K14
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C1 | O1 | sing | 1.43Å | 1.44Å | |
O1 | C2 | sing | 1.36Å | 1.38Å | |
C2 | C3 | doub | 1.39Å | 1.40Å | Aromatic |
C2 | C7 | sing | 1.39Å | 1.40Å | Aromatic |
C3 | C4 | sing | 1.38Å | 1.40Å | Aromatic |
C4 | C5 | doub | 1.38Å | 1.39Å | Aromatic |
C5 | C6 | sing | 1.38Å | 1.40Å | Aromatic |
C5 | S8 | sing | 1.76Å | 1.63Å | |
C6 | C7 | doub | 1.38Å | 1.41Å | Aromatic |
S8 | O9 | doub | 1.42Å | 1.43Å | |
S8 | O10 | doub | 1.42Å | 1.45Å | |
S8 | N11 | sing | 1.66Å | 1.62Å | |
N11 | C12 | sing | 1.46Å | 1.49Å | |
N11 | C16 | sing | 1.46Å | 1.48Å | |
C12 | C13 | sing | 1.53Å | 1.53Å | |
C13 | C14 | sing | 1.53Å | 1.53Å | |
C13 | C15 | sing | 1.53Å | 1.53Å | |
C15 | C18 | sing | 1.53Å | 1.51Å | |
C16 | C17 | sing | 1.53Å | 1.53Å | |
C17 | O18 | sing | 1.43Å | 1.43Å | |
C17 | C19 | sing | 1.53Å | 1.52Å | |
C19 | N20 | sing | 1.46Å | 1.44Å | |
C19 | C32 | sing | 1.53Å | 1.54Å | |
N20 | C21 | sing | 1.35Å | 1.33Å | |
C21 | O22 | doub | 1.22Å | 1.22Å | |
C21 | O23 | sing | 1.35Å | 1.44Å | |
O23 | C24 | sing | 1.45Å | 1.42Å | |
C24 | C25 | sing | 1.54Å | 1.51Å | |
C24 | C31 | sing | 1.54Å | 1.51Å | |
C25 | O26 | sing | 1.43Å | 1.43Å | |
O26 | C27 | sing | 1.44Å | 1.43Å | |
C27 | O28 | sing | 1.43Å | 1.43Å | |
C27 | C31 | sing | 1.56Å | 1.52Å | |
O28 | C29 | sing | 1.43Å | 1.44Å | |
C29 | C30 | sing | 1.54Å | 1.52Å | |
C30 | C31 | sing | 1.55Å | 1.52Å | |
C32 | C38 | sing | 1.51Å | 1.52Å | |
C33 | C34 | doub | 1.38Å | 1.38Å | Aromatic |
C33 | C38 | sing | 1.38Å | 1.39Å | Aromatic |
C34 | C35 | sing | 1.38Å | 1.38Å | Aromatic |
C35 | C36 | doub | 1.38Å | 1.38Å | Aromatic |
C36 | C37 | sing | 1.38Å | 1.39Å | Aromatic |
C37 | C38 | doub | 1.38Å | 1.38Å | Aromatic |
C1 | H1 | sing | 1.09Å | 1.10Å | |
C1 | H1A | sing | 1.09Å | 1.10Å | |
C1 | H1B | sing | 1.09Å | 1.10Å | |
C3 | H3 | sing | 1.08Å | 1.08Å | |
C4 | H4 | sing | 1.08Å | 1.08Å | |
C6 | H6 | sing | 1.08Å | 1.08Å | |
C7 | H7 | sing | 1.08Å | 1.08Å | |
C12 | H12 | sing | 1.09Å | 1.10Å | |
C12 | H12A | sing | 1.09Å | 1.10Å | |
C13 | H13 | sing | 1.09Å | 1.10Å | |
C14 | H14 | sing | 1.09Å | 1.10Å | |
C14 | H14A | sing | 1.09Å | 1.10Å | |
C14 | H14B | sing | 1.09Å | 1.10Å | |
C15 | H15 | sing | 1.09Å | 1.10Å | |
C15 | H15A | sing | 1.09Å | 1.10Å | |
C16 | H16 | sing | 1.09Å | 1.10Å | |
C16 | H16A | sing | 1.09Å | 1.10Å | |
C17 | H17 | sing | 1.09Å | 1.10Å | |
C18 | H18 | sing | 1.09Å | 1.10Å | |
C18 | H18A | sing | 1.09Å | 1.10Å | |
C18 | H18B | sing | 1.09Å | 1.10Å | |
O18 | HO18 | sing | 0.97Å | 0.95Å | |
C19 | H19 | sing | 1.09Å | 1.10Å | |
N20 | HN20 | sing | 0.97Å | 1.00Å | |
