MZ9
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 | 1.51Å | 1.51Å | |
| C21 | N20 | sing | 1.35Å | 1.33Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C22 | H221 | sing | 1.09Å | 1.10Å | |
| C22 | H222 | sing | 1.09Å | 1.10Å | |
| C23 | C24 | sing | 1.51Å | 1.52Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C24 | C26 | sing | 1.51Å | 1.51Å | |
| C24 | O25 | doub | 1.21Å | 1.23Å | |
| C26 | C27 | sing | 1.53Å | 1.51Å | |
| C26 | H261 | sing | 1.09Å | 1.10Å | |
| C26 | H262 | sing | 1.09Å | 1.10Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H273 | sing | 1.09Å | 1.10Å | |
| N20 | C19 | sing | 1.47Å | 1.45Å | |
| N20 | HN20 | sing | 0.97Å | 1.00Å | |
| C19 | C32 | sing | 1.53Å | 1.53Å | |
| C19 | C17 | sing | 1.53Å | 1.53Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C32 | C38 | sing | 1.51Å | 1.52Å | |
| 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 | 1.40Å | Aromatic |
| C37 | C36 | sing | 1.38Å | 1.39Å | 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 | 1.53Å | |
| C17 | O18 | sing | 1.43Å | 1.44Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å | |
| C16 | N11 | sing | 1.47Å | 1.48Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| N11 | S8 | sing | 1.66Å | 1.62Å | |
| N11 | C12 | sing | 1.47Å | 1.48Å | |
| 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 | C15 | sing | 1.53Å | 1.53Å | |
| C13 | H13 | 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 | |
| C15 | C18 | sing | 1.53Å | 1.51Å | |
| 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 | |
| S8 | O9 | doub | 1.42Å | 1.44Å | |
| S8 | O10 | doub | 1.42Å | 1.43Å | |
| S8 | C5 | sing | 1.76Å | 1.61Å | |
| C5 | C6 | doub | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | C2 | doub | 1.39Å | 1.40Å | Aromatic |
| C7 | H7 | sing | 1.08Å | 1.08Å | |
| C4 | C3 | doub | 1.38Å | 1.40Å | Aromatic |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | C2 | sing | 1.39Å | 1.39Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | O19 | sing | 1.36Å | 1.38Å | |
| O19 | C20 | sing | 1.43Å | 1.43Å | |
| C20 | H201 | sing | 1.09Å | 1.10Å | |
| C20 | H202 | sing | 1.09Å | 1.10Å | |
| C20 | H203 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O22 | C21 | C22 | 118.5° | 120.0° |
| O22 | C21 | N20 | 126.0° | 120.0° |
| C22 | C21 | N20 | 115.5° | 120.0° |
| C21 | C22 | C23 | 110.2° | 109.5° |
| C21 | C22 | H221 | 109.2° | 109.5° |
