MZ7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O9 | S8 | doub | 1.42Å | 1.43Å | |
| S8 | O10 | doub | 1.42Å | 1.44Å | |
| S8 | N11 | sing | 1.66Å | 1.62Å | |
| S8 | C5 | sing | 1.76Å | 1.62Å | |
| C5 | C4 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C6 | sing | 1.39Å | 1.39Å | 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 | |
| C4 | C3 | sing | 1.39Å | 1.41Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | S1 | sing | 1.76Å | 1.70Å | Aromatic |
| C3 | C2 | doub | 1.40Å | 1.39Å | Aromatic |
| C2 | N1 | sing | 1.35Å | 1.36Å | Aromatic |
| N1 | C1 | doub | 1.28Å | 1.36Å | Aromatic |
| S1 | C1 | sing | 1.71Å | 1.74Å | Aromatic |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| N11 | C16 | sing | 1.46Å | 1.48Å | |
| N11 | C12 | sing | 1.46Å | 1.47Å | |
| C12 | C13 | sing | 1.53Å | 1.53Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C13 | C14 | sing | 1.53Å | 1.53Å | |
| C13 | H131 | sing | 1.09Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | 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 | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| C17 | C19 | sing | 1.53Å | 1.54Å | |
| C17 | O18 | sing | 1.43Å | 1.43Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å | |
| C19 | N20 | sing | 1.47Å | 1.45Å | |
| C19 | C32 | sing | 1.53Å | 1.53Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| N20 | C21 | sing | 1.35Å | 1.34Å | |
| N20 | HN20 | sing | 0.97Å | 1.00Å | |
| C21 | O22 | doub | 1.21Å | 1.22Å | |
| C21 | C22 | sing | 1.51Å | 1.51Å | |
| C22 | N26 | sing | 1.46Å | 1.45Å | |
| C22 | C23 | sing | 1.53Å | 1.52Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | C25 | sing | 1.53Å | 1.54Å | |
| C23 | C24 | sing | 1.53Å | 1.52Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H251 | sing | 1.09Å | 1.10Å | |
| C25 | H252 | sing | 1.09Å | 1.10Å | |
| C25 | H253 | sing | 1.09Å | 1.10Å | |
| C24 | H241 | sing | 1.09Å | 1.10Å | |
| C24 | H242 | sing | 1.09Å | 1.10Å | |
| C24 | H243 | sing | 1.09Å | 1.10Å | |
| N26 | C27 | sing | 1.35Å | 1.33Å | |
| N26 | HN26 | sing | 0.97Å | 1.00Å | |
| C27 | C29 | sing | 1.51Å | 1.50Å | |
| C27 | O28 | doub | 1.21Å | 1.23Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H293 | sing | 1.09Å | 1.10Å | |
| C32 | C38 | sing | 1.51Å | 1.51Å | |
| 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 |
| C33 | C34 | doub | 1.38Å | 1.39Å | Aromatic |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C34 | C35 | sing | 1.38Å | 1.39Å | Aromatic |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C35 | C36 | doub | 1.38Å | 1.39Å | Aromatic |
| C35 | H35 | sing | 1.08Å | 1.08Å | |