C24 | H24 | sing | 1.09Å | 1.10Å | |
C25 | H25 | sing | 1.09Å | 1.10Å | |
C25 | H25A | sing | 1.09Å | 1.10Å | |
C27 | H27 | sing | 1.09Å | 1.10Å | |
C29 | H29 | sing | 1.09Å | 1.10Å | |
C29 | H29A | sing | 1.09Å | 1.10Å | |
C30 | H30 | sing | 1.09Å | 1.10Å | |
C30 | H30A | sing | 1.09Å | 1.10Å | |
C31 | H31 | sing | 1.09Å | 1.10Å | |
C32 | H32 | sing | 1.09Å | 1.10Å | |
C32 | H32A | sing | 1.09Å | 1.10Å | |
C33 | H33 | sing | 1.08Å | 1.08Å | |
C34 | H34 | sing | 1.08Å | 1.08Å | |
C35 | H35 | sing | 1.08Å | 1.08Å | |
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) |
C1 | O1 | C2 | 122.0° | 117.0° |
O1 | C1 | H1 | 109.5° | 109.5° |
O1 | C1 | H1A | 109.5° | 109.5° |
O1 | C1 | H1B | 109.4° | 109.5° |
O1 | C2 | C3 | 121.5° | 120.1° |
O1 | C2 | C7 | 120.0° | 120.0° |
C3 | C2 | C7 | 118.5° | 119.9° |
C2 | C3 | C4 | 120.3° | 120.0° |
C2 | C3 | H3 | 119.9° | 120.0° |
C2 | C7 | C6 | 120.4° | 119.9° |
C2 | C7 | H7 | 119.8° | 120.0° |
C3 | C4 | C5 | 122.1° | 120.1° |
C4 | C3 | H3 | 119.8° | 120.0° |
C3 | C4 | H4 | 118.9° | 120.0° |
C4 | C5 | C6 | 117.2° | 120.0° |
C4 | C5 | S8 | 120.6° | 120.0° |
C5 | C4 | H4 | 119.0° | 119.9° |
C6 | C5 | S8 | 122.2° | 120.0° |
C5 | C6 | C7 | 121.4° | 120.1° |
C5 | C6 | H6 | 119.3° | 119.9° |
C5 | S8 | O9 | 109.7° | 106.4° |
C5 | S8 | O10 | 111.3° | 106.4° |
C5 | S8 | N11 | 111.1° | 107.2° |
C7 | C6 | H6 | 119.3° | 120.0° |
C6 | C7 | H7 | 119.8° | 120.0° |
O9 | S8 | O10 | 110.9° | 123.2° |
O9 | S8 | N11 | 108.9° | 106.4° |
O10 | S8 | N11 | 104.8° | 106.5° |
S8 | N11 | C12 | 111.8° | 120.0° |
S8 | N11 | C16 | 113.3° | 119.9° |
C12 | N11 | C16 | 112.9° | 120.0° |
N11 | C12 | C13 | 111.5° | 109.5° |
N11 | C12 | H12 | 108.8° | 109.5° |
N11 | C12 | H12A | 108.8° | 109.5° |
N11 | C16 | C17 | 109.0° | 109.5° |
N11 | C16 | H16 | 109.6° | 109.5° |
N11 | C16 | H16A | 109.6° | 109.5° |
C12 | C13 | C14 | 113.5° | 109.5° |
C12 | C13 | C15 | 109.2° | 109.5° |
C13 | C12 | H12 | 108.8° | 109.5° |
C13 | C12 | H12A | 108.8° | 109.5° |
C12 | C13 | H13 | 107.8° | 109.5° |
C14 | C13 | C15 | 112.0° | 109.4° |
C14 | C13 | H13 | 104.7° | 109.5° |
C13 | C14 | H14 | 109.5° | 109.5° |
C13 | C14 | H14A | 109.4° | 109.5° |
C13 | C14 | H14B | 109.5° | 109.5° |
C13 | C15 | C18 | 114.3° | 109.5° |
C15 | C13 | H13 | 109.4° | 109.5° |
C13 | C15 | H15 | 107.9° | 109.5° |
C13 | C15 | H15A | 107.9° | 109.4° |
C18 | C15 | H15 | 107.9° | 109.5° |
C18 | C15 | H15A | 107.9° | 109.4° |
C15 | C18 | H18 | 109.5° | 109.5° |
C15 | C18 | H18A | 109.4° | 109.5° |
C15 | C18 | H18B | 109.5° | 109.4° |
C16 | C17 | O18 | 110.2° | 109.5° |
C16 | C17 | C19 | 114.4° | 109.5° |
C17 | C16 | H16 | 109.7° | 109.4° |