| C21 | C22 | H222 | 109.1° | 109.5° |
| C21 | N20 | C19 | 124.9° | 120.0° |
| C21 | N20 | HN20 | 117.5° | 119.9° |
| C23 | C22 | H221 | 109.2° | 109.4° |
| C23 | C22 | H222 | 109.1° | 109.4° |
| C22 | C23 | C24 | 114.8° | 109.5° |
| C22 | C23 | H231 | 107.7° | 109.5° |
| C22 | C23 | H232 | 106.5° | 109.5° |
| H221 | C22 | H222 | 110.0° | 109.5° |
| C24 | C23 | H231 | 107.7° | 109.4° |
| C24 | C23 | H232 | 106.5° | 109.4° |
| C23 | C24 | C26 | 115.1° | 120.0° |
| C23 | C24 | O25 | 122.5° | 119.9° |
| H231 | C23 | H232 | 113.7° | 109.5° |
| C26 | C24 | O25 | 122.3° | 120.0° |
| C24 | C26 | C27 | 113.4° | 109.5° |
| C24 | C26 | H261 | 108.2° | 109.4° |
| C24 | C26 | H262 | 107.3° | 109.5° |
| C27 | C26 | H261 | 108.2° | 109.5° |
| C27 | C26 | H262 | 107.3° | 109.5° |
| C26 | C27 | H271 | 109.5° | 109.5° |
| C26 | C27 | H272 | 109.5° | 109.5° |
| C26 | C27 | H273 | 109.4° | 109.5° |
| H261 | C26 | H262 | 112.6° | 109.5° |
| H271 | C27 | H272 | 109.5° | 109.5° |
| H271 | C27 | H273 | 109.5° | 109.4° |
| H272 | C27 | H273 | 109.5° | 109.5° |
| C19 | N20 | HN20 | 117.6° | 120.0° |
| N20 | C19 | C32 | 107.6° | 109.4° |
| N20 | C19 | C17 | 109.7° | 109.4° |
| N20 | C19 | H19 | 112.3° | 109.4° |
| C32 | C19 | C17 | 114.2° | 109.5° |
| C32 | C19 | H19 | 107.7° | 109.5° |
| C19 | C32 | C38 | 108.7° | 109.4° |
| C19 | C32 | H321 | 109.7° | 109.5° |
| C19 | C32 | H322 | 109.9° | 109.4° |
| C17 | C19 | H19 | 105.4° | 109.5° |
| C19 | C17 | C16 | 113.0° | 109.4° |
| C19 | C17 | O18 | 111.2° | 109.5° |
| C19 | C17 | H17 | 105.8° | 109.5° |
| C38 | C32 | H321 | 109.7° | 109.5° |
| C38 | C32 | H322 | 109.9° | 109.5° |
| C32 | C38 | C37 | 120.4° | 120.0° |
| C32 | C38 | C33 | 120.1° | 120.0° |
| H321 | C32 | H322 | 108.8° | 109.5° |
| C37 | C38 | C33 | 119.5° | 120.0° |
| C38 | C37 | C36 | 120.3° | 120.0° |
| C38 | C37 | H37 | 119.9° | 120.0° |
| C38 | C33 | C34 | 120.0° | 120.0° |
| C38 | C33 | H33 | 120.0° | 120.0° |
| C36 | C37 | H37 | 119.9° | 120.0° |
| C37 | C36 | C35 | 120.0° | 120.0° |
| C37 | C36 | H36 | 120.0° | 120.0° |
| C35 | C36 | H36 | 120.0° | 120.0° |
| C36 | C35 | C34 | 119.8° | 120.0° |
| C36 | C35 | H35 | 120.1° | 120.0° |
| C34 | C35 | H35 | 120.1° | 120.0° |
| C35 | C34 | C33 | 120.4° | 120.0° |
| C35 | C34 | H34 | 119.8° | 119.9° |
| C33 | C34 | H34 | 119.8° | 120.0° |
| C34 | C33 | H33 | 120.0° | 120.0° |
| C16 | C17 | O18 | 109.4° | 109.5° |