| C36 | C37 | sing | 1.38Å | 1.39Å | Aromatic |
| 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) |
| O9 | S8 | O10 | 110.5° | 123.2° |
| O9 | S8 | N11 | 107.9° | 106.4° |
| O9 | S8 | C5 | 111.5° | 106.4° |
| O10 | S8 | N11 | 106.2° | 106.4° |
| O10 | S8 | C5 | 109.2° | 106.4° |
| N11 | S8 | C5 | 111.4° | 107.2° |
| S8 | N11 | C16 | 113.0° | 120.0° |
| S8 | N11 | C12 | 112.8° | 120.0° |
| S8 | C5 | C4 | 124.3° | 119.9° |
| S8 | C5 | C6 | 117.8° | 120.0° |
| C4 | C5 | C6 | 117.8° | 120.1° |
| C5 | C4 | C3 | 121.4° | 119.9° |
| C5 | C4 | H4 | 119.3° | 120.0° |
| C5 | C6 | C7 | 121.0° | 120.8° |
| C5 | C6 | H6 | 119.5° | 119.6° |
| C7 | C6 | H6 | 119.5° | 119.6° |
| C6 | C7 | C2 | 120.9° | 120.5° |
| C6 | C7 | H7 | 119.6° | 119.8° |
| C2 | C7 | H7 | 119.5° | 119.8° |
| C7 | C2 | C3 | 119.4° | 118.5° |
| C7 | C2 | N1 | 130.4° | 129.7° |
| C3 | C4 | H4 | 119.3° | 120.1° |
| C4 | C3 | S1 | 124.5° | 131.7° |
| C4 | C3 | C2 | 119.5° | 120.3° |
| S1 | C3 | C2 | 116.0° | 108.0° |
| C3 | S1 | C1 | 86.3° | 90.8° |
| C3 | C2 | N1 | 110.1° | 111.8° |
| C2 | N1 | C1 | 112.4° | 117.9° |
| N1 | C1 | S1 | 115.1° | 111.5° |
| N1 | C1 | H1 | 122.5° | 124.2° |
| S1 | C1 | H1 | 122.4° | 124.2° |
| C16 | N11 | C12 | 113.6° | 120.0° |
| N11 | C16 | C17 | 109.3° | 109.5° |
| N11 | C16 | H161 | 109.6° | 109.5° |
| N11 | C16 | H162 | 109.6° | 109.5° |
| N11 | C12 | C13 | 109.7° | 109.4° |
| N11 | C12 | H121 | 109.4° | 109.5° |
| N11 | C12 | H122 | 109.3° | 109.5° |
| C13 | C12 | H121 | 109.4° | 109.5° |
| C13 | C12 | H122 | 109.3° | 109.5° |
| C12 | C13 | C14 | 110.5° | 109.4° |
| C12 | C13 | H131 | 109.1° | 109.5° |
| C12 | C13 | H132 | 108.9° | 109.5° |
| H121 | C12 | H122 | 109.6° | 109.4° |
| C14 | C13 | H131 | 109.1° | 109.5° |
| C14 | C13 | H132 | 108.9° | 109.5° |
| C13 | C14 | C15 | 117.0° | 109.5° |
| C13 | C14 | H141 | 107.0° | 109.5° |
| C13 | C14 | H142 | 105.3° | 109.5° |
| H131 | C13 | H132 | 110.3° | 109.5° |
| C15 | C14 | H141 | 107.1° | 109.5° |
| C15 | C14 | H142 | 105.3° | 109.4° |
| C14 | C15 | C18 | 112.9° | 109.5° |
| C14 | C15 | H151 | 108.4° | 109.5° |
| C14 | C15 | H152 | 107.6° | 109.5° |
| H141 | C14 | H142 | 115.6° | 109.5° |
| C18 | C15 | H151 | 108.3° | 109.5° |
| C18 | C15 | H152 | 107.5° | 109.4° |
| C15 | C18 | H181 | 109.5° | 109.5° |
| C15 | C18 | H182 | 109.4° | 109.5° |
| C15 | C18 | H183 | 109.4° | 109.4° |
| H151 | C15 | H152 | 112.2° | 109.5° |
| H181 | C18 | H182 | 109.5° | 109.5° |
| H181 | C18 | H183 | 109.4° | 109.5° |
| H182 | C18 | H183 | 109.5° | 109.5° |
| C17 | C16 | H161 | 109.5° | 109.4° |
