5W6
Bonds
First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
C20 | C19 | sing | 1.51Å | 1.51Å | |
C18 | O17 | sing | 1.43Å | 1.43Å | |
C4 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
C4 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
C3 | C2 | sing | 1.40Å | 1.39Å | Aromatic |
C19 | N21 | sing | 1.33Å | 1.35Å | Aromatic |
C19 | C1 | doub | 1.38Å | 1.48Å | Aromatic |
O17 | C5 | sing | 1.36Å | 1.37Å | |
C5 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
C2 | C1 | sing | 1.48Å | 1.49Å | |
C2 | C7 | doub | 1.40Å | 1.39Å | Aromatic |
N21 | C23 | doub | 1.33Å | 1.36Å | Aromatic |
C1 | N22 | sing | 1.37Å | 1.33Å | Aromatic |
C6 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
C6 | S8 | sing | 1.76Å | 1.60Å | |
O10 | S8 | doub | 1.42Å | 1.44Å | |
C23 | N22 | sing | 1.37Å | 1.34Å | Aromatic |
C23 | C27 | sing | 1.41Å | 1.49Å | Aromatic |
N22 | N24 | sing | 1.40Å | 1.40Å | Aromatic |
S8 | O9 | doub | 1.42Å | 1.43Å | |
S8 | N11 | sing | 1.66Å | 1.61Å | |
C12 | N11 | sing | 1.47Å | 1.47Å | |
C12 | C13 | sing | 1.53Å | 1.52Å | |
C27 | N29 | sing | 1.39Å | 1.35Å | |
C27 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
N29 | C30 | sing | 1.46Å | 1.45Å | |
N24 | C25 | doub | 1.31Å | 1.35Å | Aromatic |
N11 | C14 | sing | 1.47Å | 1.47Å | |
C34 | C33 | sing | 1.51Å | 1.50Å | |
C14 | C8 | sing | 1.53Å | 1.53Å | |
C31 | C30 | sing | 1.53Å | 1.52Å | |
C31 | N32 | sing | 1.46Å | 1.45Å | |
C13 | C9 | sing | 1.53Å | 1.53Å | |
C10 | C9 | sing | 1.53Å | 1.52Å | |
C10 | O11 | sing | 1.43Å | 1.43Å | |
C25 | C26 | sing | 1.40Å | 1.39Å | Aromatic |
C25 | CL1 | sing | 1.74Å | 1.79Å | |
C9 | C8 | sing | 1.53Å | 1.53Å | |
C33 | N32 | sing | 1.35Å | 1.33Å | |
C33 | O35 | doub | 1.21Å | 1.22Å | |
C3 | H1 | sing | 1.08Å | 1.08Å | |
C4 | H2 | sing | 1.08Å | 1.08Å | |
C7 | H3 | sing | 1.08Å | 1.08Å | |
C8 | H4 | sing | 1.09Å | 1.10Å | |
C8 | H5 | sing | 1.09Å | 1.10Å | |
C9 | H6 | sing | 1.09Å | 1.10Å | |
C10 | H7 | sing | 1.09Å | 1.10Å | |
C10 | H8 | sing | 1.09Å | 1.10Å | |
C12 | H9 | sing | 1.09Å | 1.10Å | |
C12 | H10 | sing | 1.09Å | 1.10Å | |
C13 | H11 | sing | 1.09Å | 1.10Å | |
C13 | H12 | sing | 1.09Å | 1.10Å | |
C14 | H13 | sing | 1.09Å | 1.10Å | |
C14 | H14 | sing | 1.09Å | 1.10Å | |
C18 | H15 | sing | 1.09Å | 1.10Å | |
C18 | H16 | sing | 1.09Å | 1.10Å | |
C18 | H17 | sing | 1.09Å | 1.10Å | |
C20 | H18 | sing | 1.09Å | 1.10Å | |
C20 | H19 | sing | 1.09Å | 1.10Å | |
