MZ1
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O26 | C25 | doub | 1.21Å | 1.23Å | |
| C25 | C27 | sing | 1.51Å | 1.52Å | |
| C25 | N24 | sing | 1.35Å | 1.34Å | |
| C27 | H271 | sing | 1.09Å | 1.10Å | |
| C27 | H272 | sing | 1.09Å | 1.10Å | |
| C27 | H273 | sing | 1.09Å | 1.10Å | |
| N24 | C22 | sing | 1.47Å | 1.46Å | |
| N24 | HN24 | sing | 0.97Å | 1.00Å | |
| C22 | C23 | sing | 1.53Å | 1.53Å | |
| C22 | C21 | sing | 1.51Å | 1.52Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H231 | sing | 1.09Å | 1.10Å | |
| C23 | H232 | sing | 1.09Å | 1.10Å | |
| C23 | H233 | sing | 1.09Å | 1.10Å | |
| C21 | O22 | doub | 1.21Å | 1.24Å | |
| C21 | N20 | sing | 1.35Å | 1.34Å | |
| N20 | C19 | sing | 1.47Å | 1.47Å | |
| N20 | HN20 | sing | 0.97Å | 1.00Å | |
| C19 | C32 | sing | 1.53Å | 1.53Å | |
| C19 | C17 | sing | 1.53Å | 1.54Å | |
| 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 | 1.39Å | 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 | 1.40Å | Aromatic |
| C34 | H34 | sing | 1.08Å | 1.08Å | |
| C33 | H33 | sing | 1.08Å | 1.08Å | |
| C17 | C16 | sing | 1.53Å | 1.55Å | |
| C17 | O18 | sing | 1.43Å | 1.43Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| O18 | HO18 | sing | 0.97Å | 0.95Å | |
| C16 | N11 | sing | 1.47Å | 1.49Å | |
| C16 | H161 | sing | 1.09Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| N11 | S8 | sing | 1.66Å | 1.63Å | |
| N11 | C12 | sing | 1.46Å | 1.49Å | |
| S8 | O9 | doub | 1.42Å | 1.42Å | |
| S8 | O10 | doub | 1.42Å | 1.43Å | |
| S8 | C5 | sing | 1.76Å | 1.64Å | |
| C5 | C6 | doub | 1.38Å | 1.40Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.38Å | 1.41Å | Aromatic |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | F1 | sing | 1.35Å | 1.35Å | |
| C7 | C2 | doub | 1.39Å | 1.39Å | Aromatic |
| C4 | F3 | sing | 1.35Å | 1.33Å | |
| C4 | C3 | doub | 1.38Å | 1.41Å | Aromatic |
| C3 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | F2 | sing | 1.35Å | 1.35Å | |
| C12 | C15 | sing | 1.51Å | 1.53Å | |
| C12 | H121 | sing | 1.09Å | 1.10Å | |
| C12 | H122 | sing | 1.09Å | 1.10Å | |
| C15 | S1 | sing | 1.76Å | 1.68Å | Aromatic |
| C15 | C18 | doub | 1.33Å | 1.36Å | Aromatic |
| C18 | C14 | sing | 1.38Å | 1.42Å | Aromatic |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C14 | C13 | doub | 1.33Å | 1.34Å | Aromatic |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C13 | S1 | sing | 1.76Å | 1.66Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O26 | C25 | C27 | 118.5° | 120.0° |
