5W7
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 | 1.50Å | |
| 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 | N11 | sing | 1.66Å | 1.62Å | |
| S8 | O9 | doub | 1.42Å | 1.43Å | |
| N11 | C11 | sing | 1.47Å | 1.48Å | |
| N24 | C25 | doub | 1.31Å | 1.36Å | Aromatic |
| C27 | N29 | sing | 1.39Å | 1.35Å | |
| C27 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| N29 | C30 | sing | 1.47Å | 1.45Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C11 | C12 | sing | 1.53Å | 1.53Å | |
| O35 | C33 | doub | 1.21Å | 1.22Å | |
| C10 | C13 | sing | 1.53Å | 1.53Å | |
| C31 | C30 | sing | 1.53Å | 1.52Å | |
| C31 | N32 | sing | 1.46Å | 1.45Å | |
| C25 | C26 | sing | 1.40Å | 1.39Å | Aromatic |
| C25 | CL1 | sing | 1.74Å | 1.80Å | |
| C13 | C9 | sing | 1.53Å | 1.53Å | |
| C33 | N32 | sing | 1.35Å | 1.33Å | |
| C33 | C34 | sing | 1.51Å | 1.50Å | |
| C12 | C8 | sing | 1.53Å | 1.53Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C9 | N1 | sing | 1.47Å | 1.49Å | |
| C18 | H1 | sing | 1.09Å | 1.10Å | |
| C18 | H2 | sing | 1.09Å | 1.10Å | |
| C18 | H3 | sing | 1.09Å | 1.10Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C26 | H7 | sing | 1.08Å | 1.08Å | |
| N1 | H8 | sing | 1.01Å | 1.00Å | |
| N1 | H9 | sing | 1.01Å | 1.00Å | |
| C9 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C8 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C3 | H18 | sing | 1.08Å | 1.08Å | |
| C4 | H19 | sing | 1.08Å | 1.08Å | |
| C7 | H20 | sing | 1.08Å | 1.08Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C10 | H22 | sing | 1.09Å | 1.10Å | |
| C10 | H23 | sing | 1.09Å | 1.10Å | |
| C31 | H24 | sing | 1.09Å | 1.10Å | |
| C31 | H25 | sing | 1.09Å | 1.10Å | |
| C30 | H26 | sing | 1.09Å | 1.10Å | |
| C30 | H27 | sing | 1.09Å | 1.10Å | |
| C34 | H28 | sing | 1.09Å | 1.10Å | |
| C34 | H29 | sing | 1.09Å | 1.10Å | |
| C34 | H30 | sing | 1.09Å | 1.10Å | |
| N11 | H31 | sing | 0.97Å | 1.00Å | |
| N29 | H32 | sing | 0.97Å | 1.00Å | |
| N32 | H33 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C19 | N21 | 127.0° | 125.9° |
| C20 | C19 | C1 | 128.2° | 125.9° |
| C19 | C20 | H4 | 109.5° | 109.5° |
| C19 | C20 | H5 | 109.5° | 109.4° |
| C19 | C20 | H6 | 109.5° | 109.4° |
| C18 | O17 | C5 | 120.1° | 117.0° |
| O17 | C18 | H1 | 109.5° | 109.5° |
| O17 | C18 | H2 | 109.5° | 109.5° |
| O17 | C18 | H3 | 109.5° | 109.4° |
| C3 | C4 | C5 | 120.4° | 120.1° |
| C4 | C3 | C2 | 120.2° | 119.9° |
| C4 | C3 | H18 | 119.9° | 120.0° |
| C3 | C4 | H19 | 119.8° | 120.0° |
| C4 | C5 | O17 | 120.1° | 119.9° |
| C4 | C5 | C6 | 119.8° | 120.1° |
| C5 | C4 | H19 | 119.8° | 119.9° |
| C3 | C2 | C1 | 119.5° | 120.1° |
| C3 | C2 | C7 | 119.0° | 119.8° |
| C2 | C3 | H18 | 119.9° | 120.1° |
| N21 | C19 | C1 | 104.9° | 108.2° |
| C19 | N21 | C23 | 108.9° | 109.5° |
| C19 | C1 | C2 | 134.7° | 126.6° |
| C19 | C1 | N22 | 106.8° | 106.7° |