| C16 | C17 | H17 | 107.7° | 109.5° |
| C17 | C16 | N11 | 108.9° | 109.5° |
| C17 | C16 | H161 | 109.6° | 109.5° |
| C17 | C16 | H162 | 109.8° | 109.5° |
| O18 | C17 | H17 | 109.6° | 109.5° |
| C17 | O18 | HO18 | 109.5° | 114.0° |
| N11 | C16 | H161 | 109.6° | 109.4° |
| N11 | C16 | H162 | 109.8° | 109.4° |
| C16 | N11 | S8 | 112.6° | 120.0° |
| C16 | N11 | C12 | 112.7° | 120.0° |
| H161 | C16 | H162 | 109.1° | 109.5° |
| S8 | N11 | C12 | 111.6° | 120.0° |
| N11 | S8 | O9 | 105.8° | 106.4° |
| N11 | S8 | O10 | 109.9° | 106.4° |
| N11 | S8 | C5 | 111.2° | 107.2° |
| N11 | C12 | C13 | 110.6° | 109.5° |
| N11 | C12 | H121 | 109.1° | 109.5° |
| N11 | C12 | H122 | 108.9° | 109.5° |
| C13 | C12 | H121 | 109.1° | 109.5° |
| C13 | C12 | H122 | 108.8° | 109.5° |
| C12 | C13 | C14 | 112.8° | 109.4° |
| C12 | C13 | C15 | 110.0° | 109.5° |
| C12 | C13 | H13 | 107.7° | 109.5° |
| H121 | C12 | H122 | 110.4° | 109.5° |
| C14 | C13 | C15 | 112.2° | 109.5° |
| C14 | C13 | H13 | 105.4° | 109.5° |
| C13 | C14 | H141 | 109.5° | 109.4° |
| C13 | C14 | H142 | 109.5° | 109.5° |
| C13 | C14 | H143 | 109.5° | 109.5° |
| C15 | C13 | H13 | 108.5° | 109.5° |
| C13 | C15 | C18 | 114.1° | 109.5° |
| C13 | C15 | H151 | 108.0° | 109.4° |
| C13 | C15 | H152 | 106.9° | 109.5° |
| H141 | C14 | H142 | 109.5° | 109.5° |
| H141 | C14 | H143 | 109.5° | 109.5° |
| H142 | C14 | H143 | 109.5° | 109.5° |
| C18 | C15 | H151 | 108.0° | 109.5° |
| C18 | C15 | H152 | 106.9° | 109.5° |
| C15 | C18 | H181 | 109.5° | 109.5° |
| C15 | C18 | H182 | 109.5° | 109.5° |
| C15 | C18 | H183 | 109.5° | 109.5° |
| H151 | C15 | H152 | 113.1° | 109.5° |
| H181 | C18 | H182 | 109.5° | 109.5° |
| H181 | C18 | H183 | 109.5° | 109.5° |
| H182 | C18 | H183 | 109.5° | 109.4° |
| O9 | S8 | O10 | 109.1° | 123.1° |
| O9 | S8 | C5 | 110.3° | 106.4° |
| O10 | S8 | C5 | 110.4° | 106.4° |
| S8 | C5 | C6 | 120.4° | 119.9° |
| S8 | C5 | C4 | 121.1° | 120.0° |
| C6 | C5 | C4 | 118.4° | 120.1° |
| C5 | C6 | C7 | 121.5° | 120.1° |
| C5 | C6 | H6 | 119.2° | 119.9° |
| C5 | C4 | C3 | 120.5° | 120.1° |
| C5 | C4 | H4 | 119.7° | 120.0° |
| C7 | C6 | H6 | 119.3° | 120.0° |
| C6 | C7 | C2 | 120.0° | 120.0° |
| C6 | C7 | H7 | 120.0° | 120.0° |
| C2 | C7 | H7 | 120.0° | 120.0° |
| C7 | C2 | C3 | 118.7° | 119.9° |
| C7 | C2 | O19 | 123.1° | 120.1° |
| C3 | C4 | H4 | 119.8° | 119.9° |
| C4 | C3 | C2 | 120.9° | 119.9° |
| C4 | C3 | H3 | 119.6° | 120.0° |
