109.5° |
| C19 | C17 | H17 | 108.9° | 109.5° |
| C38 | C32 | H321 | 109.2° | 109.5° |
| C38 | C32 | H322 | 109.1° | 109.5° |
| C32 | C38 | C37 | 121.1° | 120.0° |
| C32 | C38 | C33 | 120.2° | 120.0° |
| H321 | C32 | H322 | 110.0° | 109.5° |
| C37 | C38 | C33 | 118.7° | 120.1° |
| C38 | C37 | C36 | 120.6° | 120.0° |
| C38 | C37 | H37 | 119.7° | 120.1° |
| C38 | C33 | C34 | 120.8° | 120.0° |
| C38 | C33 | H33 | 119.6° | 120.1° |
| C36 | C37 | H37 | 119.7° | 120.0° |
| C37 | C36 | C35 | 120.2° | 120.0° |
| C37 | C36 | H36 | 119.9° | 120.0° |
| C35 | C36 | H36 | 119.9° | 120.0° |
| C36 | C35 | C34 | 119.4° | 120.0° |
| C36 | C35 | H35 | 120.3° | 120.0° |
| C34 | C35 | H35 | 120.3° | 120.0° |
| C35 | C34 | C33 | 120.3° | 120.0° |
| C35 | C34 | H34 | 119.8° | 120.0° |
| C33 | C34 | H34 | 119.9° | 120.0° |
| C34 | C33 | H33 | 119.6° | 120.0° |
| C16 | C17 | O18 | 110.9° | 109.4° |
| C16 | C17 | H17 | 107.3° | 109.5° |
| C17 | C16 | N11 | 108.4° | 109.5° |
| C17 | C16 | H161 | 109.8° | 109.4° |
| C17 | C16 | H162 | 110.1° | 109.5° |
| O18 | C17 | H17 | 109.1° | 109.4° |
| C17 | O18 | HO18 | 109.5° | 113.9° |
| N11 | C16 | H161 | 109.8° | 109.5° |
| N11 | C16 | H162 | 110.1° | 109.5° |
| C16 | N11 | S8 | 113.9° | 120.0° |
| C16 | N11 | C12 | 112.3° | 120.0° |
| H161 | C16 | H162 | 108.6° | 109.4° |
| S8 | N11 | C12 | 111.2° | 120.0° |
| N11 | S8 | O9 | 105.5° | 106.4° |
| N11 | S8 | O10 | 108.2° | 106.4° |
| N11 | S8 | C5 | 111.2° | 107.2° |
| N11 | C12 | C13 | 109.0° | 109.5° |
| N11 | C12 | H121 | 109.6° | 109.5° |
| N11 | C12 | H122 | 109.7° | 109.5° |
| C13 | C12 | H121 | 109.6° | 109.5° |
| C13 | C12 | H122 | 109.7° | 109.4° |
| C12 | C13 | C14 | 113.0° | 109.5° |
| C12 | C13 | C15 | 110.3° | 109.5° |
| C12 | C13 | H13 | 107.1° | 109.5° |
| H121 | C12 | H122 | 109.1° | 109.5° |
| C14 | C13 | C15 | 111.4° | 109.5° |
| C14 | C13 | H13 | 106.0° | 109.4° |
| C13 | C14 | H141 | 109.5° | 109.5° |
| C13 | C14 | H142 | 109.4° | 109.5° |
| C13 | C14 | H143 | 109.5° | 109.5° |
| C15 | C13 | H13 | 108.8° | 109.5° |
| C13 | C15 | C18 | 114.5° | 109.5° |
| C13 | C15 | H151 | 107.8° | 109.5° |
| C13 | C15 | H152 | 106.7° | 109.5° |
| C18 | C15 | H151 | 107.8° | 109.4° |
| C18 | C15 | H152 | 106.7° | 109.4° |
| C15 | C18 | H181 | 109.5° | 109.5° |
| C15 | C18 | H182 | 109.5° | 109.5° |
| C15 | C18 | H183 | 109.5° | 109.5° |
| H151 | C15 | H152 | 113.5° | 109.5° |