| C17 | C16 | H162 | 109.5° | 109.5° |
| C16 | C17 | C19 | 113.8° | 109.4° |
| C16 | C17 | O18 | 107.6° | 109.4° |
| C16 | C17 | H17 | 108.4° | 109.5° |
| H161 | C16 | H162 | 109.3° | 109.4° |
| C19 | C17 | O18 | 111.1° | 109.5° |
| C19 | C17 | H17 | 104.7° | 109.5° |
| C17 | C19 | N20 | 111.3° | 109.4° |
| C17 | C19 | C32 | 113.3° | 109.5° |
| C17 | C19 | H19 | 105.3° | 109.5° |
| O18 | C17 | H17 | 111.3° | 109.5° |
| C17 | O18 | HO18 | 109.5° | 114.0° |
| N20 | C19 | C32 | 108.8° | 109.4° |
| N20 | C19 | H19 | 110.1° | 109.5° |
| C19 | N20 | C21 | 126.9° | 120.0° |
| C19 | N20 | HN20 | 116.6° | 120.0° |
| C32 | C19 | H19 | 108.0° | 109.5° |
| C19 | C32 | C38 | 110.7° | 109.5° |
| C19 | C32 | H321 | 109.0° | 109.4° |
| C19 | C32 | H322 | 108.8° | 109.4° |
| C21 | N20 | HN20 | 116.6° | 120.0° |
| N20 | C21 | O22 | 126.2° | 120.0° |
| N20 | C21 | C22 | 113.8° | 120.0° |
| O22 | C21 | C22 | 120.0° | 120.0° |
| C21 | C22 | N26 | 112.4° | 109.5° |
| C21 | C22 | C23 | 113.6° | 109.5° |
| C21 | C22 | H22 | 104.7° | 109.5° |
| N26 | C22 | C23 | 110.3° | 109.5° |
| N26 | C22 | H22 | 108.4° | 109.5° |
| C22 | N26 | C27 | 121.6° | 120.0° |
| C22 | N26 | HN26 | 119.2° | 120.0° |
| C23 | C22 | H22 | 107.1° | 109.5° |
| C22 | C23 | C25 | 111.2° | 109.5° |
| C22 | C23 | C24 | 109.3° | 109.5° |
| C22 | C23 | H23 | 109.1° | 109.5° |
| C25 | C23 | C24 | 111.4° | 109.5° |
| C25 | C23 | H23 | 106.9° | 109.4° |
| C23 | C25 | H251 | 109.5° | 109.4° |
| C23 | C25 | H252 | 109.4° | 109.5° |
| C23 | C25 | H253 | 109.5° | 109.4° |
| C24 | C23 | H23 | 108.9° | 109.5° |
| C23 | C24 | H241 | 109.5° | 109.5° |
| C23 | C24 | H242 | 109.5° | 109.5° |
| C23 | C24 | H243 | 109.5° | 109.5° |
| H251 | C25 | H252 | 109.5° | 109.5° |
| H251 | C25 | H253 | 109.4° | 109.5° |
| H252 | C25 | H253 | 109.5° | 109.5° |
| H241 | C24 | H242 | 109.5° | 109.5° |
| H241 | C24 | H243 | 109.5° | 109.5° |
| H242 | C24 | H243 | 109.5° | 109.5° |
| C27 | N26 | HN26 | 119.2° | 120.0° |
| N26 | C27 | C29 | 113.7° | 120.0° |
| N26 | C27 | O28 | 123.4° | 120.0° |
| C29 | C27 | O28 | 122.9° | 120.0° |
| C27 | C29 | H291 | 109.5° | 109.4° |
| C27 | C29 | H292 | 109.5° | 109.4° |
| C27 | C29 | H293 | 109.4° | 109.5° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H291 | C29 | H293 | 109.5° | 109.5° |
| H292 | C29 | H293 | 109.5° | 109.5° |
| C38 | C32 | H321 | 109.0° | 109.5° |
| C38 | C32 | H322 | 108.8° | 109.5° |
| C32 | C38 | C37 | 120.7° | 120.0° |
| C32 | C38 | C33 | 119.9° | 120.0° |
| H321 | C32 | H322 | 110.5° | 109.5° |
| C37 | C38 | C33 | 119.3° | 120.0° |
| C38 | C37 | C36 | 120.5° | 120.0° |