| C2 | C3 | H3 | 119.5° | 120.1° |
| C3 | C2 | O19 | 118.2° | 120.0° |
| C2 | O19 | C20 | 124.6° | 117.0° |
| O19 | C20 | H201 | 109.5° | 109.4° |
| O19 | C20 | H202 | 109.5° | 109.5° |
| O19 | C20 | H203 | 109.5° | 109.4° |
| H201 | C20 | H202 | 109.4° | 109.5° |
| H201 | C20 | H203 | 109.5° | 109.5° |
| H202 | C20 | H203 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O22 | C21 | C22 | N20 | 179.5° | 179.7° |
| O22 | C21 | C22 | C23 | 68.4° | 0.0° |
| O22 | C21 | C22 | H221 | 51.6° | 120.0° |
| O22 | C21 | C22 | H222 | 171.9° | 120.0° |
| O22 | C21 | N20 | C19 | 1.7° | 0.0° |
| O22 | C21 | N20 | HN20 | 178.3° | 180.0° |
| C21 | C22 | C23 | H221 | 120.0° | 120.0° |
| C21 | C22 | C23 | H222 | 119.7° | 120.0° |
| C21 | C22 | H221 | H222 | 119.7° | 120.0° |
| C21 | C22 | C23 | C24 | 122.3° | 180.0° |
| C21 | C22 | C23 | H231 | 2.3° | 60.0° |
| C21 | C22 | C23 | H232 | 120.1° | 60.0° |
| C22 | C21 | N20 | C19 | 177.8° | 179.7° |
| C22 | C21 | N20 | HN20 | 2.2° | 0.3° |
| N20 | C21 | C22 | C23 | 111.2° | 179.7° |
| N20 | C21 | C22 | H221 | 128.8° | 59.7° |
| N20 | C21 | C22 | H222 | 8.6° | 60.3° |
| C21 | N20 | C19 | HN20 | 180.0° | 180.0° |
| C21 | N20 | C19 | C32 | 126.4° | 85.0° |
| C21 | N20 | C19 | C17 | 108.8° | 155.0° |
| C21 | N20 | C19 | H19 | 8.1° | 35.0° |
| C23 | C22 | H221 | H222 | 119.7° | 120.0° |
| C22 | C23 | C24 | H231 | 120.0° | 120.0° |
| C22 | C23 | C24 | H232 | 117.6° | 120.0° |
| C22 | C23 | H231 | H232 | 117.8° | 120.0° |
| C22 | C23 | C24 | C26 | 169.0° | 180.0° |
| C22 | C23 | C24 | O25 | 11.4° | 0.0° |
| H221 | C22 | C23 | C24 | 117.7° | 60.0° |
| H221 | C22 | C23 | H231 | 122.3° | 180.0° |
| H221 | C22 | C23 | H232 | 0.1° | 60.0° |
| H222 | C22 | C23 | C24 | 2.6° | 60.0° |
| H222 | C22 | C23 | H231 | 117.4° | 60.0° |
| H222 | C22 | C23 | H232 | 120.2° | 180.0° |
| C24 | C23 | H231 | H232 | 117.8° | 119.9° |
| C23 | C24 | C26 | O25 | 179.6° | 180.0° |
| C23 | C24 | C26 | C27 | 175.5° | 180.0° |
| C23 | C24 | C26 | H261 | 64.5° | 60.0° |
| C23 | C24 | C26 | H262 | 57.2° | 60.0° |
| H231 | C23 | C24 | C26 | 49.0° | 60.0° |
| H231 | C23 | C24 | O25 | 131.4° | 120.0° |
| H232 | C23 | C24 | C26 | 73.3° | 60.0° |
| H232 | C23 | C24 | O25 | 106.2° | 120.0° |
| C24 | C26 | C27 | H261 | 120.0° | 120.0° |
| C24 | C26 | C27 | H262 | 118.3° | 120.0° |
| C24 | C26 | H261 | H262 | 118.4° | 120.0° |
| C24 | C26 | C27 | H271 | 154.7° | 180.0° |
