MZ8
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 | 1.63Å | |
S8 | C5 | sing | 1.76Å | 1.64Å | |
C5 | C4 | doub | 1.38Å | 1.41Å | Aromatic |
C5 | C6 | sing | 1.39Å | 1.40Å | Aromatic |
C4 | C3 | sing | 1.39Å | 1.42Å | Aromatic |
C4 | H4 | sing | 1.08Å | 1.08Å | |
C3 | S1 | sing | 1.76Å | 1.71Å | Aromatic |
C3 | C2 | doub | 1.40Å | 1.40Å | Aromatic |
S1 | C1 | sing | 1.71Å | 1.74Å | Aromatic |
C1 | N1 | doub | 1.28Å | 1.35Å | Aromatic |
C1 | H1 | sing | 1.08Å | 1.08Å | |
N1 | C2 | sing | 1.35Å | 1.36Å | Aromatic |
C2 | C7 | sing | 1.41Å | 1.39Å | Aromatic |
C7 | C6 | doub | 1.36Å | 1.39Å | Aromatic |
C7 | H7 | sing | 1.08Å | 1.08Å | |
C6 | H6 | sing | 1.08Å | 1.08Å | |
N11 | C16 | sing | 1.46Å | 1.48Å | |
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 | 1.52Å | |
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 | H151 | sing | 1.09Å | 1.10Å | |
C15 | H152 | sing | 1.09Å | 1.10Å | |
C15 | H153 | 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 | 1.52Å | |
C17 | O18 | sing | 1.43Å | 1.44Å | |
C17 | H17 | sing | 1.09Å | 1.10Å | |
O18 | HO18 | sing | 0.97Å | 0.95Å | |
C19 | N20 | sing | 1.47Å | 1.46Å | |
C19 | C32 | sing | 1.53Å | 1.54Å | |
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 |
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 | 1.40Å | Aromatic |
C36 | H36 | sing | 1.08Å | 1.08Å | |
C37 | H37 | sing | 1.08Å | 1.08Å | |
N20 | C21 | sing | 1.35Å | 1.33Å | |
N20 | HN20 | sing | 0.97Å | 1.00Å | |
C21 | C22 | sing | 1.48Å | 1.49Å | |
C21 | O22 | doub | 1.22Å | 1.22Å | |
C22 | C23 | doub | 1.40Å | 1.40Å | Aromatic |
C22 | C27 | sing | 1.40Å | 1.38Å | Aromatic |
C23 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
C23 | H23 | sing | 1.08Å | 1.08Å | |
C24 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
C24 | H24 | sing | 1.08Å | 1.08Å | |
C25 | C26 | sing | 1.39Å | 1.40Å | Aromatic |
C25 | H25 | sing | 1.08Å | 1.08Å | |
C26 | O27 | sing | 1.36Å | 1.35Å | |
C26 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
O27 | HO27 | sing | 0.97Å | 0.95Å | |
C27 | H27 | sing | 1.08Å | 1.08Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
O9 | S8 | O10 | 109.5° | 123.2° |
O9 | S8 | N11 | 104.7° | 106.4° |
O9 | S8 | C5 | 111.4° | 106.4° |
O10 | S8 | N11 | 108.2° | 106.4° |
O10 | S8 | C5 | 111.0° | 106.4° |
N11 | S8 | C5 | 111.7° | 107.2° |