C17 | C16 | H16A | 109.6° | 109.5° |
C16 | C17 | H17 | 105.2° | 109.5° |
O18 | C17 | C19 | 108.7° | 109.5° |
O18 | C17 | H17 | 111.4° | 109.5° |
C17 | O18 | HO18 | 109.5° | 114.0° |
C17 | C19 | N20 | 106.2° | 109.5° |
C17 | C19 | C32 | 115.4° | 109.4° |
C19 | C17 | H17 | 106.9° | 109.4° |
C17 | C19 | H19 | 107.8° | 109.4° |
N20 | C19 | C32 | 109.5° | 109.5° |
C19 | N20 | C21 | 125.5° | 120.0° |
N20 | C19 | H19 | 113.9° | 109.5° |
C19 | N20 | HN20 | 117.2° | 120.0° |
C19 | C32 | C38 | 108.6° | 109.5° |
C32 | C19 | H19 | 104.3° | 109.5° |
C19 | C32 | H32 | 109.8° | 109.5° |
C19 | C32 | H32A | 109.8° | 109.5° |
N20 | C21 | O22 | 128.1° | 120.0° |
N20 | C21 | O23 | 111.6° | 120.0° |
C21 | N20 | HN20 | 117.3° | 120.0° |
O22 | C21 | O23 | 120.3° | 120.0° |
C21 | O23 | C24 | 118.6° | 117.0° |
O23 | C24 | C25 | 104.3° | 110.3° |
O23 | C24 | C31 | 111.3° | 110.3° |
O23 | C24 | H24 | 109.9° | 110.4° |
C25 | C24 | C31 | 103.7° | 104.8° |
C24 | C25 | O26 | 104.0° | 107.4° |
C25 | C24 | H24 | 116.8° | 110.4° |
C24 | C25 | H25 | 111.3° | 109.8° |
C24 | C25 | H25A | 111.4° | 109.9° |
C24 | C31 | C27 | 103.2° | 102.7° |
C24 | C31 | C30 | 117.2° | 108.9° |
C31 | C24 | H24 | 110.5° | 110.5° |
C24 | C31 | H31 | 107.3° | 113.8° |
C25 | O26 | C27 | 108.7° | 108.0° |
O26 | C25 | H25 | 111.3° | 109.8° |
O26 | C25 | H25A | 111.3° | 109.9° |
O26 | C27 | O28 | 111.5° | 108.7° |
O26 | C27 | C31 | 108.1° | 104.0° |
O26 | C27 | H27 | 108.4° | 112.6° |
O28 | C27 | C31 | 107.3° | 105.1° |
C27 | O28 | C29 | 111.1° | 110.4° |
O28 | C27 | H27 | 109.1° | 112.6° |
C27 | C31 | C30 | 104.9° | 101.2° |
C31 | C27 | H27 | 112.5° | 113.3° |
C27 | C31 | H31 | 119.2° | 114.2° |
O28 | C29 | C30 | 105.6° | 107.7° |
O28 | C29 | H29 | 110.8° | 109.9° |
O28 | C29 | H29A | 110.8° | 109.8° |
C29 | C30 | C31 | 104.2° | 102.6° |
C30 | C29 | H29 | 110.8° | 109.8° |
C30 | C29 | H29A | 110.8° | 109.8° |
C29 | C30 | H30 | 111.3° | 110.8° |
C29 | C30 | H30A | 111.2° | 110.8° |
C31 | C30 | H30 | 111.3° | 110.8° |
C31 | C30 | H30A | 111.3° | 110.8° |
C30 | C31 | H31 | 105.7° | 114.7° |
C32 | C38 | C33 | 120.3° | 120.0° |
C32 | C38 | C37 | 120.7° | 120.0° |
C38 | C32 | H32 | 109.8° | 109.4° |
C38 | C32 | H32A | 109.8° | 109.5° |
C34 | C33 | C38 | 120.6° | 120.0° |
C33 | C34 | C35 | 120.1° | 120.0° |
C34 | C33 | H33 | 119.7° | 120.0° |
C33 | C34 | H34 | 120.0° | 120.0° |
C33 | C38 | C37 | 119.0° | 120.0° |
C38 | C33 | H33 | 119.7° | 120.0° |
C34 | C35 | C36 | 119.9° | 120.0° |
C35 | C34 | H34 | 120.0° | 120.0° |
C34 | C35 | H35 | 120.0° | 120.0° |
C35 | C36 | C37 | 119.9° | 120.0° |
C36 | C35 | H35 | 120.0° | 120.0° |
C35 | C36 | H36 | 120.0° | 120.0° |