C20 | H20 | sing | 1.09Å | 1.10Å | |
C26 | H21 | sing | 1.08Å | 1.08Å | |
N29 | H22 | sing | 0.97Å | 1.00Å | |
C30 | H23 | sing | 1.09Å | 1.10Å | |
C30 | H24 | sing | 1.09Å | 1.10Å | |
C31 | H25 | sing | 1.09Å | 1.10Å | |
C31 | H26 | sing | 1.09Å | 1.10Å | |
N32 | H27 | sing | 0.97Å | 1.00Å | |
C34 | H28 | sing | 1.09Å | 1.10Å | |
C34 | H29 | sing | 1.09Å | 1.10Å | |
C34 | H30 | sing | 1.09Å | 1.10Å | |
O11 | H31 | sing | 0.97Å | 0.95Å |
Angles
First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
C20 | C19 | N21 | 127.6° | 125.8° |
C20 | C19 | C1 | 127.8° | 125.9° |
C19 | C20 | H18 | 109.5° | 109.4° |
C19 | C20 | H19 | 109.5° | 109.4° |
C19 | C20 | H20 | 109.5° | 109.5° |
C18 | O17 | C5 | 120.1° | 117.1° |
O17 | C18 | H15 | 109.5° | 109.4° |
O17 | C18 | H16 | 109.5° | 109.5° |
O17 | C18 | H17 | 109.5° | 109.5° |
C3 | C4 | C5 | 120.4° | 120.1° |
C4 | C3 | C2 | 119.9° | 119.9° |
C4 | C3 | H1 | 120.0° | 120.1° |
C3 | C4 | H2 | 119.8° | 119.9° |
C4 | C5 | O17 | 118.9° | 119.9° |
C4 | C5 | C6 | 119.9° | 120.2° |
C5 | C4 | H2 | 119.8° | 120.0° |
C3 | C2 | C1 | 119.4° | 120.1° |
C3 | C2 | C7 | 119.5° | 119.8° |
C2 | C3 | H1 | 120.1° | 120.0° |
N21 | C19 | C1 | 104.6° | 108.2° |
C19 | N21 | C23 | 109.1° | 109.5° |
C19 | C1 | C2 | 133.7° | 126.6° |
C19 | C1 | N22 | 107.1° | 106.7° |
O17 | C5 | C6 | 121.2° | 119.9° |
C5 | C6 | C7 | 119.5° | 120.1° |
C5 | C6 | S8 | 121.8° | 119.9° |
C1 | C2 | C7 | 121.1° | 120.1° |
C2 | C1 | N22 | 119.2° | 126.7° |
C2 | C7 | C6 | 120.7° | 119.9° |
C2 | C7 | H3 | 119.6° | 120.0° |
N21 | C23 | N22 | 110.1° | 108.5° |
N21 | C23 | C27 | 132.5° | 132.4° |
C1 | N22 | C23 | 109.1° | 107.1° |
C1 | N22 | N24 | 127.7° | 132.7° |
C7 | C6 | S8 | 118.7° | 119.9° |
C6 | C7 | H3 | 119.6° | 120.1° |
C6 | S8 | O10 | 110.4° | 106.4° |
C6 | S8 | O9 | 108.6° | 106.4° |
C6 | S8 | N11 | 111.7° | 107.2° |
O10 | S8 | O9 | 108.5° | 123.2° |
O10 | S8 | N11 | 109.2° | 106.4° |
N22 | C23 | C27 | 117.4° | 119.1° |
C23 | N22 | N24 | 123.1° | 120.2° |
C23 | C27 | N29 | 120.9° | 120.6° |
C23 | C27 | C26 | 118.5° | 118.9° |
N22 | N24 | C25 | 119.8° | 121.0° |
O9 | S8 | N11 | 108.2° | 106.4° |
S8 | N11 | C12 | 110.8° | 120.6° |
S8 | N11 | C14 | 111.2° | 120.7° |
N11 | C12 | C13 | 108.5° | 108.8° |
C12 | N11 | C14 | 109.0° | 118.7° |
N11 | C12 | H9 | 109.7° | 109.6° |
N11 | C12 | H10 | 109.7° | 109.5° |
C12 | C13 | C9 | 111.4° | 109.3° |
C13 | C12 | H9 | 109.7° | 109.6° |
C13 | C12 | H10 | 109.7° | 109.6° |