S8 | N11 | C16 | 113.2° | 120.0° |
S8 | N11 | C12 | 113.2° | 120.0° |
S8 | C5 | C4 | 125.5° | 120.0° |
S8 | C5 | C6 | 117.8° | 120.0° |
C4 | C5 | C6 | 116.7° | 120.0° |
C5 | C4 | C3 | 122.2° | 120.0° |
C5 | C4 | H4 | 118.9° | 120.0° |
C5 | C6 | C7 | 121.7° | 120.8° |
C5 | C6 | H6 | 119.2° | 119.6° |
C3 | C4 | H4 | 118.9° | 120.0° |
C4 | C3 | S1 | 126.2° | 131.7° |
C4 | C3 | C2 | 118.9° | 120.3° |
S1 | C3 | C2 | 114.9° | 108.0° |
C3 | S1 | C1 | 86.8° | 90.9° |
C3 | C2 | N1 | 110.9° | 111.8° |
C3 | C2 | C7 | 119.5° | 118.5° |
S1 | C1 | N1 | 115.3° | 111.5° |
S1 | C1 | H1 | 122.4° | 124.3° |
N1 | C1 | H1 | 122.4° | 124.2° |
C1 | N1 | C2 | 112.2° | 117.9° |
N1 | C2 | C7 | 129.7° | 129.7° |
C2 | C7 | C6 | 121.0° | 120.4° |
C2 | C7 | H7 | 119.5° | 119.8° |
C6 | C7 | H7 | 119.5° | 119.8° |
C7 | C6 | H6 | 119.1° | 119.6° |
C16 | N11 | C12 | 113.0° | 120.0° |
N11 | C16 | C17 | 111.4° | 109.5° |
N11 | C16 | H161 | 108.8° | 109.4° |
N11 | C16 | H162 | 108.4° | 109.4° |
N11 | C12 | C13 | 110.8° | 109.4° |
N11 | C12 | H121 | 109.0° | 109.5° |
N11 | C12 | H122 | 108.7° | 109.5° |
C13 | C12 | H121 | 109.0° | 109.5° |
C13 | C12 | H122 | 108.7° | 109.4° |
C12 | C13 | C14 | 112.9° | 109.5° |
C12 | C13 | C15 | 109.1° | 109.5° |
C12 | C13 | H13 | 108.3° | 109.5° |
H121 | C12 | H122 | 110.5° | 109.5° |
C14 | C13 | C15 | 112.0° | 109.5° |
C14 | C13 | H13 | 105.2° | 109.4° |
C13 | C14 | H141 | 109.5° | 109.5° |
C13 | C14 | H142 | 109.5° | 109.5° |
C13 | C14 | H143 | 109.4° | 109.4° |
C15 | C13 | H13 | 109.2° | 109.5° |
C13 | C15 | H151 | 109.5° | 109.5° |
C13 | C15 | H152 | 109.5° | 109.5° |
C13 | C15 | H153 | 109.5° | 109.5° |
H141 | C14 | H142 | 109.4° | 109.5° |
H141 | C14 | H143 | 109.5° | 109.5° |
H142 | C14 | H143 | 109.5° | 109.5° |
H151 | C15 | H152 | 109.4° | 109.4° |
H151 | C15 | H153 | 109.4° | 109.5° |
H152 | C15 | H153 | 109.5° | 109.5° |
C17 | C16 | H161 | 108.9° | 109.5° |
C17 | C16 | H162 | 108.4° | 109.5° |
C16 | C17 | C19 | 110.5° | 109.5° |
C16 | C17 | O18 | 110.6° | 109.5° |
C16 | C17 | H17 | 108.5° | 109.5° |
H161 | C16 | H162 | 111.0° | 109.5° |
C19 | C17 | O18 | 111.0° | 109.5° |
C19 | C17 | H17 | 108.1° | 109.4° |
C17 | C19 | N20 | 111.9° | 109.5° |
C17 | C19 | C32 | 114.9° | 109.5° |
C17 | C19 | H19 | 102.1° | 109.5° |
O18 | C17 | H17 | 108.0° | 109.5° |
C17 | O18 | HO18 | 109.5° | 114.0° |