| C38 | C37 | H37 | 119.8° | 120.0° |
| C38 | C33 | C34 | 120.4° | 120.0° |
| C38 | C33 | H33 | 119.8° | 120.0° |
| C34 | C33 | H33 | 119.8° | 120.0° |
| C33 | C34 | C35 | 119.9° | 120.0° |
| C33 | C34 | H34 | 120.0° | 120.0° |
| C35 | C34 | H34 | 120.1° | 120.0° |
| C34 | C35 | C36 | 120.1° | 120.0° |
| C34 | C35 | H35 | 119.9° | 120.0° |
| C36 | C35 | H35 | 119.9° | 119.9° |
| C35 | C36 | C37 | 119.8° | 120.0° |
| C35 | C36 | H36 | 120.1° | 120.0° |
| C37 | C36 | H36 | 120.1° | 120.0° |
| C36 | C37 | H37 | 119.8° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O9 | S8 | O10 | N11 | 116.8° | 123.0° |
| O9 | S8 | O10 | C5 | 123.0° | 122.9° |
| O9 | S8 | N11 | C5 | 122.7° | 113.5° |
| O9 | S8 | C5 | C4 | 29.2° | 156.4° |
| O9 | S8 | C5 | C6 | 151.9° | 23.8° |
| O9 | S8 | N11 | C16 | 152.3° | 23.5° |
| O9 | S8 | N11 | C12 | 77.1° | 156.4° |
| O10 | S8 | N11 | C5 | 118.8° | 113.5° |
| O10 | S8 | C5 | C4 | 151.6° | 23.5° |
| O10 | S8 | C5 | C6 | 29.5° | 156.7° |
| O10 | S8 | N11 | C16 | 33.8° | 156.4° |
| O10 | S8 | N11 | C12 | 164.4° | 23.5° |
| N11 | S8 | C5 | C4 | 91.4° | 90.0° |
| N11 | S8 | C5 | C6 | 87.5° | 89.8° |
| S8 | N11 | C16 | C12 | 130.2° | 179.9° |
| S8 | N11 | C12 | C13 | 148.2° | 95.0° |
| S8 | N11 | C12 | H121 | 28.2° | 145.0° |
| S8 | N11 | C12 | H122 | 91.9° | 25.0° |
| S8 | N11 | C16 | C17 | 119.8° | 95.0° |
| S8 | N11 | C16 | H161 | 120.2° | 145.1° |
| S8 | N11 | C16 | H162 | 0.3° | 25.1° |
| S8 | C5 | C4 | C6 | 178.9° | 179.8° |
| S8 | C5 | C6 | C7 | 178.9° | 180.0° |
| S8 | C5 | C6 | H6 | 1.1° | 0.0° |
| S8 | C5 | C4 | C3 | 179.7° | 180.0° |
| S8 | C5 | C4 | H4 | 0.3° | 0.0° |
| C5 | S8 | N11 | C16 | 85.0° | 90.0° |
| C5 | S8 | N11 | C12 | 45.7° | 90.0° |
| C4 | C5 | C6 | C7 | 0.1° | 0.2° |
| C4 | C5 | C6 | H6 | 179.9° | 179.7° |
| C5 | C4 | C3 | H4 | 180.0° | 180.0° |
| C5 | C4 | C3 | S1 | 179.4° | 179.9° |
| C5 | C4 | C3 | C2 | 1.3° | 0.0° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | C2 | 0.5° | 0.1° |
| C5 | C6 | C7 | H7 | 179.5° | 180.0° |
| C6 | C5 | C4 | C3 | 0.8° | 0.2° |
| C6 | C5 | C4 | H4 | 179.2° | 179.8° |
| C6 | C7 | C2 | H7 | 180.0° | 179.9° |
| C6 | C7 | C2 | C3 | 0.0° | 0.3° |
| C6 | C7 | C2 | N1 | 178.7° | 180.0° |
| H6 | C6 | C7 | C2 | 179.5° | 180.0° |
| H6 | C6 | C7 | H7 | 0.5° | 0.0° |
| C7 | C2 | C3 | C4 | 0.9° | 0.3° |
| C7 | C2 | C3 | S1 | 179.7° | 179.7° |
| C7 | C2 | C3 | N1 | 178.9° | 179.7° |
| C7 | C2 | N1 | C1 | 179.6° | 180.0° |
| H7 | C7 | C2 | C3 | 180.0° | 179.7° |
| H7 | C7 | C2 | N1 | 1.3° | 0.1° |
| C4 | C3 | S1 | C2 | 179.3° | 180.0° |
| C4 | C3 | C2 | N1 | 178.1° | 180.0° |