C12 | C13 | H11 | 109.0° | 109.5° |
C12 | C13 | H12 | 109.0° | 109.6° |
N29 | C27 | C26 | 120.6° | 120.5° |
C27 | N29 | C30 | 120.0° | 120.0° |
C27 | N29 | H22 | 106.8° | 119.9° |
C27 | C26 | C25 | 120.4° | 119.9° |
C27 | C26 | H21 | 119.8° | 120.0° |
N29 | C30 | C31 | 112.8° | 109.5° |
C30 | N29 | H22 | 106.8° | 120.0° |
N29 | C30 | H23 | 108.6° | 109.5° |
N29 | C30 | H24 | 108.6° | 109.5° |
N24 | C25 | C26 | 120.8° | 120.9° |
N24 | C25 | CL1 | 119.8° | 119.5° |
N11 | C14 | C8 | 108.6° | 108.8° |
N11 | C14 | H13 | 109.7° | 109.6° |
N11 | C14 | H14 | 109.7° | 109.7° |
C34 | C33 | N32 | 115.7° | 120.0° |
C34 | C33 | O35 | 122.2° | 120.0° |
C33 | C34 | H28 | 109.5° | 109.5° |
C33 | C34 | H29 | 109.5° | 109.4° |
C33 | C34 | H30 | 109.4° | 109.5° |
C14 | C8 | C9 | 111.8° | 109.3° |
C14 | C8 | H4 | 108.9° | 109.5° |
C14 | C8 | H5 | 108.9° | 109.5° |
C8 | C14 | H13 | 109.7° | 109.6° |
C8 | C14 | H14 | 109.7° | 109.6° |
C30 | C31 | N32 | 111.4° | 109.5° |
C31 | C30 | H23 | 108.6° | 109.4° |
C31 | C30 | H24 | 108.6° | 109.5° |
C30 | C31 | H25 | 109.0° | 109.4° |
C30 | C31 | H26 | 109.0° | 109.5° |
C31 | N32 | C33 | 122.0° | 120.0° |
N32 | C31 | H25 | 109.0° | 109.5° |
N32 | C31 | H26 | 109.0° | 109.5° |
C31 | N32 | H27 | 119.0° | 120.0° |
C13 | C9 | C10 | 109.9° | 109.5° |
C13 | C9 | C8 | 110.5° | 109.5° |
C13 | C9 | H6 | 108.8° | 109.5° |
C9 | C13 | H11 | 109.0° | 109.4° |
C9 | C13 | H12 | 109.0° | 109.5° |
C9 | C10 | O11 | 109.1° | 109.5° |
C10 | C9 | C8 | 110.1° | 109.4° |
C10 | C9 | H6 | 108.8° | 109.5° |
C9 | C10 | H7 | 109.6° | 109.5° |
C9 | C10 | H8 | 109.6° | 109.5° |
O11 | C10 | H7 | 109.5° | 109.5° |
O11 | C10 | H8 | 109.6° | 109.4° |
C10 | O11 | H31 | 109.5° | 114.0° |
C26 | C25 | CL1 | 119.4° | 119.6° |
C25 | C26 | H21 | 119.8° | 120.0° |
C9 | C8 | H4 | 108.9° | 109.5° |
C9 | C8 | H5 | 108.9° | 109.5° |
C8 | C9 | H6 | 108.8° | 109.5° |
N32 | C33 | O35 | 122.1° | 120.0° |
C33 | N32 | H27 | 119.0° | 120.0° |
H4 | C8 | H5 | 109.5° | 109.5° |
H7 | C10 | H8 | 109.5° | 109.4° |
H9 | C12 | H10 | 109.5° | 109.7° |
H11 | C13 | H12 | 109.5° | 109.5° |
H13 | C14 | H14 | 109.5° | 109.5° |
H15 | C18 | H16 | 109.5° | 109.4° |
H15 | C18 | H17 | 109.5° | 109.5° |
H16 | C18 | H17 | 109.4° | 109.5° |
H18 | C20 | H19 | 109.5° | 109.5° |
H18 | C20 | H20 | 109.5° | 109.5° |
H19 | C20 | H20 | 109.4° | 109.5° |
H23 | C30 | H24 | 109.5° | 109.5° |
H25 | C31 | H26 | 109.4° | 109.5° |
H28 | C34 | H29 | 109.4° | 109.5° |