| O26 | C25 | N24 | 122.2° | 120.0° |
| C27 | C25 | N24 | 119.3° | 120.0° |
| C25 | C27 | H271 | 109.5° | 109.5° |
| C25 | C27 | H272 | 109.5° | 109.5° |
| C25 | C27 | H273 | 109.5° | 109.5° |
| C25 | N24 | C22 | 123.1° | 120.0° |
| C25 | N24 | HN24 | 118.4° | 120.0° |
| H271 | C27 | H272 | 109.4° | 109.4° |
| H271 | C27 | H273 | 109.5° | 109.5° |
| H272 | C27 | H273 | 109.5° | 109.4° |
| C22 | N24 | HN24 | 118.4° | 120.0° |
| N24 | C22 | C23 | 111.4° | 109.4° |
| N24 | C22 | C21 | 108.1° | 109.5° |
| N24 | C22 | H22 | 109.8° | 109.5° |
| C23 | C22 | C21 | 111.4° | 109.5° |
| C23 | C22 | H22 | 106.3° | 109.5° |
| C22 | C23 | H231 | 109.5° | 109.5° |
| C22 | C23 | H232 | 109.5° | 109.4° |
| C22 | C23 | H233 | 109.5° | 109.4° |
| C21 | C22 | H22 | 109.8° | 109.5° |
| C22 | C21 | O22 | 120.2° | 120.0° |
| C22 | C21 | N20 | 117.0° | 120.0° |
| H231 | C23 | H232 | 109.4° | 109.5° |
| H231 | C23 | H233 | 109.5° | 109.5° |
| H232 | C23 | H233 | 109.5° | 109.4° |
| O22 | C21 | N20 | 122.9° | 120.0° |
| C21 | N20 | C19 | 123.8° | 120.1° |
| C21 | N20 | HN20 | 118.1° | 120.0° |
| C19 | N20 | HN20 | 118.1° | 120.0° |
| N20 | C19 | C32 | 106.1° | 109.5° |
| N20 | C19 | C17 | 109.2° | 109.5° |
| N20 | C19 | H19 | 113.1° | 109.4° |
| C32 | C19 | C17 | 113.1° | 109.5° |
| C32 | C19 | H19 | 109.3° | 109.5° |
| C19 | C32 | C38 | 110.2° | 109.5° |
| C19 | C32 | H321 | 109.2° | 109.4° |
| C19 | C32 | H322 | 109.1° | 109.4° |
| C17 | C19 | H19 | 106.2° | 109.5° |
| C19 | C17 | C16 | 112.1° | 109.5° |
| C19 | C17 | O18 | 110.6° | 109.4° |
| C19 | C17 | H17 | 107.1° | 109.5° |
| C38 | C32 | H321 | 109.2° | 109.5° |
| C38 | C32 | H322 | 109.1° | 109.5° |
| C32 | C38 | C37 | 120.7° | 120.0° |
| C32 | C38 | C33 | 120.5° | 120.0° |
| H321 | C32 | H322 | 110.0° | 109.5° |
| C37 | C38 | C33 | 118.8° | 120.0° |
| C38 | C37 | C36 | 120.7° | 120.0° |
| C38 | C37 | H37 | 119.6° | 120.0° |
| C38 | C33 | C34 | 120.6° | 120.0° |
| C38 | C33 | H33 | 119.7° | 120.0° |
| 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 | 119.6° | 120.0° |
| C36 | C35 | H35 | 120.2° | 120.0° |
| C34 | C35 | H35 | 120.2° | 120.0° |
| C35 | C34 | C33 | 120.1° | 120.0° |
| C35 | C34 | H34 | 119.9° | 119.9° |
| C33 | C34 | H34 | 119.9° | 120.1° |