| C4 | C3 | S1 | C1 | 178.8° | 179.8° |
| H4 | C4 | C3 | S1 | 0.6° | 0.0° |
| H4 | C4 | C3 | C2 | 178.7° | 180.0° |
| S1 | C3 | C2 | N1 | 1.3° | 0.0° |
| C3 | S1 | C1 | N1 | 0.5° | 0.4° |
| C3 | S1 | C1 | H1 | 179.5° | 180.0° |
| C3 | C2 | N1 | C1 | 1.6° | 0.3° |
| C2 | C3 | S1 | C1 | 0.5° | 0.3° |
| C2 | N1 | C1 | S1 | 1.3° | 0.5° |
| C2 | N1 | C1 | H1 | 178.7° | 180.0° |
| N1 | C1 | S1 | H1 | 180.0° | 179.5° |
| C16 | N11 | C12 | C13 | 81.5° | 85.0° |
| C16 | N11 | C12 | H121 | 158.5° | 35.0° |
| C16 | N11 | C12 | H122 | 38.4° | 155.0° |
| N11 | C16 | C17 | H161 | 120.0° | 120.0° |
| N11 | C16 | C17 | H162 | 120.1° | 120.0° |
| N11 | C16 | H161 | H162 | 120.1° | 120.0° |
| N11 | C16 | C17 | C19 | 73.9° | 175.0° |
| N11 | C16 | C17 | O18 | 162.5° | 65.0° |
| N11 | C16 | C17 | H17 | 42.0° | 55.0° |
| N11 | C12 | C13 | H121 | 120.0° | 120.0° |
| N11 | C12 | C13 | H122 | 119.9° | 120.0° |
| N11 | C12 | H121 | H122 | 119.9° | 120.0° |
| N11 | C12 | C13 | C14 | 169.9° | 180.0° |
| N11 | C12 | C13 | H131 | 70.1° | 60.0° |
| N11 | C12 | C13 | H132 | 50.3° | 60.0° |
| C12 | N11 | C16 | C17 | 110.0° | 85.0° |
| C12 | N11 | C16 | H161 | 10.0° | 35.0° |
| C12 | N11 | C16 | H162 | 129.9° | 155.0° |
| C13 | C12 | H121 | H122 | 119.9° | 120.0° |
| C12 | C13 | C14 | H131 | 120.0° | 120.0° |
| C12 | C13 | C14 | H132 | 119.6° | 120.0° |
| C12 | C13 | H131 | H132 | 119.6° | 120.0° |
| C12 | C13 | C14 | C15 | 62.8° | 180.0° |
| C12 | C13 | C14 | H141 | 57.2° | 60.0° |
| C12 | C13 | C14 | H142 | 179.3° | 60.0° |
| H121 | C12 | C13 | C14 | 49.9° | 60.0° |
| H121 | C12 | C13 | H131 | 169.9° | 180.0° |
| H121 | C12 | C13 | H132 | 69.7° | 60.0° |
| H122 | C12 | C13 | C14 | 70.2° | 60.0° |
| H122 | C12 | C13 | H131 | 49.8° | 60.0° |
| H122 | C12 | C13 | H132 | 170.2° | 180.0° |
| C14 | C13 | H131 | H132 | 119.6° | 120.0° |
| C13 | C14 | C15 | H141 | 120.0° | 120.0° |
| C13 | C14 | C15 | H142 | 116.5° | 120.0° |
| C13 | C14 | H141 | H142 | 116.8° | 120.1° |
| C13 | C14 | C15 | C18 | 52.8° | 180.0° |
| C13 | C14 | C15 | H151 | 67.2° | 60.0° |
| C13 | C14 | C15 | H152 | 171.3° | 60.0° |
| H131 | C13 | C14 | C15 | 177.2° | 60.0° |
| H131 | C13 | C14 | H141 | 62.8° | 180.0° |
| H131 | C13 | C14 | H142 | 60.7° | 59.9° |
| H132 | C13 | C14 | C15 | 56.8° | 60.0° |
| H132 | C13 | C14 | H141 | 176.8° | 60.0° |
| H132 | C13 | C14 | H142 | 59.7° | 180.0° |
| C15 | C14 | H141 | H142 | 116.9° | 119.9° |
| C14 | C15 | C18 | H151 | 120.0° | 120.0° |
| C14 | C15 | C18 | H152 | 118.5° | 120.0° |
| C14 | C15 | H151 | H152 | 118.6° | 120.0° |
| C14 | C15 | C18 | H181 | 99.6° | 180.0° |