C36 | C37 | C38 | 120.5° | 120.0° |
C37 | C36 | H36 | 120.1° | 120.0° |
C36 | C37 | H37 | 119.7° | 120.0° |
C38 | C37 | H37 | 119.8° | 120.0° |
H1 | C1 | H1A | 109.4° | 109.4° |
H1 | C1 | H1B | 109.5° | 109.5° |
H1A | C1 | H1B | 109.5° | 109.4° |
H12 | C12 | H12A | 110.1° | 109.4° |
H14 | C14 | H14A | 109.5° | 109.5° |
H14 | C14 | H14B | 109.5° | 109.4° |
H14A | C14 | H14B | 109.5° | 109.4° |
H15 | C15 | H15A | 111.0° | 109.5° |
H16 | C16 | H16A | 109.3° | 109.4° |
H18 | C18 | H18A | 109.5° | 109.5° |
H18 | C18 | H18B | 109.4° | 109.4° |
H18A | C18 | H18B | 109.5° | 109.5° |
H25 | C25 | H25A | 107.5° | 110.0° |
H29 | C29 | H29A | 108.1° | 109.8° |
H30 | C30 | H30A | 107.6° | 110.9° |
H32 | C32 | H32A | 109.1° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C1 | O1 | C2 | C3 | 7.7° | 180.0° |
C1 | O1 | C2 | C7 | 171.4° | 0.3° |
O1 | C1 | H1 | H1A | 120.0° | 120.0° |
O1 | C1 | H1 | H1B | 120.0° | 120.0° |
O1 | C1 | H1A | H1B | 120.0° | 120.0° |
O1 | C2 | C3 | C7 | 179.1° | 179.8° |
O1 | C2 | C3 | C4 | 179.4° | 180.0° |
O1 | C2 | C7 | C6 | 179.9° | 179.7° |
C2 | O1 | C1 | H1 | 180.0° | 60.0° |
C2 | O1 | C1 | H1A | 60.0° | 60.0° |
C2 | O1 | C1 | H1B | 60.0° | 180.0° |
O1 | C2 | C3 | H3 | 0.6° | 0.0° |
O1 | C2 | C7 | H7 | 0.1° | 0.0° |
C2 | C3 | C4 | H3 | 180.0° | 180.0° |
C2 | C3 | C4 | C5 | 0.0° | 0.0° |
C3 | C2 | C7 | C6 | 1.0° | 0.6° |
C2 | C3 | C4 | H4 | 180.0° | 180.0° |
C3 | C2 | C7 | H7 | 179.1° | 179.7° |
C7 | C2 | C3 | C4 | 0.3° | 0.3° |
C2 | C7 | C6 | C5 | 1.4° | 0.6° |
C2 | C7 | C6 | H7 | 180.0° | 179.7° |
C7 | C2 | C3 | H3 | 179.7° | 179.8° |
C2 | C7 | C6 | H6 | 178.5° | 179.7° |
C3 | C4 | C5 | H4 | 180.0° | 180.0° |
C3 | C4 | C5 | C6 | 0.5° | 0.0° |
C3 | C4 | C5 | S8 | 178.7° | 180.0° |
C4 | C5 | C6 | S8 | 179.1° | 180.0° |
C4 | C5 | C6 | C7 | 1.2° | 0.4° |
C4 | C5 | S8 | O9 | 151.2° | 156.5° |
C4 | C5 | S8 | O10 | 28.2° | 23.6° |
C4 | C5 | S8 | N11 | 88.2° | 90.0° |
C5 | C4 | C3 | H3 | 180.0° | 180.0° |
C4 | C5 | C6 | H6 | 178.8° | 180.0° |
C5 | C6 | C7 | H6 | 180.0° | 179.7° |
C6 | C5 | S8 | O9 | 29.7° | 23.5° |
C6 | C5 | S8 | O10 | 152.7° | 156.4° |
C6 | C5 | S8 | N11 | 90.9° | 90.0° |
C6 | C5 | C4 | H4 | 179.6° | 179.9° |
C5 | C6 | C7 | H7 | 178.6° | 179.7° |
S8 | C5 | C6 | C7 | 177.9° | 179.7° |
C5 | S8 | O9 | O10 | 123.3° | 122.9° |
C5 | S8 | O9 | N11 | 121.9° | 114.1° |
C5 | S8 | O10 | N11 | 120.2° | 114.1° |
C5 | S8 | N11 | C12 | 47.6° | 90.0° |
C5 | S8 | N11 | C16 | 81.4° | 90.0° |
S8 | C5 | C4 | H4 | 1.3° | 0.0° |
S8 | C5 | C6 | H6 | 2.1° | 0.0° |
O9 | S8 | O10 | N11 | 117.4° | 123.0° |
O9 | S8 | N11 | C12 | 168.6° | 23.5° |