H28 | C34 | H30 | 109.5° | 109.5° |
H29 | C34 | H30 | 109.5° | 109.5° |
Dihedrals
First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
C20 | C19 | N21 | C1 | 179.9° | 180.0° |
C20 | C19 | C1 | C2 | 0.3° | 0.3° |
C20 | C19 | N21 | C23 | 180.0° | 180.0° |
C20 | C19 | C1 | N22 | 179.9° | 180.0° |
C19 | C20 | H18 | H19 | 120.0° | 119.9° |
C19 | C20 | H18 | H20 | 120.0° | 120.0° |
C19 | C20 | H19 | H20 | 120.0° | 120.0° |
C18 | O17 | C5 | C4 | 83.2° | 0.0° |
C18 | O17 | C5 | C6 | 96.5° | 180.0° |
O17 | C18 | H15 | H16 | 120.0° | 120.0° |
O17 | C18 | H15 | H17 | 120.0° | 120.1° |
O17 | C18 | H16 | H17 | 120.0° | 120.1° |
C3 | C4 | C5 | H2 | 180.0° | 179.9° |
C4 | C3 | C2 | H1 | 180.0° | 180.0° |
C3 | C4 | C5 | O17 | 179.9° | 180.0° |
C3 | C4 | C5 | C6 | 0.2° | 0.1° |
C4 | C3 | C2 | C1 | 179.6° | 180.0° |
C4 | C3 | C2 | C7 | 0.7° | 0.3° |
C5 | C4 | C3 | C2 | 0.2° | 0.1° |
C4 | C5 | O17 | C6 | 179.7° | 180.0° |
C4 | C5 | C6 | C7 | 0.1° | 0.3° |
C4 | C5 | C6 | S8 | 179.9° | 180.0° |
C5 | C4 | C3 | H1 | 179.9° | 179.9° |
C3 | C2 | C1 | C19 | 45.3° | 135.6° |
C3 | C2 | C1 | C7 | 178.9° | 179.7° |
C3 | C2 | C1 | N22 | 134.3° | 44.7° |
C3 | C2 | C7 | C6 | 0.8° | 0.6° |
C2 | C3 | C4 | H2 | 179.9° | 180.0° |
C3 | C2 | C7 | H3 | 179.2° | 179.7° |
N21 | C19 | C1 | C2 | 179.8° | 179.8° |
N21 | C19 | C1 | N22 | 0.2° | 0.0° |
C19 | N21 | C23 | N22 | 0.0° | 0.0° |
C19 | N21 | C23 | C27 | 179.9° | 179.9° |
N21 | C19 | C20 | H18 | 0.0° | 90.0° |
N21 | C19 | C20 | H19 | 120.0° | 150.0° |
N21 | C19 | C20 | H20 | 120.0° | 30.1° |
C19 | C1 | C2 | N22 | 179.5° | 179.7° |
C19 | C1 | C2 | C7 | 133.6° | 44.7° |
C1 | C19 | N21 | C23 | 0.1° | 0.0° |
C19 | C1 | N22 | C23 | 0.3° | 0.0° |
C19 | C1 | N22 | N24 | 180.0° | 179.7° |
C1 | C19 | C20 | H18 | 179.9° | 90.0° |
C1 | C19 | C20 | H19 | 59.9° | 30.0° |
C1 | C19 | C20 | H20 | 60.1° | 150.0° |
O17 | C5 | C6 | C7 | 179.8° | 179.7° |
O17 | C5 | C6 | S8 | 0.2° | 0.0° |
O17 | C5 | C4 | H2 | 0.1° | 0.1° |
C5 | O17 | C18 | H15 | 180.0° | 60.0° |
C5 | O17 | C18 | H16 | 60.0° | 59.9° |
C5 | O17 | C18 | H17 | 60.0° | 180.0° |
C5 | C6 | C7 | C2 | 0.4° | 0.6° |
C5 | C6 | C7 | S8 | 180.0° | 179.7° |
C5 | C6 | S8 | O10 | 43.7° | 178.6° |
C5 | C6 | S8 | O9 | 162.5° | 48.5° |
C5 | C6 | S8 | N11 | 78.1° | 65.0° |
C6 | C5 | C4 | H2 | 179.8° | 180.0° |
C5 | C6 | C7 | H3 | 179.6° | 179.7° |
C1 | C2 | C7 | C6 | 179.6° | 179.7° |
C2 | C1 | N22 | C23 | 179.9° | 179.8° |