| C34 | C33 | H33 | 119.7° | 120.0° |
| C16 | C17 | O18 | 110.0° | 109.5° |
| C16 | C17 | H17 | 107.7° | 109.5° |
| C17 | C16 | N11 | 108.4° | 109.5° |
| C17 | C16 | H161 | 109.8° | 109.4° |
| C17 | C16 | H162 | 110.1° | 109.4° |
| O18 | C17 | H17 | 109.3° | 109.4° |
| C17 | O18 | HO18 | 109.5° | 114.0° |
| N11 | C16 | H161 | 109.8° | 109.5° |
| N11 | C16 | H162 | 110.1° | 109.4° |
| C16 | N11 | S8 | 115.5° | 120.0° |
| C16 | N11 | C12 | 115.2° | 120.0° |
| H161 | C16 | H162 | 108.7° | 109.5° |
| S8 | N11 | C12 | 112.9° | 120.0° |
| N11 | S8 | O9 | 103.2° | 106.4° |
| N11 | S8 | O10 | 106.9° | 106.4° |
| N11 | S8 | C5 | 116.7° | 107.2° |
| N11 | C12 | C15 | 108.6° | 109.4° |
| N11 | C12 | H121 | 109.8° | 109.5° |
| N11 | C12 | H122 | 110.0° | 109.5° |
| O9 | S8 | O10 | 109.4° | 123.2° |
| O9 | S8 | C5 | 109.2° | 106.4° |
| O10 | S8 | C5 | 111.0° | 106.4° |
| S8 | C5 | C6 | 121.3° | 120.0° |
| S8 | C5 | C4 | 122.4° | 119.9° |
| C6 | C5 | C4 | 116.3° | 120.1° |
| C5 | C6 | C7 | 122.2° | 120.0° |
| C5 | C6 | H6 | 118.9° | 120.0° |
| C5 | C4 | F3 | 120.7° | 120.0° |
| C5 | C4 | C3 | 122.0° | 120.0° |
| C7 | C6 | H6 | 118.9° | 120.0° |
| C6 | C7 | F1 | 122.1° | 120.0° |
| C6 | C7 | C2 | 120.1° | 120.0° |
| F1 | C7 | C2 | 117.8° | 120.0° |
| C7 | C2 | C3 | 119.0° | 120.0° |
| C7 | C2 | F2 | 119.6° | 120.0° |
| F3 | C4 | C3 | 117.3° | 120.0° |
| C4 | C3 | C2 | 120.5° | 120.0° |
| C4 | C3 | H3 | 119.8° | 120.0° |
| C2 | C3 | H3 | 119.7° | 120.0° |
| C3 | C2 | F2 | 121.4° | 120.0° |
| C15 | C12 | H121 | 109.8° | 109.4° |
| C15 | C12 | H122 | 110.0° | 109.4° |
| C12 | C15 | S1 | 122.9° | 125.2° |
| C12 | C15 | C18 | 122.1° | 125.2° |
| H121 | C12 | H122 | 108.8° | 109.5° |
| S1 | C15 | C18 | 115.0° | 109.6° |
| C15 | S1 | C13 | 90.2° | 91.0° |
| C15 | C18 | C14 | 108.4° | 114.9° |
| C15 | C18 | H18 | 125.8° | 122.6° |
| C14 | C18 | H18 | 125.8° | 122.5° |
| C18 | C14 | C13 | 112.6° | 114.9° |
| C18 | C14 | H14 | 123.7° | 122.5° |
| C13 | C14 | H14 | 123.7° | 122.6° |
| C14 | C13 | S1 | 113.8° | 109.6° |
| C14 | C13 | H13 | 123.1° | 125.2° |
| S1 | C13 | H13 | 123.1° | 125.2° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O26 | C25 | C27 | N24 | 178.8° | 179.7° |
| O26 | C25 | C27 | H271 | 174.1° | 0.0° |
| O26 | C25 | C27 | H272 | 54.1° | 120.0° |
| O26 | C25 | C27 | H273 | 65.9° | 120.0° |