O9 | S8 | N11 | C16 | 39.7° | 156.5° |
O10 | S8 | N11 | C12 | 72.7° | 156.5° |
O10 | S8 | N11 | C16 | 158.3° | 23.6° |
S8 | N11 | C12 | C16 | 129.2° | 180.0° |
S8 | N11 | C12 | C13 | 150.9° | 93.3° |
S8 | N11 | C16 | C17 | 119.7° | 94.1° |
S8 | N11 | C12 | H12 | 30.9° | 146.6° |
S8 | N11 | C12 | H12A | 89.1° | 26.6° |
S8 | N11 | C16 | H16 | 120.3° | 145.9° |
S8 | N11 | C16 | H16A | 0.3° | 26.0° |
N11 | C12 | C13 | H12 | 120.0° | 120.0° |
N11 | C12 | C13 | H12A | 120.0° | 120.0° |
N11 | C12 | C13 | C14 | 58.5° | 65.3° |
N11 | C12 | C13 | C15 | 175.7° | 174.7° |
C12 | N11 | C16 | C17 | 111.9° | 85.8° |
N11 | C12 | H12 | H12A | 119.1° | 120.0° |
N11 | C12 | C13 | H13 | 57.0° | 54.7° |
C12 | N11 | C16 | H16 | 8.1° | 34.1° |
C12 | N11 | C16 | H16A | 128.1° | 154.1° |
C16 | N11 | C12 | C13 | 79.9° | 86.7° |
N11 | C16 | C17 | H16 | 120.0° | 120.0° |
N11 | C16 | C17 | H16A | 120.0° | 120.1° |
N11 | C16 | C17 | O18 | 169.5° | 65.0° |
N11 | C16 | C17 | C19 | 67.7° | 175.0° |
C16 | N11 | C12 | H12 | 160.1° | 33.3° |
C16 | N11 | C12 | H12A | 40.1° | 153.3° |
N11 | C16 | H16 | H16A | 120.2° | 120.0° |
N11 | C16 | C17 | H17 | 49.3° | 55.1° |
C12 | C13 | C14 | C15 | 124.3° | 120.0° |
C12 | C13 | C14 | H13 | 117.3° | 120.0° |
C12 | C13 | C15 | H13 | 117.7° | 120.0° |
C12 | C13 | C15 | C18 | 61.9° | 175.0° |
C13 | C12 | H12 | H12A | 119.2° | 120.0° |
C12 | C13 | C14 | H14 | 180.0° | 53.0° |
C12 | C13 | C14 | H14A | 60.0° | 173.1° |
C12 | C13 | C14 | H14B | 60.0° | 67.0° |
C12 | C13 | C15 | H15 | 58.1° | 65.0° |
C12 | C13 | C15 | H15A | 178.1° | 55.0° |
C14 | C13 | C15 | H13 | 115.7° | 120.0° |
C14 | C13 | C15 | C18 | 64.7° | 65.0° |
C14 | C13 | C12 | H12 | 61.5° | 54.7° |
C14 | C13 | C12 | H12A | 178.5° | 174.7° |
C13 | C14 | H14 | H14A | 120.0° | 120.1° |
C13 | C14 | H14 | H14B | 120.0° | 120.0° |
C13 | C14 | H14A | H14B | 120.0° | 120.0° |
C14 | C13 | C15 | H15 | 175.3° | 55.0° |
C14 | C13 | C15 | H15A | 55.3° | 175.0° |
C13 | C15 | C18 | H15 | 120.0° | 120.0° |
C13 | C15 | C18 | H15A | 120.0° | 119.9° |
C15 | C13 | C12 | H12 | 64.3° | 65.3° |
C15 | C13 | C12 | H12A | 55.8° | 54.7° |
C15 | C13 | C14 | H14 | 55.7° | 67.0° |
C15 | C13 | C14 | H14A | 175.7° | 53.1° |
C15 | C13 | C14 | H14B | 64.3° | 173.0° |
C13 | C15 | H15 | H15A | 118.0° | 120.0° |
C13 | C15 | C18 | H18 | 180.0° | 180.0° |
C13 | C15 | C18 | H18A | 60.0° | 60.0° |
C13 | C15 | C18 | H18B | 60.0° | 60.0° |
C18 | C15 | C13 | H13 | 179.6° | 55.0° |
C18 | C15 | H15 | H15A | 118.0° | 120.0° |
C15 | C18 | H18 | H18A | 120.0° | 120.0° |
C15 | C18 | H18 | H18B | 120.0° | 119.9° |
C15 | C18 | H18A | H18B | 120.0° | 120.0° |
C16 | C17 | O18 | C19 | 126.1° | 120.1° |