| H181 | C18 | H182 | 109.5° | 109.4° |
| H181 | C18 | H183 | 109.4° | 109.5° |
| H182 | C18 | H183 | 109.5° | 109.4° |
| H141 | C14 | H142 | 109.5° | 109.5° |
| H141 | C14 | H143 | 109.4° | 109.5° |
| H142 | C14 | H143 | 109.5° | 109.4° |
| O9 | S8 | O10 | 110.6° | 123.2° |
| O9 | S8 | C5 | 110.0° | 106.4° |
| O10 | S8 | C5 | 111.2° | 106.4° |
| S8 | C5 | C4 | 125.0° | 120.0° |
| S8 | C5 | C6 | 117.8° | 120.0° |
| C4 | C5 | C6 | 117.1° | 120.1° |
| C5 | C4 | C3 | 121.5° | 119.9° |
| C5 | C4 | H4 | 119.3° | 120.0° |
| C5 | C6 | C7 | 121.5° | 120.8° |
| C5 | C6 | H6 | 119.3° | 119.7° |
| C7 | C6 | H6 | 119.3° | 119.6° |
| C6 | C7 | C2 | 121.3° | 120.4° |
| C6 | C7 | H7 | 119.4° | 119.8° |
| C2 | C7 | H7 | 119.3° | 119.7° |
| C7 | C2 | C3 | 119.7° | 118.5° |
| C7 | C2 | N1 | 129.7° | 129.7° |
| C3 | C2 | N1 | 110.6° | 111.8° |
| C2 | C3 | C4 | 118.9° | 120.3° |
| C2 | C3 | S1 | 114.7° | 108.0° |
| C2 | N1 | C1 | 113.0° | 117.8° |
| C4 | C3 | S1 | 126.4° | 131.7° |
| C3 | C4 | H4 | 119.2° | 120.0° |
| C3 | S1 | C1 | 86.9° | 90.8° |
| N1 | C1 | S1 | 114.8° | 111.6° |
| N1 | C1 | H1 | 122.6° | 124.2° |
| S1 | C1 | H1 | 122.6° | 124.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O22 | C21 | C22 | N20 | 177.5° | 179.7° |
| O22 | C21 | C22 | C23 | 130.2° | 180.0° |
| O22 | C21 | C22 | C27 | 47.2° | 0.3° |
| O22 | C21 | N20 | C19 | 3.9° | 0.0° |
| O22 | C21 | N20 | HN20 | 176.1° | 180.0° |
| C21 | C22 | C23 | C27 | 177.5° | 179.7° |
| C21 | C22 | C27 | C26 | 178.0° | 179.9° |
| C21 | C22 | C27 | H27 | 2.0° | 0.0° |
| C21 | C22 | C23 | C24 | 178.9° | 179.8° |
| C21 | C22 | C23 | H23 | 1.1° | 0.0° |
| C22 | C21 | N20 | C19 | 173.4° | 179.7° |
| C22 | C21 | N20 | HN20 | 6.5° | 0.3° |
| N20 | C21 | C22 | C23 | 47.3° | 0.3° |
| N20 | C21 | C22 | C27 | 135.3° | 179.4° |
| C21 | N20 | C19 | HN20 | 180.0° | 180.0° |
| C21 | N20 | C19 | C32 | 129.6° | 85.0° |
| C21 | N20 | C19 | C17 | 106.8° | 155.0° |
| C21 | N20 | C19 | H19 | 8.6° | 35.0° |
| C23 | C22 | C27 | C26 | 0.7° | 0.2° |
| C23 | C22 | C27 | H27 | 179.3° | 179.7° |
| C22 | C23 | C24 | C25 | 1.5° | 0.6° |
| C22 | C23 | C24 | H23 | 180.0° | 179.8° |
| C22 | C23 | C24 | H24 | 178.5° | 179.8° |
| C22 | C27 | C26 | H27 | 180.0° | 179.9° |
| C22 | C27 | C26 | C25 | 0.1° | 0.0° |
| C22 | C27 | C26 | O27 | 179.5° | 180.0° |
| C27 | C22 | C23 | C24 | 1.5° | 0.5° |
| C27 | C22 | C23 | H23 | 178.5° | 179.7° |