| C14 | C15 | C18 | H182 | 140.4° | 60.0° |
| C14 | C15 | C18 | H183 | 20.4° | 60.0° |
| H141 | C14 | C15 | C18 | 172.8° | 60.0° |
| H141 | C14 | C15 | H151 | 52.8° | 180.0° |
| H141 | C14 | C15 | H152 | 68.7° | 60.0° |
| H142 | C14 | C15 | C18 | 63.6° | 60.0° |
| H142 | C14 | C15 | H151 | 176.4° | 60.1° |
| H142 | C14 | C15 | H152 | 54.8° | 180.0° |
| C18 | C15 | H151 | H152 | 118.6° | 120.0° |
| C15 | C18 | H181 | H182 | 120.0° | 120.0° |
| C15 | C18 | H181 | H183 | 120.0° | 120.0° |
| C15 | C18 | H182 | H183 | 120.0° | 120.0° |
| H151 | C15 | C18 | H181 | 20.4° | 60.0° |
| H151 | C15 | C18 | H182 | 99.6° | 180.0° |
| H151 | C15 | C18 | H183 | 140.4° | 60.0° |
| H152 | C15 | C18 | H181 | 141.9° | 60.0° |
| H152 | C15 | C18 | H182 | 21.9° | 60.0° |
| H152 | C15 | C18 | H183 | 98.1° | 180.0° |
| H181 | C18 | H182 | H183 | 120.0° | 120.0° |
| C17 | C16 | H161 | H162 | 120.0° | 120.0° |
| C16 | C17 | C19 | O18 | 121.7° | 119.9° |
| C16 | C17 | C19 | H17 | 118.1° | 120.0° |
| C16 | C17 | O18 | H17 | 118.6° | 120.0° |
| C16 | C17 | O18 | HO18 | 141.4° | 60.0° |
| C16 | C17 | C19 | N20 | 165.9° | 175.0° |
| C16 | C17 | C19 | C32 | 71.1° | 65.0° |
| C16 | C17 | C19 | H19 | 46.7° | 55.0° |
| H161 | C16 | C17 | C19 | 166.0° | 65.0° |
| H161 | C16 | C17 | O18 | 42.4° | 55.0° |
| H161 | C16 | C17 | H17 | 78.0° | 175.0° |
| H162 | C16 | C17 | C19 | 46.1° | 55.0° |
| H162 | C16 | C17 | O18 | 77.5° | 175.0° |
| H162 | C16 | C17 | H17 | 162.1° | 65.0° |
| C19 | C17 | O18 | H17 | 116.2° | 120.1° |
| C19 | C17 | O18 | HO18 | 16.2° | 59.9° |
| C17 | C19 | N20 | C32 | 125.5° | 120.0° |
| C17 | C19 | N20 | H19 | 116.3° | 120.0° |
| C17 | C19 | C32 | H19 | 116.2° | 120.0° |
| C17 | C19 | N20 | C21 | 108.8° | 155.0° |
| C17 | C19 | N20 | HN20 | 71.2° | 25.0° |
| C17 | C19 | C32 | C38 | 178.3° | 175.0° |
| C17 | C19 | C32 | H321 | 61.7° | 65.0° |
| C17 | C19 | C32 | H322 | 58.8° | 55.1° |
| O18 | C17 | C19 | N20 | 72.4° | 65.0° |
| O18 | C17 | C19 | C32 | 50.5° | 54.9° |
| O18 | C17 | C19 | H19 | 168.4° | 175.0° |
| H17 | C17 | O18 | HO18 | 100.0° | 180.0° |
| H17 | C17 | C19 | N20 | 47.8° | 55.0° |
| H17 | C17 | C19 | C32 | 170.7° | 175.0° |
| H17 | C17 | C19 | H19 | 71.5° | 65.0° |
| N20 | C19 | C32 | H19 | 119.4° | 120.0° |
| C19 | N20 | C21 | HN20 | 180.0° | 179.9° |
| C19 | N20 | C21 | O22 | 3.1° | 0.0° |
| C19 | N20 | C21 | C22 | 176.1° | 180.0° |
| N20 | C19 | C32 | C38 | 57.4° | 65.0° |
| N20 | C19 | C32 | H321 | 62.6° | 55.0° |
| N20 | C19 | C32 | H322 | 176.8° | 175.0° |
| C32 | C19 | N20 | C21 | 125.7° | 85.0° |
| C32 | C19 | N20 | HN20 | 54.3° | 95.1° |