| C24 | C26 | C27 | H272 | 34.7° | 60.0° |
| C24 | C26 | C27 | H273 | 85.3° | 60.1° |
| O25 | C24 | C26 | C27 | 4.1° | 0.0° |
| O25 | C24 | C26 | H261 | 115.9° | 120.0° |
| O25 | C24 | C26 | H262 | 122.4° | 120.0° |
| C27 | C26 | H261 | H262 | 118.4° | 120.0° |
| C26 | C27 | H271 | H272 | 120.0° | 120.1° |
| C26 | C27 | H271 | H273 | 120.0° | 120.0° |
| C26 | C27 | H272 | H273 | 120.0° | 120.1° |
| H261 | C26 | C27 | H271 | 85.3° | 60.0° |
| H261 | C26 | C27 | H272 | 154.8° | 180.0° |
| H261 | C26 | C27 | H273 | 34.7° | 59.9° |
| H262 | C26 | C27 | H271 | 36.4° | 60.0° |
| H262 | C26 | C27 | H272 | 83.6° | 60.0° |
| H262 | C26 | C27 | H273 | 156.4° | 179.9° |
| H271 | C27 | H272 | H273 | 120.0° | 119.9° |
| N20 | C19 | C32 | C17 | 122.1° | 120.0° |
| N20 | C19 | C32 | H19 | 121.2° | 120.0° |
| N20 | C19 | C17 | H19 | 121.1° | 120.0° |
| N20 | C19 | C32 | C38 | 56.4° | 65.0° |
| N20 | C19 | C32 | H321 | 63.6° | 55.0° |
| N20 | C19 | C32 | H322 | 176.7° | 175.0° |
| N20 | C19 | C17 | C16 | 165.7° | 175.0° |
| N20 | C19 | C17 | O18 | 70.8° | 65.0° |
| N20 | C19 | C17 | H17 | 48.1° | 55.0° |
| HN20 | N20 | C19 | C32 | 53.6° | 95.0° |
| HN20 | N20 | C19 | C17 | 71.2° | 25.0° |
| HN20 | N20 | C19 | H19 | 171.9° | 145.0° |
| C32 | C19 | C17 | H19 | 118.0° | 120.1° |
| C19 | C32 | C38 | H321 | 120.0° | 120.0° |
| C19 | C32 | C38 | H322 | 120.3° | 119.9° |
| C19 | C32 | H321 | H322 | 120.3° | 119.9° |
| C19 | C32 | C38 | C37 | 69.0° | 90.1° |
| C19 | C32 | C38 | C33 | 110.2° | 90.3° |
| C32 | C19 | C17 | C16 | 73.4° | 65.0° |
| C32 | C19 | C17 | O18 | 50.1° | 54.9° |
| C32 | C19 | C17 | H17 | 169.0° | 175.0° |
| C17 | C19 | C32 | C38 | 178.5° | 175.0° |
| C17 | C19 | C32 | H321 | 58.5° | 64.9° |
| C17 | C19 | C32 | H322 | 61.2° | 55.0° |
| C19 | C17 | C16 | O18 | 124.4° | 120.0° |
| C19 | C17 | C16 | H17 | 116.5° | 120.0° |
| C19 | C17 | O18 | H17 | 116.6° | 120.0° |
| C19 | C17 | O18 | HO18 | 18.9° | 59.9° |
| C19 | C17 | C16 | N11 | 68.3° | 174.4° |
| C19 | C17 | C16 | H161 | 51.7° | 54.4° |
| C19 | C17 | C16 | H162 | 171.5° | 65.6° |
| H19 | C19 | C32 | C38 | 64.9° | 54.9° |
| H19 | C19 | C32 | H321 | 175.1° | 175.0° |
| H19 | C19 | C32 | H322 | 55.5° | 65.0° |
| H19 | C19 | C17 | C16 | 44.6° | 55.0° |
| H19 | C19 | C17 | O18 | 168.0° | 175.0° |
| H19 | C19 | C17 | H17 | 73.0° | 64.9° |
| C38 | C32 | H321 | H322 | 120.3° | 120.1° |