N20 | C19 | C32 | 103.1° | 109.4° |
N20 | C19 | H19 | 114.2° | 109.5° |
C19 | N20 | C21 | 125.4° | 120.0° |
C19 | N20 | HN20 | 117.3° | 120.0° |
C32 | C19 | H19 | 111.1° | 109.5° |
C19 | C32 | C38 | 110.7° | 109.5° |
C19 | C32 | H321 | 109.0° | 109.5° |
C19 | C32 | H322 | 108.8° | 109.4° |
C38 | C32 | H321 | 109.1° | 109.5° |
C38 | C32 | H322 | 108.8° | 109.5° |
C32 | C38 | C37 | 121.3° | 120.0° |
C32 | C38 | C33 | 119.8° | 120.0° |
H321 | C32 | H322 | 110.4° | 109.5° |
C37 | C38 | C33 | 119.0° | 120.0° |
C38 | C37 | C36 | 120.4° | 120.0° |
C38 | C37 | H37 | 119.8° | 120.0° |
C38 | C33 | C34 | 120.6° | 120.0° |
C38 | C33 | H33 | 119.7° | 120.0° |
C34 | C33 | H33 | 119.7° | 120.0° |
C33 | C34 | C35 | 120.2° | 120.0° |
C33 | C34 | H34 | 119.9° | 120.0° |
C35 | C34 | H34 | 119.9° | 120.0° |
C34 | C35 | C36 | 119.7° | 120.0° |
C34 | C35 | H35 | 120.1° | 120.0° |
C36 | C35 | H35 | 120.2° | 120.0° |
C35 | C36 | C37 | 120.1° | 120.0° |
C35 | C36 | H36 | 120.0° | 120.0° |
C37 | C36 | H36 | 119.9° | 120.0° |
C36 | C37 | H37 | 119.8° | 119.9° |
C21 | N20 | HN20 | 117.3° | 120.0° |
N20 | C21 | C22 | 116.5° | 120.0° |
N20 | C21 | O22 | 125.7° | 120.0° |
C22 | C21 | O22 | 117.7° | 120.0° |
C21 | C22 | C23 | 117.5° | 120.1° |
C21 | C22 | C27 | 122.9° | 120.1° |
C23 | C22 | C27 | 119.5° | 119.8° |
C22 | C23 | C24 | 121.2° | 119.9° |
C22 | C23 | H23 | 119.4° | 120.0° |
C22 | C27 | C26 | 119.1° | 119.8° |
C22 | C27 | H27 | 120.4° | 120.1° |
C24 | C23 | H23 | 119.4° | 120.0° |
C23 | C24 | C25 | 119.2° | 120.2° |
C23 | C24 | H24 | 120.4° | 119.9° |
C25 | C24 | H24 | 120.4° | 119.9° |
C24 | C25 | C26 | 119.3° | 120.2° |
C24 | C25 | H25 | 120.3° | 119.9° |
C26 | C25 | H25 | 120.4° | 119.8° |
C25 | C26 | O27 | 119.4° | 120.0° |
C25 | C26 | C27 | 121.6° | 120.0° |
O27 | C26 | C27 | 119.0° | 120.0° |
C26 | O27 | HO27 | 109.5° | 114.0° |
C26 | C27 | H27 | 120.4° | 120.1° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
O9 | S8 | O10 | N11 | 113.6° | 122.9° |
O9 | S8 | O10 | C5 | 123.4° | 123.0° |
O9 | S8 | N11 | C5 | 120.7° | 113.5° |
O9 | S8 | C5 | C4 | 26.5° | 150.6° |
O9 | S8 | C5 | C6 | 154.6° | 29.1° |
O9 | S8 | N11 | C16 | 156.2° | 28.9° |
O9 | S8 | N11 | C12 | 73.5° | 151.1° |
O10 | S8 | N11 | C5 | 122.5° | 113.5° |
O10 | S8 | C5 | C4 | 148.9° | 17.6° |
O10 | S8 | C5 | C6 | 32.3° | 162.1° |