C16 | C17 | O18 | H17 | 116.4° | 120.0° |
C16 | C17 | C19 | H17 | 116.1° | 120.0° |
C16 | C17 | C19 | N20 | 165.7° | 175.0° |
C16 | C17 | C19 | C32 | 72.8° | 65.0° |
C17 | C16 | H16 | H16A | 120.2° | 120.0° |
C16 | C17 | O18 | HO18 | 180.0° | 60.0° |
C16 | C17 | C19 | H19 | 43.3° | 54.9° |
O18 | C17 | C19 | H17 | 120.3° | 120.0° |
O18 | C17 | C19 | N20 | 70.7° | 65.0° |
O18 | C17 | C19 | C32 | 50.9° | 55.1° |
O18 | C17 | C16 | H16 | 49.5° | 55.0° |
O18 | C17 | C16 | H16A | 70.5° | 175.0° |
O18 | C17 | C19 | H19 | 167.0° | 175.0° |
C17 | C19 | N20 | C32 | 125.2° | 120.0° |
C17 | C19 | N20 | H19 | 118.4° | 120.0° |
C17 | C19 | C32 | H19 | 118.1° | 119.9° |
C17 | C19 | N20 | C21 | 109.6° | 155.0° |
C17 | C19 | C32 | C38 | 179.4° | 175.0° |
C19 | C17 | C16 | H16 | 172.3° | 65.0° |
C19 | C17 | C16 | H16A | 52.3° | 54.9° |
C19 | C17 | O18 | HO18 | 53.9° | 60.1° |
C17 | C19 | N20 | HN20 | 70.4° | 25.0° |
C17 | C19 | C32 | H32 | 59.4° | 65.0° |
C17 | C19 | C32 | H32A | 60.6° | 55.0° |
N20 | C19 | C32 | H19 | 122.2° | 120.1° |
C19 | N20 | C21 | HN20 | 180.0° | 180.0° |
C19 | N20 | C21 | O22 | 0.2° | 0.0° |
C19 | N20 | C21 | O23 | 179.7° | 180.0° |
N20 | C19 | C32 | C38 | 59.7° | 65.0° |
N20 | C19 | C17 | H17 | 49.6° | 55.0° |
N20 | C19 | C32 | H32 | 60.3° | 55.0° |
N20 | C19 | C32 | H32A | 179.7° | 175.0° |
C32 | C19 | N20 | C21 | 125.2° | 85.0° |
C19 | C32 | C38 | H32 | 120.0° | 120.0° |
C19 | C32 | C38 | H32A | 120.0° | 120.1° |
C19 | C32 | C38 | C33 | 107.9° | 90.0° |
C19 | C32 | C38 | C37 | 71.6° | 90.0° |
C32 | C19 | C17 | H17 | 171.2° | 175.0° |
C32 | C19 | N20 | HN20 | 54.8° | 95.0° |
C19 | C32 | H32 | H32A | 120.4° | 120.1° |
N20 | C21 | O22 | O23 | 179.5° | 180.0° |
N20 | C21 | O23 | C24 | 170.6° | 180.0° |
C21 | N20 | C19 | H19 | 8.9° | 35.0° |
O22 | C21 | O23 | C24 | 8.9° | 0.0° |
O22 | C21 | N20 | HN20 | 179.8° | 180.0° |
C21 | O23 | C24 | C25 | 143.1° | 91.5° |
C21 | O23 | C24 | C31 | 105.7° | 153.2° |
O23 | C21 | N20 | HN20 | 0.3° | 0.0° |
C21 | O23 | C24 | H24 | 17.0° | 30.8° |
O23 | C24 | C25 | C31 | 116.6° | 118.8° |
O23 | C24 | C25 | H24 | 121.6° | 122.3° |
O23 | C24 | C31 | H24 | 122.4° | 122.3° |
O23 | C24 | C25 | O26 | 81.1° | 115.4° |
O23 | C24 | C31 | C27 | 84.1° | 136.5° |
O23 | C24 | C31 | C30 | 30.6° | 29.8° |
O23 | C24 | C25 | H25 | 158.9° | 125.2° |
O23 | C24 | C25 | H25A | 38.9° | 4.1° |
O23 | C24 | C31 | H31 | 149.2° | 99.5° |
C25 | C24 | C31 | H24 | 126.0° | 118.9° |
C24 | C25 | O26 | H25 | 120.0° | 119.4° |
C24 | C25 | O26 | H25A | 120.0° | 119.5° |
C24 | C25 | O26 | C27 | 29.9° | 25.6° |
C25 | C24 | C31 | C27 | 27.5° | 17.8° |