| C19 | C32 | C38 | H321 | 120.0° | 120.0° |
| C19 | C32 | C38 | H322 | 119.5° | 120.0° |
| C19 | C32 | H321 | H322 | 119.5° | 120.0° |
| C19 | C32 | C38 | C37 | 76.1° | 90.0° |
| C19 | C32 | C38 | C33 | 103.6° | 89.7° |
| H19 | C19 | N20 | C21 | 7.5° | 35.0° |
| H19 | C19 | N20 | HN20 | 172.4° | 145.0° |
| H19 | C19 | C32 | C38 | 62.1° | 55.0° |
| H19 | C19 | C32 | H321 | 177.9° | 175.0° |
| H19 | C19 | C32 | H322 | 57.4° | 65.0° |
| N20 | C21 | O22 | C22 | 179.1° | 180.0° |
| N20 | C21 | C22 | N26 | 97.5° | 180.0° |
| N20 | C21 | C22 | C23 | 136.4° | 60.0° |
| N20 | C21 | C22 | H22 | 19.9° | 60.0° |
| HN20 | N20 | C21 | O22 | 176.9° | 180.0° |
| HN20 | N20 | C21 | C22 | 3.9° | 0.0° |
| O22 | C21 | C22 | N26 | 81.7° | 0.0° |
| O22 | C21 | C22 | C23 | 44.3° | 120.0° |
| O22 | C21 | C22 | H22 | 160.8° | 120.0° |
| C21 | C22 | N26 | C23 | 127.8° | 120.0° |
| C21 | C22 | N26 | H22 | 115.3° | 120.0° |
| C21 | C22 | C23 | H22 | 115.1° | 120.0° |
| C21 | C22 | C23 | C25 | 177.5° | 180.0° |
| C21 | C22 | C23 | C24 | 54.2° | 60.0° |
| C21 | C22 | C23 | H23 | 64.8° | 60.0° |
| C21 | C22 | N26 | C27 | 118.6° | 155.0° |
| C21 | C22 | N26 | HN26 | 61.5° | 25.0° |
| N26 | C22 | C23 | H22 | 117.7° | 120.0° |
| N26 | C22 | C23 | C25 | 55.3° | 60.0° |
| N26 | C22 | C23 | C24 | 178.7° | 60.0° |
| N26 | C22 | C23 | H23 | 62.3° | 180.0° |
| C22 | N26 | C27 | HN26 | 180.0° | 180.0° |
| C22 | N26 | C27 | C29 | 177.7° | 180.0° |
| C22 | N26 | C27 | O28 | 1.8° | 0.0° |
| C22 | C23 | C25 | C24 | 122.1° | 120.0° |
| C22 | C23 | C25 | H23 | 119.0° | 120.0° |
| C22 | C23 | C24 | H23 | 119.2° | 120.0° |
| C22 | C23 | C25 | H251 | 107.4° | 60.0° |
| C22 | C23 | C25 | H252 | 132.6° | 180.0° |
| C22 | C23 | C25 | H253 | 12.6° | 60.0° |
| C22 | C23 | C24 | H241 | 66.6° | 60.0° |
| C22 | C23 | C24 | H242 | 173.4° | 180.0° |
| C22 | C23 | C24 | H243 | 53.5° | 60.0° |
| C23 | C22 | N26 | C27 | 113.6° | 85.0° |
| C23 | C22 | N26 | HN26 | 66.3° | 95.0° |
| H22 | C22 | C23 | C25 | 62.4° | 60.0° |
| H22 | C22 | C23 | C24 | 60.9° | 180.0° |
| H22 | C22 | C23 | H23 | 180.0° | 60.0° |
| H22 | C22 | N26 | C27 | 3.3° | 35.0° |
| H22 | C22 | N26 | HN26 | 176.7° | 145.0° |
| C25 | C23 | C24 | H23 | 117.6° | 120.0° |
| C23 | C25 | H251 | H252 | 120.0° | 120.0° |
| C23 | C25 | H251 | H253 | 120.0° | 119.9° |
| C23 | C25 | H252 | H253 | 120.0° | 119.9° |
| C25 | C23 | C24 | H241 | 56.6° | 180.0° |
| C25 | C23 | C24 | H242 | 63.3° | 60.0° |
| C25 | C23 | C24 | H243 | 176.7° | 60.0° |
| C24 | C23 | C25 | H251 | 130.5° | 60.0° |
| C24 | C23 | C25 | H252 | 10.5° | 60.0° |