O10 | S8 | N11 | C16 | 39.4° | 161.8° |
O10 | S8 | N11 | C12 | 169.8° | 18.2° |
N11 | S8 | C5 | C4 | 90.3° | 95.9° |
N11 | S8 | C5 | C6 | 88.6° | 84.4° |
S8 | N11 | C16 | C12 | 130.4° | 179.9° |
S8 | N11 | C12 | C13 | 150.3° | 114.9° |
S8 | N11 | C12 | H121 | 30.3° | 125.2° |
S8 | N11 | C12 | H122 | 90.2° | 5.1° |
S8 | N11 | C16 | C17 | 119.6° | 95.0° |
S8 | N11 | C16 | H161 | 120.4° | 145.0° |
S8 | N11 | C16 | H162 | 0.4° | 25.0° |
S8 | C5 | C4 | C6 | 178.9° | 179.7° |
S8 | C5 | C4 | C3 | 178.4° | 180.0° |
S8 | C5 | C4 | H4 | 1.6° | 0.1° |
S8 | C5 | C6 | C7 | 177.6° | 179.7° |
S8 | C5 | C6 | H6 | 2.4° | 0.1° |
C5 | S8 | N11 | C16 | 83.1° | 84.7° |
C5 | S8 | N11 | C12 | 47.2° | 95.4° |
C5 | C4 | C3 | H4 | 180.0° | 179.9° |
C5 | C4 | C3 | S1 | 179.8° | 180.0° |
C5 | C4 | C3 | C2 | 0.4° | 0.1° |
C4 | C5 | C6 | C7 | 1.4° | 0.6° |
C4 | C5 | C6 | H6 | 178.6° | 179.8° |
C6 | C5 | C4 | C3 | 0.5° | 0.3° |
C6 | C5 | C4 | H4 | 179.5° | 179.8° |
C5 | C6 | C7 | C2 | 1.4° | 0.6° |
C5 | C6 | C7 | H6 | 180.0° | 179.7° |
C5 | C6 | C7 | H7 | 178.7° | 179.7° |
C4 | C3 | S1 | C2 | 179.4° | 179.9° |
C4 | C3 | S1 | C1 | 179.9° | 180.0° |
C4 | C3 | C2 | N1 | 179.4° | 180.0° |
C4 | C3 | C2 | C7 | 0.5° | 0.1° |
H4 | C4 | C3 | S1 | 0.2° | 0.1° |
H4 | C4 | C3 | C2 | 179.6° | 180.0° |
C3 | S1 | C1 | N1 | 0.9° | 0.1° |
C3 | S1 | C1 | H1 | 179.1° | 180.0° |
S1 | C3 | C2 | N1 | 0.0° | 0.0° |
S1 | C3 | C2 | C7 | 180.0° | 180.0° |
C2 | C3 | S1 | C1 | 0.5° | 0.1° |
C3 | C2 | N1 | C1 | 0.7° | 0.0° |
C3 | C2 | N1 | C7 | 180.0° | 179.9° |
C3 | C2 | C7 | C6 | 0.3° | 0.4° |
C3 | C2 | C7 | H7 | 179.7° | 179.9° |
S1 | C1 | N1 | H1 | 180.0° | 180.0° |
S1 | C1 | N1 | C2 | 1.1° | 0.1° |
C1 | N1 | C2 | C7 | 179.3° | 179.9° |
H1 | C1 | N1 | C2 | 178.9° | 180.0° |
N1 | C2 | C7 | C6 | 179.7° | 179.7° |
N1 | C2 | C7 | H7 | 0.3° | 0.0° |
C2 | C7 | C6 | H7 | 180.0° | 179.7° |
C2 | C7 | C6 | H6 | 178.6° | 179.7° |
H7 | C7 | C6 | H6 | 1.3° | 0.0° |
C16 | N11 | C12 | C13 | 79.3° | 65.2° |
C16 | N11 | C12 | H121 | 160.8° | 54.8° |
C16 | N11 | C12 | H122 | 40.2° | 174.8° |
N11 | C16 | C17 | H161 | 120.0° | 120.0° |
N11 | C16 | C17 | H162 | 119.2° | 120.0° |
N11 | C16 | H161 | H162 | 119.2° | 119.9° |
N11 | C16 | C17 | C19 | 67.5° | 175.0° |
N11 | C16 | C17 | O18 | 169.2° | 65.0° |
N11 | C16 | C17 | H17 | 50.8° | 55.0° |
N11 | C12 | C13 | H121 | 120.0° | 120.0° |