| C27 | C26 | C25 | O27 | 179.4° | 180.0° |
| C27 | C26 | O27 | HO27 | 115.2° | 90.0° |
| C27 | C26 | C25 | C24 | 0.1° | 0.0° |
| C27 | C26 | C25 | H25 | 179.9° | 179.9° |
| H27 | C27 | C26 | C25 | 179.9° | 180.0° |
| H27 | C27 | C26 | O27 | 0.5° | 0.1° |
| C25 | C26 | O27 | HO27 | 65.3° | 90.0° |
| C26 | C25 | C24 | H25 | 180.0° | 179.9° |
| C26 | C25 | C24 | C23 | 0.7° | 0.3° |
| C26 | C25 | C24 | H24 | 179.3° | 180.0° |
| O27 | C26 | C25 | C24 | 179.5° | 180.0° |
| O27 | C26 | C25 | H25 | 0.5° | 0.0° |
| C25 | C24 | C23 | H24 | 180.0° | 179.7° |
| C25 | C24 | C23 | H23 | 178.5° | 179.7° |
| H25 | C25 | C24 | C23 | 179.3° | 179.8° |
| H25 | C25 | C24 | H24 | 0.7° | 0.1° |
| H24 | C24 | C23 | H23 | 1.5° | 0.0° |
| N20 | C19 | C32 | C17 | 121.8° | 120.0° |
| N20 | C19 | C32 | H19 | 122.9° | 120.0° |
| N20 | C19 | C17 | H19 | 122.8° | 120.0° |
| N20 | C19 | C32 | C38 | 56.1° | 65.0° |
| N20 | C19 | C32 | H321 | 63.9° | 55.0° |
| N20 | C19 | C32 | H322 | 175.8° | 175.0° |
| N20 | C19 | C17 | C16 | 169.5° | 175.0° |
| N20 | C19 | C17 | O18 | 67.7° | 65.0° |
| N20 | C19 | C17 | H17 | 51.5° | 55.0° |
| HN20 | N20 | C19 | C32 | 50.4° | 95.0° |
| HN20 | N20 | C19 | C17 | 73.3° | 25.0° |
| HN20 | N20 | C19 | H19 | 171.4° | 145.0° |
| C32 | C19 | C17 | H19 | 121.0° | 119.9° |
| C19 | C32 | C38 | H321 | 120.0° | 119.9° |
| C19 | C32 | C38 | H322 | 119.7° | 120.0° |
| C19 | C32 | H321 | H322 | 119.7° | 120.0° |
| C19 | C32 | C38 | C37 | 71.0° | 90.0° |
| C19 | C32 | C38 | C33 | 109.4° | 90.3° |
| C32 | C19 | C17 | C16 | 74.2° | 64.9° |
| C32 | C19 | C17 | O18 | 48.6° | 55.0° |
| C32 | C19 | C17 | H17 | 167.8° | 175.0° |
| C17 | C19 | C32 | C38 | 177.9° | 175.0° |
| C17 | C19 | C32 | H321 | 57.9° | 65.1° |
| C17 | C19 | C32 | H322 | 62.4° | 54.9° |
| C19 | C17 | C16 | O18 | 122.0° | 120.0° |
| C19 | C17 | C16 | H17 | 119.0° | 120.1° |
| C19 | C17 | O18 | H17 | 119.0° | 120.0° |
| C19 | C17 | O18 | HO18 | 19.0° | 60.0° |
| C19 | C17 | C16 | N11 | 65.8° | 174.4° |
| C19 | C17 | C16 | H161 | 54.2° | 54.4° |
| C19 | C17 | C16 | H162 | 173.7° | 65.5° |
| H19 | C19 | C32 | C38 | 66.8° | 55.0° |
| H19 | C19 | C32 | H321 | 173.2° | 175.0° |
| H19 | C19 | C32 | H322 | 52.9° | 65.0° |
| H19 | C19 | C17 | C16 | 46.7° | 55.0° |
| H19 | C19 | C17 | O18 | 169.6° | 175.0° |
| H19 | C19 | C17 | H17 | 71.3° | 65.1° |
| C38 | C32 | H321 | H322 | 119.7° | 120.1° |
| C32 | C38 | C37 | C33 | 179.6° | 179.7° |