| O26 | C25 | N24 | C22 | 1.1° | 0.0° |
| O26 | C25 | N24 | HN24 | 178.8° | 180.0° |
| C25 | C27 | H271 | H272 | 120.0° | 120.0° |
| C25 | C27 | H271 | H273 | 120.0° | 120.0° |
| C25 | C27 | H272 | H273 | 120.0° | 120.0° |
| C27 | C25 | N24 | C22 | 179.8° | 179.7° |
| C27 | C25 | N24 | HN24 | 0.1° | 0.3° |
| N24 | C25 | C27 | H271 | 4.7° | 179.7° |
| N24 | C25 | C27 | H272 | 124.7° | 59.7° |
| N24 | C25 | C27 | H273 | 115.3° | 60.2° |
| C25 | N24 | C22 | HN24 | 180.0° | 180.0° |
| C25 | N24 | C22 | C23 | 113.9° | 85.0° |
| C25 | N24 | C22 | C21 | 123.4° | 155.0° |
| C25 | N24 | C22 | H22 | 3.7° | 35.0° |
| H271 | C27 | H272 | H273 | 120.0° | 120.0° |
| N24 | C22 | C23 | C21 | 120.8° | 120.0° |
| N24 | C22 | C23 | H22 | 119.6° | 120.0° |
| N24 | C22 | C21 | H22 | 119.8° | 120.0° |
| N24 | C22 | C23 | H231 | 18.6° | 60.0° |
| N24 | C22 | C23 | H232 | 138.5° | 179.9° |
| N24 | C22 | C23 | H233 | 101.5° | 60.0° |
| N24 | C22 | C21 | O22 | 72.5° | 0.0° |
| N24 | C22 | C21 | N20 | 107.6° | 180.0° |
| HN24 | N24 | C22 | C23 | 66.1° | 95.0° |
| HN24 | N24 | C22 | C21 | 56.7° | 25.0° |
| HN24 | N24 | C22 | H22 | 176.4° | 145.0° |
| C23 | C22 | C21 | H22 | 117.5° | 120.0° |
| C22 | C23 | H231 | H232 | 120.0° | 120.0° |
| C22 | C23 | H231 | H233 | 120.0° | 120.0° |
| C22 | C23 | H232 | H233 | 120.0° | 119.9° |
| C23 | C22 | C21 | O22 | 50.3° | 120.0° |
| C23 | C22 | C21 | N20 | 129.7° | 60.0° |
| C21 | C22 | C23 | H231 | 102.3° | 60.0° |
| C21 | C22 | C23 | H232 | 17.7° | 60.1° |
| C21 | C22 | C23 | H233 | 137.7° | 180.0° |
| C22 | C21 | O22 | N20 | 180.0° | 180.0° |
| C22 | C21 | N20 | C19 | 178.8° | 180.0° |
| C22 | C21 | N20 | HN20 | 1.2° | 0.0° |
| H22 | C22 | C23 | H231 | 138.2° | 180.0° |
| H22 | C22 | C23 | H232 | 101.9° | 59.9° |
| H22 | C22 | C23 | H233 | 18.1° | 60.0° |
| H22 | C22 | C21 | O22 | 167.8° | 120.0° |
| H22 | C22 | C21 | N20 | 12.2° | 60.0° |
| H231 | C23 | H232 | H233 | 120.0° | 120.1° |
| O22 | C21 | N20 | C19 | 1.2° | 0.0° |
| O22 | C21 | N20 | HN20 | 178.8° | 180.0° |
| C21 | N20 | C19 | HN20 | 180.0° | 180.0° |
| C21 | N20 | C19 | C32 | 118.7° | 85.0° |
| C21 | N20 | C19 | C17 | 119.2° | 155.0° |
| C21 | N20 | C19 | H19 | 1.2° | 35.0° |
| N20 | C19 | C32 | C17 | 119.7° | 120.1° |
| N20 | C19 | C32 | H19 | 122.3° | 119.9° |
| N20 | C19 | C17 | H19 | 122.3° | 119.9° |
| N20 | C19 | C32 | C38 | 60.4° | 65.0° |