N11 | C12 | C13 | H122 | 119.5° | 120.0° |
N11 | C12 | H121 | H122 | 119.5° | 120.1° |
N11 | C12 | C13 | C14 | 58.2° | 176.9° |
N11 | C12 | C13 | C15 | 176.6° | 63.1° |
N11 | C12 | C13 | H13 | 57.8° | 56.9° |
C12 | N11 | C16 | C17 | 110.0° | 85.0° |
C12 | N11 | C16 | H161 | 10.0° | 35.1° |
C12 | N11 | C16 | H162 | 130.9° | 155.0° |
C13 | C12 | H121 | H122 | 119.4° | 120.0° |
C12 | C13 | C14 | C15 | 123.6° | 120.0° |
C12 | C13 | C14 | H13 | 117.8° | 120.0° |
C12 | C13 | C15 | H13 | 118.2° | 120.0° |
C12 | C13 | C14 | H141 | 13.4° | 60.0° |
C12 | C13 | C14 | H142 | 106.6° | 180.0° |
C12 | C13 | C14 | H143 | 133.4° | 60.0° |
C12 | C13 | C15 | H151 | 99.8° | 54.7° |
C12 | C13 | C15 | H152 | 140.2° | 65.3° |
C12 | C13 | C15 | H153 | 20.1° | 174.7° |
H121 | C12 | C13 | C14 | 61.8° | 56.9° |
H121 | C12 | C13 | C15 | 63.4° | 176.9° |
H121 | C12 | C13 | H13 | 177.8° | 63.1° |
H122 | C12 | C13 | C14 | 177.6° | 63.1° |
H122 | C12 | C13 | C15 | 57.2° | 56.9° |
H122 | C12 | C13 | H13 | 61.6° | 176.9° |
C14 | C13 | C15 | H13 | 116.1° | 120.0° |
C13 | C14 | H141 | H142 | 120.0° | 120.0° |
C13 | C14 | H141 | H143 | 120.0° | 120.0° |
C13 | C14 | H142 | H143 | 120.0° | 120.0° |
C14 | C13 | C15 | H151 | 134.5° | 65.3° |
C14 | C13 | C15 | H152 | 14.5° | 174.8° |
C14 | C13 | C15 | H153 | 105.6° | 54.7° |
C15 | C13 | C14 | H141 | 137.1° | 60.0° |
C15 | C13 | C14 | H142 | 17.1° | 60.0° |
C15 | C13 | C14 | H143 | 103.0° | 180.0° |
C13 | C15 | H151 | H152 | 120.0° | 120.0° |
C13 | C15 | H151 | H153 | 120.0° | 120.0° |
C13 | C15 | H152 | H153 | 120.0° | 120.1° |
H13 | C13 | C14 | H141 | 104.4° | 180.0° |
H13 | C13 | C14 | H142 | 135.6° | 60.0° |
H13 | C13 | C14 | H143 | 15.6° | 60.0° |
H13 | C13 | C15 | H151 | 18.4° | 174.7° |
H13 | C13 | C15 | H152 | 101.6° | 54.8° |
H13 | C13 | C15 | H153 | 138.3° | 65.3° |
H141 | C14 | H142 | H143 | 120.0° | 120.0° |
H151 | C15 | H152 | H153 | 119.9° | 120.0° |
C17 | C16 | H161 | H162 | 119.2° | 120.1° |
C16 | C17 | C19 | O18 | 123.1° | 120.0° |
C16 | C17 | C19 | H17 | 118.6° | 120.0° |
C16 | C17 | O18 | H17 | 118.6° | 120.0° |
C16 | C17 | O18 | HO18 | 143.8° | 60.0° |
C16 | C17 | C19 | N20 | 166.3° | 175.0° |
C16 | C17 | C19 | C32 | 76.6° | 65.0° |
C16 | C17 | C19 | H19 | 43.8° | 55.0° |
H161 | C16 | C17 | C19 | 172.5° | 65.0° |
H161 | C16 | C17 | O18 | 49.2° | 55.0° |