C25 | C24 | C31 | C30 | 142.2° | 89.0° |
C24 | C25 | H25 | H25A | 122.2° | 121.1° |
C25 | C24 | C31 | H31 | 99.2° | 141.7° |
C31 | C24 | C25 | O26 | 35.5° | 3.4° |
C24 | C31 | C27 | O26 | 10.3° | 33.1° |
C24 | C31 | C27 | O28 | 110.1° | 147.3° |
C24 | C31 | C27 | C30 | 123.3° | 112.5° |
C24 | C31 | C27 | H31 | 118.8° | 123.7° |
C24 | C31 | C30 | C29 | 89.9° | 140.9° |
C24 | C31 | C30 | H31 | 119.5° | 128.8° |
C31 | C24 | C25 | H25 | 84.5° | 116.0° |
C31 | C24 | C25 | H25A | 155.5° | 122.9° |
C24 | C31 | C27 | H27 | 129.9° | 89.4° |
C24 | C31 | C30 | H30 | 150.2° | 100.9° |
C24 | C31 | C30 | H30A | 30.1° | 22.6° |
C25 | O26 | C27 | O28 | 130.0° | 148.5° |
C25 | O26 | C27 | C31 | 12.3° | 37.0° |
O26 | C25 | C24 | H24 | 157.4° | 122.3° |
O26 | C25 | H25 | H25A | 122.2° | 121.1° |
C25 | O26 | C27 | H27 | 109.8° | 86.0° |
O26 | C27 | O28 | C31 | 118.1° | 110.8° |
O26 | C27 | O28 | H27 | 119.7° | 125.4° |
O26 | C27 | C31 | H27 | 119.6° | 122.5° |
O26 | C27 | O28 | C29 | 114.5° | 88.1° |
O26 | C27 | C31 | C30 | 133.5° | 79.4° |
C27 | O26 | C25 | H25 | 90.1° | 93.8° |
C27 | O26 | C25 | H25A | 149.9° | 145.1° |
O26 | C27 | C31 | H31 | 108.5° | 156.8° |
O28 | C27 | C31 | H27 | 120.0° | 123.3° |
C27 | O28 | C29 | C30 | 19.0° | 0.9° |
O28 | C27 | C31 | C30 | 13.2° | 34.8° |
C27 | O28 | C29 | H29 | 138.9° | 120.4° |
C27 | O28 | C29 | H29A | 101.0° | 118.7° |
O28 | C27 | C31 | H31 | 131.2° | 89.0° |
C31 | C27 | O28 | C29 | 3.6° | 22.8° |
C27 | C31 | C30 | C29 | 23.9° | 33.1° |
C27 | C31 | C30 | H31 | 126.8° | 123.4° |
C27 | C31 | C24 | H24 | 153.5° | 101.2° |
C27 | C31 | C30 | H30 | 96.1° | 151.4° |
C27 | C31 | C30 | H30A | 143.8° | 85.2° |
O28 | C29 | C30 | H29 | 120.0° | 119.6° |
O28 | C29 | C30 | H29A | 120.0° | 119.5° |
O28 | C29 | C30 | C31 | 26.2° | 21.3° |
C29 | O28 | C27 | H27 | 125.8° | 146.5° |
O28 | C29 | H29 | H29A | 121.6° | 120.9° |
O28 | C29 | C30 | H30 | 93.8° | 139.6° |
O28 | C29 | C30 | H30A | 146.3° | 96.9° |
C29 | C30 | C31 | H30 | 120.0° | 118.3° |
C29 | C30 | C31 | H30A | 120.0° | 118.3° |
C30 | C29 | H29 | H29A | 121.6° | 120.8° |
C29 | C30 | H30 | H30A | 122.1° | 123.5° |
C29 | C30 | C31 | H31 | 150.7° | 90.3° |
C30 | C31 | C24 | H24 | 91.8° | 152.1° |
C30 | C31 | C27 | H27 | 106.8° | 158.1° |
C31 | C30 | C29 | H29 | 146.2° | 98.3° |
C31 | C30 | C29 | H29A | 93.8° | 140.9° |
C31 | C30 | H30 | H30A | 122.2° | 123.4° |
C32 | C38 | C33 | C34 | 179.1° | 179.9° |
C32 | C38 | C33 | C37 | 179.5° | 180.0° |
C32 | C38 | C37 | C36 | 178.4° | 180.0° |
C38 | C32 | C19 | H19 | 62.6° | 55.1° |
C38 | C32 | H32 | H32A | 120.4° | 120.0° |
C32 | C38 | C33 | H33 | 0.9° | 0.2° |
C32 | C38 | C37 | H37 | 1.6° | 0.1° |