| C24 | C23 | C25 | H253 | 109.5° | 180.0° |
| C23 | C24 | H241 | H242 | 120.0° | 120.0° |
| C23 | C24 | H241 | H243 | 120.0° | 120.0° |
| C23 | C24 | H242 | H243 | 120.0° | 120.0° |
| H23 | C23 | C25 | H251 | 11.6° | 180.0° |
| H23 | C23 | C25 | H252 | 108.4° | 60.0° |
| H23 | C23 | C25 | H253 | 131.6° | 60.0° |
| H23 | C23 | C24 | H241 | 174.3° | 60.0° |
| H23 | C23 | C24 | H242 | 54.3° | 60.0° |
| H23 | C23 | C24 | H243 | 65.7° | 180.0° |
| H251 | C25 | H252 | H253 | 120.0° | 120.1° |
| H241 | C24 | H242 | H243 | 120.0° | 120.0° |
| N26 | C27 | C29 | O28 | 179.5° | 180.0° |
| N26 | C27 | C29 | H291 | 3.9° | 60.0° |
| N26 | C27 | C29 | H292 | 116.1° | 180.0° |
| N26 | C27 | C29 | H293 | 123.9° | 60.0° |
| HN26 | N26 | C27 | C29 | 2.3° | 0.0° |
| HN26 | N26 | C27 | O28 | 178.2° | 180.0° |
| C27 | C29 | H291 | H292 | 120.0° | 120.0° |
| C27 | C29 | H291 | H293 | 120.0° | 120.0° |
| C27 | C29 | H292 | H293 | 120.0° | 120.0° |
| O28 | C27 | C29 | H291 | 176.6° | 120.0° |
| O28 | C27 | C29 | H292 | 63.4° | 0.0° |
| O28 | C27 | C29 | H293 | 56.6° | 120.0° |
| H291 | C29 | H292 | H293 | 120.0° | 120.1° |
| C38 | C32 | H321 | H322 | 119.5° | 120.1° |
| C32 | C38 | C37 | C33 | 179.8° | 179.7° |
| C32 | C38 | C33 | C34 | 178.9° | 180.0° |
| C32 | C38 | C33 | H33 | 1.1° | 0.0° |
| C32 | C38 | C37 | C36 | 179.2° | 179.8° |
| C32 | C38 | C37 | H37 | 0.8° | 0.0° |
| H321 | C32 | C38 | C37 | 163.9° | 29.9° |
| H321 | C32 | C38 | C33 | 16.4° | 150.3° |
| H322 | C32 | C38 | C37 | 43.3° | 150.0° |
| H322 | C32 | C38 | C33 | 136.9° | 30.2° |
| C37 | C38 | C33 | C34 | 0.9° | 0.3° |
| C37 | C38 | C33 | H33 | 179.1° | 179.7° |
| C38 | C37 | C36 | C35 | 0.2° | 0.5° |
| C38 | C37 | C36 | H37 | 180.0° | 179.8° |
| C38 | C37 | C36 | H36 | 179.8° | 179.7° |
| C38 | C33 | C34 | H33 | 180.0° | 180.0° |
| C38 | C33 | C34 | C35 | 0.9° | 0.0° |
| C38 | C33 | C34 | H34 | 179.1° | 179.9° |
| C33 | C38 | C37 | C36 | 0.5° | 0.5° |
| C33 | C38 | C37 | H37 | 179.5° | 179.7° |
| C33 | C34 | C35 | H34 | 180.0° | 179.9° |
| C33 | C34 | C35 | C36 | 0.6° | 0.0° |
| C33 | C34 | C35 | H35 | 179.4° | 179.9° |
| H33 | C33 | C34 | C35 | 179.1° | 180.0° |
| H33 | C33 | C34 | H34 | 0.9° | 0.1° |
| C34 | C35 | C36 | H35 | 180.0° | 180.0° |
| C34 | C35 | C36 | C37 | 0.2° | 0.2° |
| C34 | C35 | C36 | H36 | 179.8° | 180.0° |
| H34 | C34 | C35 | C36 | 179.4° | 179.9° |
| H34 | C34 | C35 | H35 | 0.6° | 0.0° |
| C35 | C36 | C37 | H36 | 180.0° | 179.8° |
| C35 | C36 | C37 | H37 | 179.8° | 179.7° |
| H35 | C35 | C36 | C37 | 179.8° | 179.8° |
| H35 | C35 | C36 | H36 | 0.2° | 0.0° |
| H36 | C36 | C37 | H37 | 0.2° | 0.0° |