| C32 | C38 | C37 | C33 | 179.2° | 179.6° |
| C32 | C38 | C37 | C36 | 179.5° | 180.0° |
| C32 | C38 | C37 | H37 | 0.5° | 0.2° |
| C32 | C38 | C33 | C34 | 179.5° | 179.8° |
| C32 | C38 | C33 | H33 | 0.5° | 0.1° |
| H321 | C32 | C38 | C37 | 171.0° | 29.9° |
| H321 | C32 | C38 | C33 | 9.8° | 149.7° |
| H322 | C32 | C38 | C37 | 51.3° | 150.0° |
| H322 | C32 | C38 | C33 | 129.5° | 29.7° |
| C38 | C37 | C36 | H37 | 180.0° | 179.9° |
| C38 | C37 | C36 | C35 | 0.1° | 0.1° |
| C38 | C37 | C36 | H36 | 180.0° | 179.9° |
| C37 | C38 | C33 | C34 | 0.3° | 0.5° |
| C37 | C38 | C33 | H33 | 179.7° | 179.7° |
| C33 | C38 | C37 | C36 | 0.3° | 0.4° |
| C33 | C38 | C37 | H37 | 179.7° | 179.8° |
| C38 | C33 | C34 | C35 | 0.1° | 0.5° |
| C38 | C33 | C34 | H33 | 180.0° | 179.8° |
| C38 | C33 | C34 | H34 | 179.9° | 179.8° |
| C37 | C36 | C35 | H36 | 180.0° | 180.0° |
| C37 | C36 | C35 | C34 | 0.2° | 0.0° |
| C37 | C36 | C35 | H35 | 179.8° | 179.9° |
| H37 | C37 | C36 | C35 | 179.9° | 180.0° |
| H37 | C37 | C36 | H36 | 0.0° | 0.0° |
| C36 | C35 | C34 | H35 | 180.0° | 179.9° |
| C36 | C35 | C34 | C33 | 0.2° | 0.2° |
| C36 | C35 | C34 | H34 | 179.8° | 180.0° |
| H36 | C36 | C35 | C34 | 179.8° | 180.0° |
| H36 | C36 | C35 | H35 | 0.2° | 0.1° |
| C35 | C34 | C33 | H34 | 180.0° | 179.8° |
| C35 | C34 | C33 | H33 | 179.9° | 179.8° |
| H35 | C35 | C34 | C33 | 179.8° | 179.9° |
| H35 | C35 | C34 | H34 | 0.2° | 0.1° |
| H34 | C34 | C33 | H33 | 0.1° | 0.0° |
| C16 | C17 | O18 | H17 | 117.9° | 120.0° |
| C16 | C17 | O18 | HO18 | 144.4° | 60.0° |
| C17 | C16 | N11 | H161 | 120.0° | 120.0° |
| C17 | C16 | N11 | H162 | 120.2° | 120.0° |
| C17 | C16 | H161 | H162 | 120.2° | 120.1° |
| C17 | C16 | N11 | S8 | 120.3° | 114.2° |
| C17 | C16 | N11 | C12 | 112.5° | 65.8° |
| O18 | C17 | C16 | N11 | 167.2° | 65.6° |
| O18 | C17 | C16 | H161 | 72.8° | 174.4° |
| O18 | C17 | C16 | H162 | 47.0° | 54.4° |
| H17 | C17 | O18 | HO18 | 97.8° | 180.0° |
| H17 | C17 | C16 | N11 | 48.1° | 54.4° |
| H17 | C17 | C16 | H161 | 168.1° | 65.6° |
| H17 | C17 | C16 | H162 | 72.1° | 174.4° |
| N11 | C16 | H161 | H162 | 120.2° | 119.9° |
| C16 | N11 | S8 | C12 | 127.9° | 180.0° |
| C16 | N11 | C12 | C13 | 79.5° | 66.9° |
| C16 | N11 | C12 | H121 | 160.5° | 173.1° |
| C16 | N11 | C12 | H122 | 40.0° | 53.1° |
| C16 | N11 | S8 | O9 | 159.4° | 23.6° |
| C16 | N11 | S8 | O10 | 41.8° | 156.5° |
| C16 | N11 | S8 | C5 | 80.8° | 90.0° |