C2 | C1 | N22 | N24 | 0.4° | 0.0° |
C1 | C2 | C3 | H1 | 0.5° | 0.1° |
C1 | C2 | C7 | H3 | 0.4° | 0.0° |
C7 | C2 | C1 | N22 | 46.9° | 135.0° |
C2 | C7 | C6 | H3 | 180.0° | 179.7° |
C2 | C7 | C6 | S8 | 179.6° | 179.7° |
C7 | C2 | C3 | H1 | 179.4° | 179.8° |
N21 | C23 | N22 | C1 | 0.2° | 0.0° |
N21 | C23 | N22 | C27 | 179.9° | 179.9° |
N21 | C23 | N22 | N24 | 179.9° | 179.8° |
N21 | C23 | C27 | N29 | 0.3° | 0.1° |
N21 | C23 | C27 | C26 | 179.9° | 179.9° |
C1 | N22 | C23 | N24 | 179.8° | 179.8° |
C1 | N22 | C23 | C27 | 179.7° | 179.9° |
C1 | N22 | N24 | C25 | 179.8° | 180.0° |
C7 | C6 | S8 | O10 | 136.3° | 1.8° |
C7 | C6 | S8 | O9 | 17.5° | 131.1° |
C7 | C6 | S8 | N11 | 101.9° | 115.3° |
C6 | S8 | O10 | O9 | 118.9° | 122.9° |
C6 | S8 | O10 | N11 | 123.3° | 114.1° |
C6 | S8 | O9 | N11 | 121.5° | 114.1° |
C6 | S8 | N11 | C12 | 80.2° | 90.0° |
C6 | S8 | N11 | C14 | 41.1° | 89.9° |
S8 | C6 | C7 | H3 | 0.4° | 0.0° |
O10 | S8 | O9 | N11 | 118.5° | 123.0° |
O10 | S8 | N11 | C12 | 42.3° | 156.5° |
O10 | S8 | N11 | C14 | 163.6° | 23.6° |
N22 | C23 | C27 | N29 | 179.8° | 180.0° |
N22 | C23 | C27 | C26 | 0.2° | 0.2° |
C23 | N22 | N24 | C25 | 0.1° | 0.2° |
C27 | C23 | N22 | N24 | 0.0° | 0.1° |
C23 | C27 | N29 | C26 | 179.6° | 179.8° |
C23 | C27 | N29 | C30 | 151.7° | 179.9° |
C23 | C27 | C26 | C25 | 0.3° | 0.4° |
C23 | C27 | C26 | H21 | 179.7° | 179.6° |
C23 | C27 | N29 | H22 | 30.2° | 0.1° |
N22 | N24 | C25 | C26 | 0.0° | 0.0° |
N22 | N24 | C25 | CL1 | 179.9° | 179.7° |
O9 | S8 | N11 | C12 | 160.3° | 23.6° |
O9 | S8 | N11 | C14 | 78.4° | 156.5° |
S8 | N11 | C12 | C14 | 122.7° | 179.9° |
S8 | N11 | C12 | C13 | 170.5° | 126.4° |
S8 | N11 | C14 | C8 | 171.7° | 126.4° |
S8 | N11 | C12 | H9 | 69.6° | 113.8° |
S8 | N11 | C12 | H10 | 50.7° | 6.6° |
S8 | N11 | C14 | H13 | 51.8° | 6.5° |
S8 | N11 | C14 | H14 | 68.5° | 113.7° |
N11 | C12 | C13 | H9 | 119.8° | 119.8° |
N11 | C12 | C13 | H10 | 119.9° | 119.7° |
C12 | N11 | C14 | C8 | 65.9° | 53.5° |
N11 | C12 | C13 | C9 | 58.8° | 54.7° |
N11 | C12 | H9 | H10 | 120.5° | 120.3° |
N11 | C12 | C13 | H11 | 179.1° | 174.6° |
N11 | C12 | C13 | H12 | 61.5° | 65.4° |
C12 | N11 | C14 | H13 | 174.2° | 173.4° |
C12 | N11 | C14 | H14 | 53.9° | 66.4° |
C13 | C12 | N11 | C14 | 66.8° | 53.5° |
C12 | C13 | C9 | H11 | 120.3° | 119.9° |
C12 | C13 | C9 | H12 | 120.3° | 120.0° |
C12 | C13 | C9 | C10 | 71.4° | 178.6° |
C12 | C13 | C9 | C8 | 50.2° | 61.4° |
C12 | C13 | C9 | H6 | 169.6° | 58.6° |