| C32 | C38 | C37 | C36 | 179.6° | 180.0° |
| C32 | C38 | C37 | H37 | 0.4° | 0.0° |
| C32 | C38 | C33 | C34 | 179.4° | 179.8° |
| C32 | C38 | C33 | H33 | 0.6° | 0.0° |
| H321 | C32 | C38 | C37 | 169.0° | 29.9° |
| H321 | C32 | C38 | C33 | 10.6° | 149.8° |
| H322 | C32 | C38 | C37 | 48.7° | 150.0° |
| H322 | C32 | C38 | C33 | 130.9° | 29.7° |
| C38 | C37 | C36 | H37 | 180.0° | 180.0° |
| C38 | C37 | C36 | C35 | 0.3° | 0.0° |
| C38 | C37 | C36 | H36 | 179.7° | 180.0° |
| C37 | C38 | C33 | C34 | 1.0° | 0.5° |
| C37 | C38 | C33 | H33 | 179.0° | 179.7° |
| C33 | C38 | C37 | C36 | 0.8° | 0.3° |
| C33 | C38 | C37 | H37 | 179.2° | 179.8° |
| C38 | C33 | C34 | C35 | 0.8° | 0.4° |
| C38 | C33 | C34 | H33 | 180.0° | 179.8° |
| C38 | C33 | C34 | H34 | 179.2° | 179.7° |
| C37 | C36 | C35 | H36 | 180.0° | 180.0° |
| C37 | C36 | C35 | C34 | 0.1° | 0.0° |
| C37 | C36 | C35 | H35 | 179.9° | 179.9° |
| H37 | C37 | C36 | C35 | 179.7° | 180.0° |
| H37 | C37 | C36 | H36 | 0.3° | 0.0° |
| C36 | C35 | C34 | H35 | 180.0° | 180.0° |
| C36 | C35 | C34 | C33 | 0.3° | 0.2° |
| C36 | C35 | C34 | H34 | 179.7° | 180.0° |
| H36 | C36 | C35 | C34 | 179.9° | 180.0° |
| H36 | C36 | C35 | H35 | 0.1° | 0.1° |
| C35 | C34 | C33 | H34 | 180.0° | 179.9° |
| C35 | C34 | C33 | H33 | 179.3° | 179.8° |
| H35 | C35 | C34 | C33 | 179.7° | 179.9° |
| H35 | C35 | C34 | H34 | 0.3° | 0.0° |
| H34 | C34 | C33 | H33 | 0.7° | 0.1° |
| C16 | C17 | O18 | H17 | 118.0° | 120.0° |
| C16 | C17 | O18 | HO18 | 142.0° | 60.0° |
| C17 | C16 | N11 | H161 | 120.0° | 119.9° |
| C17 | C16 | N11 | H162 | 120.5° | 120.1° |
| C17 | C16 | H161 | H162 | 120.5° | 120.0° |
| C17 | C16 | N11 | S8 | 120.8° | 114.4° |
| C17 | C16 | N11 | C12 | 111.6° | 65.6° |
| O18 | C17 | C16 | N11 | 172.2° | 65.6° |
| O18 | C17 | C16 | H161 | 67.8° | 174.4° |
| O18 | C17 | C16 | H162 | 51.8° | 54.5° |
| H17 | C17 | O18 | HO18 | 100.0° | 180.0° |
| H17 | C17 | C16 | N11 | 53.1° | 54.3° |
| H17 | C17 | C16 | H161 | 173.2° | 65.6° |
| H17 | C17 | C16 | H162 | 67.3° | 174.4° |
| N11 | C16 | H161 | H162 | 120.4° | 120.1° |
| C16 | N11 | S8 | C12 | 128.2° | 180.0° |
| C16 | N11 | C12 | C13 | 79.2° | 66.9° |
| C16 | N11 | C12 | H121 | 160.8° | 173.1° |
| C16 | N11 | C12 | H122 | 41.0° | 53.0° |
| C16 | N11 | S8 | O9 | 160.3° | 23.5° |
| C16 | N11 | S8 | O10 | 41.9° | 156.5° |
| C16 | N11 | S8 | C5 | 80.5° | 90.0° |