C34 | C33 | C38 | H33 | 180.0° | 179.8° |
C33 | C34 | C35 | H34 | 180.0° | 180.0° |
C33 | C34 | C35 | C36 | 0.5° | 0.0° |
C34 | C33 | C38 | C37 | 0.4° | 0.1° |
C33 | C34 | C35 | H35 | 179.6° | 180.0° |
C38 | C33 | C34 | C35 | 0.1° | 0.1° |
C33 | C38 | C37 | C36 | 1.1° | 0.0° |
C33 | C38 | C32 | H32 | 12.1° | 30.0° |
C33 | C38 | C32 | H32A | 132.1° | 149.9° |
C38 | C33 | C34 | H34 | 179.9° | 179.9° |
C33 | C38 | C37 | H37 | 179.0° | 179.9° |
C34 | C35 | C36 | H35 | 180.0° | 180.0° |
C34 | C35 | C36 | C37 | 1.1° | 0.1° |
C35 | C34 | C33 | H33 | 179.9° | 179.8° |
C34 | C35 | C36 | H36 | 178.8° | 179.9° |
C35 | C36 | C37 | H36 | 180.0° | 179.9° |
C35 | C36 | C37 | C38 | 1.5° | 0.1° |
C36 | C35 | C34 | H34 | 179.6° | 180.0° |
C35 | C36 | C37 | H37 | 178.6° | 180.0° |
C36 | C37 | C38 | H37 | 180.0° | 179.9° |
C37 | C36 | C35 | H35 | 178.9° | 179.9° |
C37 | C38 | C32 | H32 | 168.4° | 150.0° |
C37 | C38 | C32 | H32A | 48.4° | 30.1° |
C37 | C38 | C33 | H33 | 179.6° | 179.8° |
C38 | C37 | C36 | H36 | 178.5° | 179.9° |
H1 | C1 | H1A | H1B | 120.0° | 119.9° |
H3 | C3 | C4 | H4 | 0.0° | 0.0° |
H6 | C6 | C7 | H7 | 1.5° | 0.0° |
H12 | C12 | C13 | H13 | 177.0° | 174.7° |
H12A | C12 | C13 | H13 | 63.0° | 65.3° |
H13 | C13 | C14 | H14 | 62.7° | 173.0° |
H13 | C13 | C14 | H14A | 57.3° | 66.9° |
H13 | C13 | C14 | H14B | 177.2° | 53.0° |
H13 | C13 | C15 | H15 | 59.6° | 175.0° |
H13 | C13 | C15 | H15A | 60.4° | 65.0° |
H14 | C14 | H14A | H14B | 120.0° | 119.9° |
H15 | C15 | C18 | H18 | 60.0° | 59.9° |
H15 | C15 | C18 | H18A | 180.0° | 180.0° |
H15 | C15 | C18 | H18B | 60.0° | 60.0° |
H15A | C15 | C18 | H18 | 60.0° | 60.1° |
H15A | C15 | C18 | H18A | 60.0° | 59.9° |
H15A | C15 | C18 | H18B | 180.0° | 179.9° |
H16 | C16 | C17 | H17 | 70.7° | 175.1° |
H16A | C16 | C17 | H17 | 169.3° | 65.0° |
H17 | C17 | O18 | HO18 | 63.6° | 180.0° |
H17 | C17 | C19 | H19 | 72.7° | 65.0° |
H18 | C18 | H18A | H18B | 120.0° | 120.0° |
H19 | C19 | N20 | HN20 | 171.1° | 145.0° |
H19 | C19 | C32 | H32 | 177.4° | 175.0° |
H19 | C19 | C32 | H32A | 57.5° | 65.0° |
H24 | C24 | C25 | H25 | 37.4° | 3.0° |
H24 | C24 | C25 | H25A | 82.6° | 118.1° |
H24 | C24 | C31 | H31 | 26.8° | 22.8° |
H27 | C27 | C31 | H31 | 11.1° | 34.3° |
H29 | C29 | C30 | H30 | 26.2° | 20.0° |
H29 | C29 | C30 | H30A | 93.7° | 143.5° |
H29A | C29 | C30 | H30 | 146.2° | 100.9° |
H29A | C29 | C30 | H30A | 26.2° | 22.6° |
H30 | C30 | C31 | H31 | 30.7° | 28.0° |
H30A | C30 | C31 | H31 | 89.4° | 151.4° |
H33 | C33 | C34 | H34 | 0.1° | 0.2° |
H34 | C34 | C35 | H35 | 0.4° | 0.0° |
H35 | C35 | C36 | H36 | 1.1° | 0.1° |
H36 | C36 | C37 | H37 | 1.4° | 0.1° |