| N20 | C19 | C32 | H321 | 59.6° | 55.0° |
| N20 | C19 | C32 | H322 | 179.9° | 175.1° |
| N20 | C19 | C17 | C16 | 169.6° | 175.0° |
| N20 | C19 | C17 | O18 | 67.4° | 65.0° |
| N20 | C19 | C17 | H17 | 51.6° | 54.9° |
| HN20 | N20 | C19 | C32 | 61.3° | 95.0° |
| HN20 | N20 | C19 | C17 | 60.8° | 25.0° |
| HN20 | N20 | C19 | H19 | 178.9° | 145.0° |
| C32 | C19 | C17 | H19 | 119.8° | 120.0° |
| C19 | C32 | C38 | H321 | 120.0° | 120.0° |
| C19 | C32 | C38 | H322 | 119.7° | 120.0° |
| C19 | C32 | H321 | H322 | 119.7° | 120.0° |
| C19 | C32 | C38 | C37 | 77.2° | 90.0° |
| C19 | C32 | C38 | C33 | 101.7° | 90.2° |
| C32 | C19 | C17 | C16 | 72.6° | 65.0° |
| C32 | C19 | C17 | O18 | 50.5° | 55.0° |
| C32 | C19 | C17 | H17 | 169.5° | 175.0° |
| C17 | C19 | C32 | C38 | 179.9° | 175.0° |
| C17 | C19 | C32 | H321 | 60.1° | 65.0° |
| C17 | C19 | C32 | H322 | 60.2° | 55.0° |
| C19 | C17 | C16 | O18 | 123.4° | 120.0° |
| C19 | C17 | C16 | H17 | 117.6° | 120.0° |
| C19 | C17 | O18 | H17 | 117.7° | 120.0° |
| C19 | C17 | O18 | HO18 | 14.7° | 52.6° |
| C19 | C17 | C16 | N11 | 73.1° | 173.4° |
| C19 | C17 | C16 | H161 | 46.9° | 53.3° |
| C19 | C17 | C16 | H162 | 166.5° | 66.7° |
| H19 | C19 | C32 | C38 | 61.9° | 54.9° |
| H19 | C19 | C32 | H321 | 178.1° | 174.9° |
| H19 | C19 | C32 | H322 | 57.8° | 65.0° |
| H19 | C19 | C17 | C16 | 47.3° | 55.0° |
| H19 | C19 | C17 | O18 | 170.3° | 175.0° |
| H19 | C19 | C17 | H17 | 70.7° | 65.0° |
| C38 | C32 | H321 | H322 | 119.7° | 120.0° |
| C32 | C38 | C37 | C33 | 178.9° | 179.8° |
| C32 | C38 | C37 | C36 | 179.6° | 180.0° |
| C32 | C38 | C37 | H37 | 0.4° | 0.0° |
| C32 | C38 | C33 | C34 | 179.3° | 179.8° |
| C32 | C38 | C33 | H33 | 0.7° | 0.1° |
| H321 | C32 | C38 | C37 | 162.8° | 30.0° |
| H321 | C32 | C38 | C33 | 18.3° | 149.8° |
| H322 | C32 | C38 | C37 | 42.5° | 150.1° |
| H322 | C32 | C38 | C33 | 138.6° | 29.7° |
| C38 | C37 | C36 | H37 | 180.0° | 179.9° |
| C38 | C37 | C36 | C35 | 0.6° | 0.0° |
| C38 | C37 | C36 | H36 | 179.4° | 180.0° |
| C37 | C38 | C33 | C34 | 0.4° | 0.4° |
| C37 | C38 | C33 | H33 | 179.6° | 179.7° |
| C33 | C38 | C37 | C36 | 0.7° | 0.2° |
| C33 | C38 | C37 | H37 | 179.3° | 179.8° |
| C38 | C33 | C34 | C35 | 0.0° | 0.4° |
| C38 | C33 | C34 | H33 | 180.0° | 179.9° |
| C38 | C33 | C34 | H34 | 179.9° | 179.8° |
| 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 | 179.4° | 180.0° |