| H161 | C16 | N11 | S8 | 0.3° | 125.7° |
| H161 | C16 | N11 | C12 | 127.6° | 54.3° |
| H162 | C16 | N11 | S8 | 119.5° | 5.8° |
| H162 | C16 | N11 | C12 | 7.8° | 174.3° |
| S8 | N11 | C12 | C13 | 152.7° | 113.1° |
| S8 | N11 | C12 | H121 | 32.7° | 6.9° |
| S8 | N11 | C12 | H122 | 87.8° | 126.9° |
| N11 | S8 | O9 | O10 | 118.2° | 123.0° |
| N11 | S8 | O9 | C5 | 120.4° | 114.1° |
| N11 | S8 | O10 | C5 | 123.0° | 114.1° |
| N11 | S8 | C5 | C6 | 89.4° | 90.0° |
| N11 | S8 | C5 | C4 | 89.6° | 90.3° |
| N11 | C12 | C13 | H121 | 120.0° | 120.0° |
| N11 | C12 | C13 | H122 | 119.5° | 120.0° |
| N11 | C12 | H121 | H122 | 119.5° | 120.0° |
| N11 | C12 | C13 | C14 | 59.1° | 65.8° |
| N11 | C12 | C13 | C15 | 174.8° | 174.2° |
| N11 | C12 | C13 | H13 | 56.7° | 54.2° |
| C12 | N11 | S8 | O9 | 72.7° | 156.5° |
| C12 | N11 | S8 | O10 | 169.6° | 23.6° |
| C12 | N11 | S8 | C5 | 47.1° | 90.0° |
| C13 | C12 | H121 | H122 | 119.5° | 120.0° |
| C12 | C13 | C14 | C15 | 124.9° | 120.0° |
| C12 | C13 | C14 | H13 | 117.3° | 120.0° |
| C12 | C13 | C15 | H13 | 117.6° | 120.0° |
| C12 | C13 | C14 | H141 | 12.2° | 180.0° |
| C12 | C13 | C14 | H142 | 107.7° | 60.0° |
| C12 | C13 | C14 | H143 | 132.2° | 60.0° |
| C12 | C13 | C15 | C18 | 61.8° | 175.0° |
| C12 | C13 | C15 | H151 | 58.2° | 65.0° |
| C12 | C13 | C15 | H152 | 179.8° | 55.0° |
| H121 | C12 | C13 | C14 | 60.9° | 54.2° |
| H121 | C12 | C13 | C15 | 65.2° | 65.8° |
| H121 | C12 | C13 | H13 | 176.7° | 174.2° |
| H122 | C12 | C13 | C14 | 178.7° | 174.2° |
| H122 | C12 | C13 | C15 | 55.3° | 54.2° |
| H122 | C12 | C13 | H13 | 62.8° | 65.8° |
| C14 | C13 | C15 | H13 | 115.9° | 120.0° |
| C13 | C14 | H141 | H142 | 120.0° | 120.0° |
| C13 | C14 | H141 | H143 | 120.0° | 120.0° |
| C13 | C14 | H142 | H143 | 120.0° | 120.1° |
| C14 | C13 | C15 | C18 | 64.6° | 65.0° |
| C14 | C13 | C15 | H151 | 175.4° | 55.0° |
| C14 | C13 | C15 | H152 | 53.4° | 174.9° |
| C15 | C13 | C14 | H141 | 137.2° | 60.0° |
| C15 | C13 | C14 | H142 | 17.2° | 180.0° |
| C15 | C13 | C14 | H143 | 102.9° | 60.0° |
| C13 | C15 | C18 | H151 | 120.0° | 119.9° |
| C13 | C15 | C18 | H152 | 118.0° | 120.0° |
| C13 | C15 | H151 | H152 | 118.1° | 120.0° |
| C13 | C15 | C18 | H181 | 148.3° | 60.0° |
| C13 | C15 | C18 | H182 | 91.7° | 60.0° |
| C13 | C15 | C18 | H183 | 28.3° | 180.0° |
| H13 | C13 | C14 | H141 | 105.0° | 60.0° |
| H13 | C13 | C14 | H142 | 135.0° | 60.0° |