H161 | C16 | C17 | H17 | 69.2° | 175.0° |
H162 | C16 | C17 | C19 | 51.6° | 55.0° |
H162 | C16 | C17 | O18 | 71.7° | 175.0° |
H162 | C16 | C17 | H17 | 170.0° | 64.9° |
C19 | C17 | O18 | H17 | 118.4° | 120.0° |
C19 | C17 | O18 | HO18 | 20.8° | 60.0° |
C17 | C19 | N20 | C32 | 124.1° | 120.0° |
C17 | C19 | N20 | H19 | 115.3° | 120.0° |
C17 | C19 | C32 | H19 | 115.2° | 120.0° |
C17 | C19 | C32 | C38 | 178.1° | 175.0° |
C17 | C19 | C32 | H321 | 58.1° | 64.9° |
C17 | C19 | C32 | H322 | 62.4° | 55.0° |
C17 | C19 | N20 | C21 | 102.7° | 155.0° |
C17 | C19 | N20 | HN20 | 77.3° | 25.0° |
O18 | C17 | C19 | N20 | 70.7° | 65.0° |
O18 | C17 | C19 | C32 | 46.5° | 55.0° |
O18 | C17 | C19 | H19 | 166.8° | 175.0° |
H17 | C17 | O18 | HO18 | 97.6° | 180.0° |
H17 | C17 | C19 | N20 | 47.7° | 55.0° |
H17 | C17 | C19 | C32 | 164.8° | 175.0° |
H17 | C17 | C19 | H19 | 74.8° | 65.0° |
N20 | C19 | C32 | H19 | 122.7° | 120.0° |
N20 | C19 | C32 | C38 | 56.0° | 65.0° |
N20 | C19 | C32 | H321 | 64.0° | 55.0° |
N20 | C19 | C32 | H322 | 175.5° | 175.0° |
C19 | N20 | C21 | HN20 | 180.0° | 180.0° |
C19 | N20 | C21 | C22 | 173.3° | 180.0° |
C19 | N20 | C21 | O22 | 2.7° | 0.0° |
C19 | C32 | C38 | H321 | 120.0° | 120.0° |
C19 | C32 | C38 | H322 | 119.5° | 119.9° |
C19 | C32 | H321 | H322 | 119.5° | 119.9° |
C19 | C32 | C38 | C37 | 67.2° | 90.0° |
C19 | C32 | C38 | C33 | 112.0° | 89.7° |
C32 | C19 | N20 | C21 | 133.2° | 85.0° |
C32 | C19 | N20 | HN20 | 46.8° | 95.0° |
H19 | C19 | C32 | C38 | 66.7° | 55.0° |
H19 | C19 | C32 | H321 | 173.3° | 175.0° |
H19 | C19 | C32 | H322 | 52.8° | 65.0° |
H19 | C19 | N20 | C21 | 12.6° | 35.0° |
H19 | C19 | N20 | HN20 | 167.4° | 145.0° |
C38 | C32 | H321 | H322 | 119.5° | 120.1° |
C32 | C38 | C37 | C33 | 179.1° | 179.7° |
C32 | C38 | C33 | C34 | 178.9° | 180.0° |
C32 | C38 | C33 | H33 | 1.1° | 0.0° |
C32 | C38 | C37 | C36 | 179.0° | 179.8° |
C32 | C38 | C37 | H37 | 1.0° | 0.0° |
H321 | C32 | C38 | C37 | 172.9° | 30.0° |
H321 | C32 | C38 | C33 | 8.0° | 150.3° |
H322 | C32 | C38 | C37 | 52.4° | 150.1° |
H322 | C32 | C38 | C33 | 128.5° | 30.2° |
C37 | C38 | C33 | C34 | 0.2° | 0.3° |
C37 | C38 | C33 | H33 | 179.8° | 179.7° |
C38 | C37 | C36 | C35 | 0.3° | 0.5° |
C38 | C37 | C36 | H37 | 180.0° | 179.8° |
C38 | C37 | C36 | H36 | 179.7° | 179.7° |
C38 | C33 | C34 | H33 | 180.0° | 179.9° |