| H161 | C16 | N11 | S8 | 0.8° | 125.7° |
| H161 | C16 | N11 | C12 | 128.4° | 54.3° |
| H162 | C16 | N11 | S8 | 118.7° | 5.7° |
| H162 | C16 | N11 | C12 | 8.8° | 174.3° |
| S8 | N11 | C12 | C13 | 151.8° | 113.1° |
| S8 | N11 | C12 | H121 | 31.8° | 6.9° |
| S8 | N11 | C12 | H122 | 88.0° | 126.9° |
| N11 | S8 | O9 | O10 | 116.8° | 122.9° |
| N11 | S8 | O9 | C5 | 120.0° | 114.1° |
| N11 | S8 | O10 | C5 | 122.4° | 114.1° |
| N11 | S8 | C5 | C4 | 90.1° | 90.0° |
| N11 | S8 | C5 | C6 | 88.5° | 89.8° |
| N11 | C12 | C13 | H121 | 120.0° | 120.0° |
| N11 | C12 | C13 | H122 | 120.2° | 120.0° |
| N11 | C12 | H121 | H122 | 120.2° | 120.0° |
| N11 | C12 | C13 | C14 | 62.8° | 65.8° |
| N11 | C12 | C13 | C15 | 171.7° | 174.2° |
| N11 | C12 | C13 | H13 | 53.5° | 54.1° |
| C12 | N11 | S8 | O9 | 71.6° | 156.5° |
| C12 | N11 | S8 | O10 | 170.1° | 23.6° |
| C12 | N11 | S8 | C5 | 47.6° | 90.0° |
| C13 | C12 | H121 | H122 | 120.2° | 120.0° |
| C12 | C13 | C14 | C15 | 124.9° | 120.0° |
| C12 | C13 | C14 | H13 | 116.9° | 120.0° |
| C12 | C13 | C15 | H13 | 117.2° | 120.1° |
| C12 | C13 | C15 | C18 | 54.9° | 175.0° |
| C12 | C13 | C15 | H151 | 65.0° | 65.0° |
| C12 | C13 | C15 | H152 | 172.7° | 55.0° |
| C12 | C13 | C14 | H141 | 14.2° | 60.0° |
| C12 | C13 | C14 | H142 | 105.8° | 60.0° |
| C12 | C13 | C14 | H143 | 134.1° | 180.0° |
| H121 | C12 | C13 | C14 | 57.2° | 54.2° |
| H121 | C12 | C13 | C15 | 68.2° | 65.8° |
| H121 | C12 | C13 | H13 | 173.5° | 174.1° |
| H122 | C12 | C13 | C14 | 177.0° | 174.2° |
| H122 | C12 | C13 | C15 | 51.6° | 54.2° |
| H122 | C12 | C13 | H13 | 66.7° | 65.8° |
| C14 | C13 | C15 | H13 | 116.5° | 119.9° |
| C14 | C13 | C15 | C18 | 71.4° | 65.0° |
| C14 | C13 | C15 | H151 | 168.6° | 55.0° |
| C14 | C13 | C15 | H152 | 46.4° | 175.0° |
| C13 | C14 | H141 | H142 | 120.0° | 120.0° |
| C13 | C14 | H141 | H143 | 120.0° | 120.0° |
| C13 | C14 | H142 | H143 | 120.0° | 120.0° |
| C13 | C15 | C18 | H151 | 120.0° | 120.0° |
| C13 | C15 | C18 | H152 | 117.8° | 120.1° |
| C13 | C15 | H151 | H152 | 118.0° | 120.0° |
| C13 | C15 | C18 | H181 | 143.8° | 60.0° |
| C13 | C15 | C18 | H182 | 96.3° | 60.0° |
| C13 | C15 | C18 | H183 | 23.8° | 180.0° |
| C15 | C13 | C14 | H141 | 139.0° | 180.0° |
| C15 | C13 | C14 | H142 | 19.0° | 60.0° |
| C15 | C13 | C14 | H143 | 101.0° | 60.0° |
| H13 | C13 | C15 | C18 | 172.1° | 55.0° |
| H13 | C13 | C15 | H151 | 52.2° | 174.9° |