C13 | C12 | H9 | H10 | 120.4° | 120.4° |
C12 | C13 | H11 | H12 | 119.1° | 120.1° |
C27 | N29 | C30 | H22 | 121.5° | 180.0° |
C27 | N29 | C30 | C31 | 112.8° | 180.0° |
N29 | C27 | C26 | C25 | 179.9° | 179.8° |
N29 | C27 | C26 | H21 | 0.1° | 0.2° |
C27 | N29 | C30 | H23 | 126.7° | 60.0° |
C27 | N29 | C30 | H24 | 7.7° | 60.0° |
C26 | C27 | N29 | C30 | 28.6° | 0.1° |
C27 | C26 | C25 | N24 | 0.2° | 0.3° |
C27 | C26 | C25 | H21 | 180.0° | 180.0° |
C27 | C26 | C25 | CL1 | 179.9° | 180.0° |
C26 | C27 | N29 | H22 | 150.1° | 179.9° |
N29 | C30 | C31 | H23 | 120.5° | 120.0° |
N29 | C30 | C31 | H24 | 120.5° | 120.0° |
N29 | C30 | C31 | N32 | 174.6° | 180.0° |
N29 | C30 | H23 | H24 | 118.5° | 120.0° |
N29 | C30 | C31 | H25 | 65.1° | 60.0° |
N29 | C30 | C31 | H26 | 54.3° | 60.0° |
N24 | C25 | C26 | CL1 | 179.9° | 179.7° |
N24 | C25 | C26 | H21 | 179.8° | 179.7° |
N11 | C14 | C8 | H13 | 119.9° | 119.8° |
N11 | C14 | C8 | H14 | 119.9° | 119.9° |
N11 | C14 | C8 | C9 | 57.3° | 54.6° |
N11 | C14 | C8 | H4 | 63.0° | 65.3° |
N11 | C14 | C8 | H5 | 177.7° | 174.6° |
C14 | N11 | C12 | H9 | 53.0° | 66.3° |
C14 | N11 | C12 | H10 | 173.3° | 173.3° |
N11 | C14 | H13 | H14 | 120.4° | 120.3° |
C34 | C33 | N32 | C31 | 23.7° | 180.0° |
C34 | C33 | N32 | O35 | 179.4° | 180.0° |
C34 | C33 | N32 | H27 | 156.3° | 0.0° |
C33 | C34 | H28 | H29 | 120.0° | 119.9° |
C33 | C34 | H28 | H30 | 120.0° | 120.0° |
C33 | C34 | H29 | H30 | 120.0° | 120.0° |
C14 | C8 | C9 | C13 | 49.6° | 61.4° |
C14 | C8 | C9 | C10 | 71.9° | 178.6° |
C14 | C8 | C9 | H4 | 120.3° | 119.9° |
C14 | C8 | C9 | H5 | 120.4° | 120.0° |
C14 | C8 | H4 | H5 | 118.9° | 120.1° |
C14 | C8 | C9 | H6 | 169.0° | 58.7° |
C8 | C14 | H13 | H14 | 120.4° | 120.3° |
C30 | C31 | N32 | H25 | 120.3° | 120.0° |
C30 | C31 | N32 | H26 | 120.3° | 120.0° |
C30 | C31 | N32 | C33 | 139.7° | 180.0° |
C31 | C30 | N29 | H22 | 8.7° | 0.0° |
C31 | C30 | H23 | H24 | 118.5° | 120.0° |
C30 | C31 | H25 | H26 | 119.1° | 120.0° |
C30 | C31 | N32 | H27 | 40.3° | 0.0° |
C31 | N32 | C33 | H27 | 180.0° | 180.0° |
C31 | N32 | C33 | O35 | 156.9° | 0.0° |
N32 | C31 | C30 | H23 | 54.1° | 60.0° |
N32 | C31 | C30 | H24 | 64.9° | 60.0° |
N32 | C31 | H25 | H26 | 119.1° | 120.0° |
C13 | C9 | C10 | C8 | 121.9° | 120.0° |
C13 | C9 | C10 | H6 | 119.0° | 120.0° |
C13 | C9 | C10 | O11 | 162.7° | 64.9° |
C13 | C9 | C8 | H6 | 119.3° | 120.1° |
C13 | C9 | C8 | H4 | 70.7° | 58.5° |
C13 | C9 | C8 | H5 | 170.0° | 178.6° |