C38 | C33 | C34 | C35 | 0.4° | 0.0° |
C38 | C33 | C34 | H34 | 179.6° | 179.9° |
C33 | C38 | C37 | C36 | 0.1° | 0.5° |
C33 | C38 | C37 | H37 | 179.8° | 179.7° |
C33 | C34 | C35 | H34 | 180.0° | 179.9° |
C33 | C34 | C35 | C36 | 0.6° | 0.0° |
C33 | C34 | C35 | H35 | 179.4° | 180.0° |
H33 | C33 | C34 | C35 | 179.6° | 180.0° |
H33 | C33 | C34 | H34 | 0.5° | 0.0° |
C34 | C35 | C36 | H35 | 180.0° | 180.0° |
C34 | C35 | C36 | C37 | 0.5° | 0.2° |
C34 | C35 | C36 | H36 | 179.5° | 179.9° |
H34 | C34 | C35 | C36 | 179.4° | 180.0° |
H34 | C34 | C35 | H35 | 0.6° | 0.0° |
C35 | C36 | C37 | H36 | 180.0° | 179.9° |
C35 | C36 | C37 | H37 | 179.7° | 179.8° |
H35 | C35 | C36 | C37 | 179.5° | 179.8° |
H35 | C35 | C36 | H36 | 0.5° | 0.1° |
H36 | C36 | C37 | H37 | 0.3° | 0.1° |
N20 | C21 | C22 | O22 | 176.4° | 179.9° |
N20 | C21 | C22 | C23 | 45.5° | 0.0° |
N20 | C21 | C22 | C27 | 138.3° | 179.7° |
HN20 | N20 | C21 | C22 | 6.7° | 0.0° |
HN20 | N20 | C21 | O22 | 177.3° | 180.0° |
C21 | C22 | C23 | C27 | 176.4° | 179.7° |
C21 | C22 | C23 | C24 | 178.4° | 180.0° |
C21 | C22 | C23 | H23 | 1.6° | 0.1° |
C21 | C22 | C27 | C26 | 177.5° | 179.8° |
C21 | C22 | C27 | H27 | 2.5° | 0.1° |
O22 | C21 | C22 | C23 | 130.9° | 180.0° |
O22 | C21 | C22 | C27 | 45.3° | 0.3° |
C22 | C23 | C24 | H23 | 180.0° | 180.0° |
C22 | C23 | C24 | C25 | 1.5° | 0.0° |
C22 | C23 | C24 | H24 | 178.5° | 180.0° |
C23 | C22 | C27 | C26 | 1.3° | 0.5° |
C23 | C22 | C27 | H27 | 178.7° | 179.8° |
C27 | C22 | C23 | C24 | 2.0° | 0.3° |
C27 | C22 | C23 | H23 | 178.0° | 179.7° |
C22 | C27 | C26 | C25 | 0.1° | 0.5° |
C22 | C27 | C26 | O27 | 179.0° | 179.7° |
C22 | C27 | C26 | H27 | 180.0° | 179.7° |
C23 | C24 | C25 | H24 | 180.0° | 180.0° |
C23 | C24 | C25 | C26 | 0.2° | 0.0° |
C23 | C24 | C25 | H25 | 179.7° | 180.0° |
H23 | C23 | C24 | C25 | 178.6° | 180.0° |
H23 | C23 | C24 | H24 | 1.4° | 0.0° |
C24 | C25 | C26 | H25 | 180.0° | 180.0° |
C24 | C25 | C26 | O27 | 179.6° | 180.0° |
C24 | C25 | C26 | C27 | 0.4° | 0.3° |
H24 | C24 | C25 | C26 | 179.8° | 180.0° |
H24 | C24 | C25 | H25 | 0.3° | 0.0° |
C25 | C26 | O27 | C27 | 179.2° | 179.7° |
C25 | C26 | O27 | HO27 | 63.4° | 90.0° |
C25 | C26 | C27 | H27 | 179.9° | 179.8° |
H25 | C25 | C26 | O27 | 0.4° | 0.0° |
H25 | C25 | C26 | C27 | 179.6° | 179.8° |
O27 | C26 | C27 | H27 | 1.0° | 0.0° |
C27 | C26 | O27 | HO27 | 117.4° | 89.7° |