| H37 | C37 | C36 | H36 | 0.6° | 0.1° |
| C36 | C35 | C34 | H35 | 180.0° | 180.0° |
| C36 | C35 | C34 | C33 | 0.2° | 0.2° |
| C36 | C35 | C34 | H34 | 179.8° | 180.0° |
| H36 | C36 | C35 | C34 | 179.9° | 180.0° |
| H36 | C36 | C35 | H35 | 0.1° | 0.0° |
| C35 | C34 | C33 | H34 | 180.0° | 179.9° |
| C35 | C34 | C33 | H33 | 180.0° | 179.7° |
| H35 | C35 | C34 | C33 | 179.8° | 179.9° |
| H35 | C35 | C34 | H34 | 0.2° | 0.0° |
| H34 | C34 | C33 | H33 | 0.0° | 0.1° |
| C16 | C17 | O18 | H17 | 118.0° | 120.0° |
| C16 | C17 | O18 | HO18 | 139.0° | 67.5° |
| C17 | C16 | N11 | H161 | 120.0° | 120.0° |
| C17 | C16 | N11 | H162 | 120.4° | 119.9° |
| C17 | C16 | H161 | H162 | 120.4° | 120.0° |
| C17 | C16 | N11 | S8 | 122.2° | 69.9° |
| C17 | C16 | N11 | C12 | 103.3° | 110.2° |
| O18 | C17 | C16 | N11 | 163.5° | 66.6° |
| O18 | C17 | C16 | H161 | 76.5° | 173.3° |
| O18 | C17 | C16 | H162 | 43.1° | 53.3° |
| H17 | C17 | O18 | HO18 | 103.0° | 172.5° |
| H17 | C17 | C16 | N11 | 44.5° | 53.3° |
| H17 | C17 | C16 | H161 | 164.5° | 66.7° |
| H17 | C17 | C16 | H162 | 75.9° | 173.3° |
| N11 | C16 | H161 | H162 | 120.4° | 120.0° |
| C16 | N11 | S8 | C12 | 135.5° | 179.9° |
| C16 | N11 | S8 | O9 | 156.1° | 149.2° |
| C16 | N11 | S8 | O10 | 40.8° | 16.3° |
| C16 | N11 | S8 | C5 | 84.1° | 97.3° |
| C16 | N11 | C12 | C15 | 105.2° | 82.5° |
| C16 | N11 | C12 | H121 | 134.8° | 157.5° |
| C16 | N11 | C12 | H122 | 15.2° | 37.4° |
| H161 | C16 | N11 | S8 | 2.3° | 50.1° |
| H161 | C16 | N11 | C12 | 136.8° | 129.8° |
| H162 | C16 | N11 | S8 | 117.3° | 170.2° |
| H162 | C16 | N11 | C12 | 17.2° | 9.7° |
| N11 | S8 | O9 | O10 | 113.5° | 122.9° |
| N11 | S8 | O9 | C5 | 124.8° | 114.1° |
| N11 | S8 | O10 | C5 | 128.2° | 114.1° |
| N11 | S8 | C5 | C6 | 103.2° | 115.0° |
| N11 | S8 | C5 | C4 | 77.6° | 65.4° |
| S8 | N11 | C12 | C15 | 119.1° | 97.6° |
| S8 | N11 | C12 | H121 | 0.9° | 22.4° |
| S8 | N11 | C12 | H122 | 120.5° | 142.5° |
| C12 | N11 | S8 | O9 | 68.3° | 30.9° |
| C12 | N11 | S8 | O10 | 176.3° | 163.8° |
| C12 | N11 | S8 | C5 | 51.4° | 82.6° |
| N11 | C12 | C15 | H121 | 120.0° | 120.0° |
| N11 | C12 | C15 | H122 | 120.3° | 120.0° |
| N11 | C12 | H121 | H122 | 120.3° | 120.0° |
| N11 | C12 | C15 | S1 | 35.1° | 97.8° |
| N11 | C12 | C15 | C18 | 143.3° | 82.4° |
| O9 | S8 | O10 | C5 | 120.7° | 123.0° |