| H13 | C13 | C14 | H143 | 14.9° | 180.0° |
| H13 | C13 | C15 | C18 | 179.4° | 55.0° |
| H13 | C13 | C15 | H151 | 59.4° | 175.0° |
| H13 | C13 | C15 | H152 | 62.6° | 65.1° |
| H141 | C14 | H142 | H143 | 120.0° | 120.0° |
| C18 | C15 | H151 | H152 | 118.1° | 120.1° |
| 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 | 28.3° | 179.9° |
| H151 | C15 | C18 | H182 | 148.3° | 59.9° |
| H151 | C15 | C18 | H183 | 91.7° | 60.0° |
| H152 | C15 | C18 | H181 | 93.8° | 60.0° |
| H152 | C15 | C18 | H182 | 26.3° | 180.0° |
| H152 | C15 | C18 | H183 | 146.2° | 60.0° |
| H181 | C18 | H182 | H183 | 120.0° | 120.0° |
| O9 | S8 | O10 | C5 | 121.4° | 122.9° |
| O9 | S8 | C5 | C6 | 27.6° | 156.4° |
| O9 | S8 | C5 | C4 | 153.3° | 23.3° |
| O10 | S8 | C5 | C6 | 148.3° | 23.6° |
| O10 | S8 | C5 | C4 | 32.7° | 156.1° |
| S8 | C5 | C6 | C4 | 179.0° | 179.7° |
| S8 | C5 | C6 | C7 | 179.2° | 180.0° |
| S8 | C5 | C6 | H6 | 0.8° | 0.0° |
| S8 | C5 | C4 | C3 | 179.2° | 180.0° |
| S8 | C5 | C4 | H4 | 0.9° | 0.0° |
| C5 | C6 | C7 | H6 | 180.0° | 179.9° |
| C5 | C6 | C7 | C2 | 0.0° | 0.1° |
| C5 | C6 | C7 | H7 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 0.1° | 0.3° |
| C6 | C5 | C4 | H4 | 179.9° | 179.7° |
| C4 | C5 | C6 | C7 | 0.1° | 0.3° |
| C4 | C5 | C6 | H6 | 179.9° | 179.7° |
| C5 | C4 | C3 | H4 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.0° | 0.0° |
| C5 | C4 | C3 | H3 | 180.0° | 180.0° |
| C6 | C7 | C2 | H7 | 180.0° | 180.0° |
| C6 | C7 | C2 | C3 | 0.1° | 0.2° |
| C6 | C7 | C2 | O19 | 179.3° | 180.0° |
| H6 | C6 | C7 | C2 | 180.0° | 180.0° |
| H6 | C6 | C7 | H7 | 0.0° | 0.0° |
| C7 | C2 | C3 | C4 | 0.1° | 0.3° |
| C7 | C2 | C3 | O19 | 179.2° | 179.8° |
| C7 | C2 | C3 | H3 | 179.9° | 179.8° |
| C7 | C2 | O19 | C20 | 6.9° | 180.0° |
| H7 | C7 | C2 | C3 | 179.9° | 179.7° |
| H7 | C7 | C2 | O19 | 0.7° | 0.0° |
| C4 | C3 | C2 | H3 | 180.0° | 180.0° |
| C4 | C3 | C2 | O19 | 179.4° | 179.9° |
| H4 | C4 | C3 | C2 | 180.0° | 180.0° |
| H4 | C4 | C3 | H3 | 0.0° | 0.0° |
| C3 | C2 | O19 | C20 | 173.9° | 0.2° |
| H3 | C3 | C2 | O19 | 0.6° | 0.0° |
| C2 | O19 | C20 | H201 | 137.2° | 180.0° |
| C2 | O19 | C20 | H202 | 17.2° | 60.0° |
| C2 | O19 | C20 | H203 | 102.8° | 60.0° |
| O19 | C20 | H201 | H202 | 120.0° | 120.0° |
| O19 | C20 | H201 | H203 | 120.0° | 119.9° |
| O19 | C20 | H202 | H203 | 120.0° | 120.0° |
| H201 | C20 | H202 | H203 | 120.0° | 120.1° |