C13 | C9 | C10 | H7 | 77.4° | 175.0° |
C13 | C9 | C10 | H8 | 42.7° | 55.0° |
C9 | C13 | C12 | H9 | 61.0° | 65.1° |
C9 | C13 | C12 | H10 | 178.7° | 174.4° |
C9 | C13 | H11 | H12 | 119.1° | 120.0° |
C9 | C10 | O11 | H7 | 120.0° | 120.0° |
C9 | C10 | O11 | H8 | 120.0° | 120.0° |
C10 | C9 | C8 | H6 | 119.1° | 119.9° |
C10 | C9 | C8 | H4 | 167.8° | 61.5° |
C10 | C9 | C8 | H5 | 48.4° | 58.7° |
C9 | C10 | H7 | H8 | 120.2° | 120.0° |
C10 | C9 | C13 | H11 | 48.9° | 58.7° |
C10 | C9 | C13 | H12 | 168.3° | 61.4° |
C9 | C10 | O11 | H31 | 180.0° | 180.0° |
O11 | C10 | C9 | C8 | 75.4° | 175.0° |
O11 | C10 | C9 | H6 | 43.6° | 55.1° |
O11 | C10 | H7 | H8 | 120.2° | 120.0° |
CL1 | C25 | C26 | H21 | 0.1° | 0.0° |
C9 | C8 | H4 | H5 | 118.9° | 120.1° |
C8 | C9 | C10 | H7 | 44.5° | 55.0° |
C8 | C9 | C10 | H8 | 164.6° | 65.0° |
C8 | C9 | C13 | H11 | 170.5° | 178.6° |
C8 | C9 | C13 | H12 | 70.0° | 58.6° |
C9 | C8 | C14 | H13 | 177.2° | 174.4° |
C9 | C8 | C14 | H14 | 62.5° | 65.3° |
C33 | N32 | C31 | H25 | 100.0° | 60.0° |
C33 | N32 | C31 | H26 | 19.4° | 60.0° |
N32 | C33 | C34 | H28 | 179.4° | 0.0° |
N32 | C33 | C34 | H29 | 59.4° | 120.0° |
N32 | C33 | C34 | H30 | 60.6° | 120.0° |
O35 | C33 | N32 | H27 | 23.1° | 180.0° |
O35 | C33 | C34 | H28 | 0.0° | 180.0° |
O35 | C33 | C34 | H29 | 120.0° | 60.0° |
O35 | C33 | C34 | H30 | 120.0° | 60.0° |
H1 | C3 | C4 | H2 | 0.1° | 0.0° |
H4 | C8 | C9 | H6 | 48.6° | 178.6° |
H4 | C8 | C14 | H13 | 56.9° | 54.5° |
H4 | C8 | C14 | H14 | 177.1° | 174.8° |
H5 | C8 | C9 | H6 | 70.7° | 61.3° |
H5 | C8 | C14 | H13 | 62.4° | 65.6° |
H5 | C8 | C14 | H14 | 57.8° | 54.7° |
H6 | C9 | C10 | H7 | 163.6° | 65.0° |
H6 | C9 | C10 | H8 | 76.3° | 175.1° |
H6 | C9 | C13 | H11 | 70.2° | 61.3° |
H6 | C9 | C13 | H12 | 49.3° | 178.7° |
H7 | C10 | O11 | H31 | 60.1° | 59.9° |
H8 | C10 | O11 | H31 | 60.0° | 60.0° |
H9 | C12 | C13 | H11 | 59.3° | 54.8° |
H9 | C12 | C13 | H12 | 178.7° | 174.9° |
H10 | C12 | C13 | H11 | 61.0° | 65.7° |
H10 | C12 | C13 | H12 | 58.4° | 54.4° |
H15 | C18 | H16 | H17 | 120.0° | 120.0° |
H18 | C20 | H19 | H20 | 120.0° | 120.1° |
H22 | N29 | C30 | H23 | 111.8° | 120.0° |
H22 | N29 | C30 | H24 | 129.2° | 120.0° |
H23 | C30 | C31 | H25 | 174.4° | 180.0° |
H23 | C30 | C31 | H26 | 66.2° | 60.0° |
H24 | C30 | C31 | H25 | 55.4° | 60.0° |
H24 | C30 | C31 | H26 | 174.8° | 180.0° |
H25 | C31 | N32 | H27 | 80.0° | 120.0° |
H26 | C31 | N32 | H27 | 160.6° | 120.0° |
H28 | C34 | H29 | H30 | 120.0° | 120.1° |