| O9 | S8 | C5 | C6 | 13.3° | 1.5° |
| O9 | S8 | C5 | C4 | 165.9° | 178.8° |
| O10 | S8 | C5 | C6 | 134.1° | 131.5° |
| O10 | S8 | C5 | C4 | 45.2° | 48.2° |
| S8 | C5 | C6 | C4 | 179.3° | 179.7° |
| S8 | C5 | C6 | C7 | 179.9° | 180.0° |
| S8 | C5 | C6 | H6 | 0.0° | 0.0° |
| S8 | C5 | C4 | F3 | 0.0° | 0.1° |
| S8 | C5 | C4 | C3 | 179.6° | 180.0° |
| C5 | C6 | C7 | H6 | 180.0° | 180.0° |
| C5 | C6 | C7 | F1 | 179.1° | 180.0° |
| C5 | C6 | C7 | C2 | 0.5° | 0.0° |
| C6 | C5 | C4 | F3 | 179.3° | 179.7° |
| C6 | C5 | C4 | C3 | 0.3° | 0.4° |
| C4 | C5 | C6 | C7 | 0.6° | 0.3° |
| C4 | C5 | C6 | H6 | 179.3° | 179.7° |
| C5 | C4 | F3 | C3 | 179.6° | 179.9° |
| C5 | C4 | C3 | C2 | 0.2° | 0.1° |
| C5 | C4 | C3 | H3 | 179.8° | 179.9° |
| C6 | C7 | F1 | C2 | 179.6° | 180.0° |
| C6 | C7 | C2 | C3 | 0.0° | 0.2° |
| C6 | C7 | C2 | F2 | 180.0° | 180.0° |
| H6 | C6 | C7 | F1 | 0.9° | 0.0° |
| H6 | C6 | C7 | C2 | 179.5° | 180.0° |
| F1 | C7 | C2 | C3 | 179.6° | 179.7° |
| F1 | C7 | C2 | F2 | 0.4° | 0.1° |
| C7 | C2 | C3 | C4 | 0.3° | 0.2° |
| C7 | C2 | C3 | F2 | 180.0° | 179.8° |
| C7 | C2 | C3 | H3 | 179.7° | 179.8° |
| F3 | C4 | C3 | C2 | 179.8° | 180.0° |
| F3 | C4 | C3 | H3 | 0.2° | 0.1° |
| C4 | C3 | C2 | H3 | 180.0° | 179.9° |
| C4 | C3 | C2 | F2 | 179.7° | 180.0° |
| H3 | C3 | C2 | F2 | 0.3° | 0.0° |
| C15 | C12 | H121 | H122 | 120.4° | 120.0° |
| C12 | C15 | S1 | C18 | 178.6° | 179.8° |
| C12 | C15 | C18 | C14 | 178.5° | 180.0° |
| C12 | C15 | C18 | H18 | 1.5° | 0.0° |
| C12 | C15 | S1 | C13 | 178.4° | 179.9° |
| H121 | C12 | C15 | S1 | 84.9° | 142.2° |
| H121 | C12 | C15 | C18 | 96.7° | 37.6° |
| H122 | C12 | C15 | S1 | 155.5° | 22.1° |
| H122 | C12 | C15 | C18 | 23.0° | 157.6° |
| S1 | C15 | C18 | C14 | 0.1° | 0.2° |
| S1 | C15 | C18 | H18 | 180.0° | 179.8° |
| C15 | S1 | C13 | C14 | 0.2° | 0.3° |
| C15 | S1 | C13 | H13 | 179.8° | 179.9° |
| C15 | C18 | C14 | H18 | 180.0° | 180.0° |
| C15 | C18 | C14 | C13 | 0.1° | 0.0° |
| C15 | C18 | C14 | H14 | 179.9° | 180.0° |
| C18 | C15 | S1 | C13 | 0.1° | 0.3° |
| C18 | C14 | C13 | H14 | 180.0° | 180.0° |
| C18 | C14 | C13 | S1 | 0.1° | 0.2° |
| C18 | C14 | C13 | H13 | 179.9° | 180.0° |
| H18 | C18 | C14 | C13 | 179.9° | 180.0° |
| H18 | C18 | C14 | H14 | 0.1° | 0.0° |
| C14 | C13 | S1 | H13 | 180.0° | 179.8° |
| H14 | C14 | C13 | S1 | 179.8° | 179.8° |
| H14 | C14 | C13 | H13 | 0.2° | 0.0° |