| H13 | C13 | C15 | H152 | 70.1° | 65.1° |
| H13 | C13 | C14 | H141 | 102.8° | 60.0° |
| H13 | C13 | C14 | H142 | 137.2° | 180.0° |
| H13 | C13 | C14 | H143 | 17.2° | 60.0° |
| C18 | C15 | H151 | H152 | 117.9° | 119.9° |
| C15 | C18 | H181 | H182 | 120.0° | 120.0° |
| C15 | C18 | H181 | H183 | 120.0° | 120.1° |
| C15 | C18 | H182 | H183 | 120.0° | 120.1° |
| H151 | C15 | C18 | H181 | 23.8° | 180.0° |
| H151 | C15 | C18 | H182 | 143.8° | 60.0° |
| H151 | C15 | C18 | H183 | 96.2° | 60.0° |
| H152 | C15 | C18 | H181 | 98.5° | 60.1° |
| H152 | C15 | C18 | H182 | 21.5° | 180.0° |
| H152 | C15 | C18 | H183 | 141.6° | 60.0° |
| H181 | C18 | H182 | H183 | 120.0° | 119.9° |
| H141 | C14 | H142 | H143 | 120.0° | 120.0° |
| O9 | S8 | O10 | C5 | 122.5° | 123.0° |
| O9 | S8 | C5 | C4 | 26.3° | 156.5° |
| O9 | S8 | C5 | C6 | 155.0° | 23.7° |
| O10 | S8 | C5 | C4 | 149.2° | 23.5° |
| O10 | S8 | C5 | C6 | 32.2° | 156.7° |
| S8 | C5 | C4 | C6 | 178.7° | 179.8° |
| S8 | C5 | C6 | C7 | 178.2° | 180.0° |
| S8 | C5 | C6 | H6 | 1.8° | 0.0° |
| S8 | C5 | C4 | C3 | 178.7° | 179.7° |
| S8 | C5 | C4 | H4 | 1.3° | 0.0° |
| C4 | C5 | C6 | C7 | 0.6° | 0.3° |
| C4 | C5 | C6 | H6 | 179.4° | 179.8° |
| C5 | C4 | C3 | C2 | 0.4° | 0.5° |
| C5 | C4 | C3 | H4 | 180.0° | 179.7° |
| C5 | C4 | C3 | S1 | 179.8° | 179.9° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | C2 | 0.8° | 0.0° |
| C5 | C6 | C7 | H7 | 179.2° | 180.0° |
| C6 | C5 | C4 | C3 | 0.0° | 0.5° |
| C6 | C5 | C4 | H4 | 180.0° | 179.8° |
| C6 | C7 | C2 | H7 | 180.0° | 180.0° |
| C6 | C7 | C2 | C3 | 0.3° | 0.0° |
| C6 | C7 | C2 | N1 | 179.7° | 180.0° |
| H6 | C6 | C7 | C2 | 179.2° | 180.0° |
| H6 | C6 | C7 | H7 | 0.8° | 0.0° |
| C7 | C2 | C3 | N1 | 180.0° | 180.0° |
| C7 | C2 | C3 | C4 | 0.3° | 0.3° |
| C7 | C2 | C3 | S1 | 179.9° | 180.0° |
| C7 | C2 | N1 | C1 | 179.9° | 180.0° |
| H7 | C7 | C2 | C3 | 179.7° | 180.0° |
| H7 | C7 | C2 | N1 | 0.3° | 0.0° |
| C2 | C3 | C4 | S1 | 179.8° | 179.6° |
| C2 | C3 | C4 | H4 | 179.6° | 179.8° |
| C3 | C2 | N1 | C1 | 0.1° | 0.0° |
| C2 | C3 | S1 | C1 | 0.2° | 0.0° |
| N1 | C2 | C3 | C4 | 179.7° | 179.7° |
| N1 | C2 | C3 | S1 | 0.1° | 0.0° |
| C2 | N1 | C1 | S1 | 0.2° | 0.0° |
| C2 | N1 | C1 | H1 | 179.7° | 180.0° |
| C4 | C3 | S1 | C1 | 179.6° | 179.7° |
| S1 | C3 | C4 | H4 | 0.2° | 0.1° |
| C3 | S1 | C1 | N1 | 0.3° | 0.0° |
| C3 | S1 | C1 | H1 | 179.7° | 180.0° |
| N1 | C1 | S1 | H1 | 180.0° | 180.0° |