| O17 | C5 | C6 | 120.1° | 119.9° |
| C5 | C6 | C7 | 119.7° | 120.1° |
| C5 | C6 | S8 | 120.3° | 120.0° |
| C1 | C2 | C7 | 121.5° | 120.1° |
| C2 | C1 | N22 | 118.6° | 126.6° |
| C2 | C7 | C6 | 120.9° | 119.9° |
| C2 | C7 | H20 | 119.5° | 120.1° |
| N21 | C23 | N22 | 110.2° | 108.5° |
| N21 | C23 | C27 | 132.5° | 132.4° |
| C1 | N22 | C23 | 109.2° | 107.1° |
| C1 | N22 | N24 | 127.9° | 132.8° |
| C7 | C6 | S8 | 120.0° | 119.9° |
| C6 | C7 | H20 | 119.6° | 120.0° |
| C6 | S8 | O10 | 109.5° | 106.5° |
| C6 | S8 | N11 | 109.9° | 107.2° |
| C6 | S8 | O9 | 109.8° | 106.4° |
| O10 | S8 | N11 | 109.6° | 106.4° |
| O10 | S8 | O9 | 108.9° | 123.2° |
| N22 | C23 | C27 | 117.3° | 119.1° |
| C23 | N22 | N24 | 122.9° | 120.2° |
| C23 | C27 | N29 | 121.1° | 120.6° |
| C23 | C27 | C26 | 118.7° | 118.9° |
| N22 | N24 | C25 | 120.2° | 121.0° |
| N11 | S8 | O9 | 109.2° | 106.4° |
| S8 | N11 | C11 | 109.9° | 120.0° |
| S8 | N11 | H31 | 109.4° | 120.0° |
| N11 | C11 | C10 | 110.3° | 109.5° |
| N11 | C11 | C12 | 110.2° | 109.4° |
| N11 | C11 | H21 | 109.6° | 109.4° |
| C11 | N11 | H31 | 109.4° | 120.0° |
| N24 | C25 | C26 | 120.5° | 121.0° |
| N24 | C25 | CL1 | 120.4° | 119.5° |
| N29 | C27 | C26 | 120.1° | 120.6° |
| C27 | N29 | C30 | 119.7° | 120.0° |
| C27 | N29 | H32 | 106.8° | 120.0° |
| C27 | C26 | C25 | 120.5° | 119.9° |
| C27 | C26 | H7 | 119.8° | 120.0° |
| N29 | C30 | C31 | 112.2° | 109.5° |
| N29 | C30 | H26 | 108.8° | 109.5° |
| N29 | C30 | H27 | 108.8° | 109.4° |
| C30 | N29 | H32 | 106.9° | 120.0° |
| C10 | C11 | C12 | 108.9° | 109.5° |
| C11 | C10 | C13 | 110.8° | 109.5° |
| C10 | C11 | H21 | 108.9° | 109.5° |
| C11 | C10 | H22 | 109.1° | 109.5° |
| C11 | C10 | H23 | 109.1° | 109.4° |
| C11 | C12 | C8 | 110.9° | 109.5° |
| C11 | C12 | H16 | 109.1° | 109.5° |
| C11 | C12 | H17 | 109.1° | 109.5° |
| C12 | C11 | H21 | 108.9° | 109.4° |
| O35 | C33 | N32 | 121.9° | 120.0° |
| O35 | C33 | C34 | 122.6° | 120.0° |
| C10 | C13 | C9 | 111.4° | 109.4° |
| C10 | C13 | H14 | 109.0° | 109.5° |
| C10 | C13 | H15 | 109.0° | 109.5° |
| C13 | C10 | H22 | 109.1° | 109.5° |
| C13 | C10 | H23 | 109.1° | 109.4° |
| C30 | C31 | N32 | 111.2° | 109.4° |
| C30 | C31 | H24 | 109.1° | 109.4° |
| C30 | C31 | H25 | 109.0° | 109.5° |
| C31 | C30 | H26 | 108.8° | 109.5° |
| C31 | C30 | H27 | 108.8° | 109.5° |
| C31 | N32 | C33 | 121.2° | 120.0° |
| N32 | C31 | H24 | 109.0° | 109.5° |
| N32 | C31 | H25 | 109.1° | 109.5° |
| C31 | N32 | H33 | 119.4° | 120.0° |
| C26 | C25 | CL1 | 119.1° | 119.5° |
| C25 | C26 | H7 | 119.8° | 120.1° |
| C13 | C9 | C8 | 109.5° | 109.5° |
| C13 | C9 | N1 | 110.3° | 109.5° |
| C13 | C9 | H11 | 109.0° | 109.5° |
| C9 | C13 | H14 | 109.0° | 109.4° |
| C9 | C13 | H15 | 109.0° | 109.5° |
| N32 | C33 | C34 | 115.5° | 120.0° |
| C33 | N32 | H33 | 119.4° | 120.0° |
| C33 | C34 | H28 | 109.5° | 109.4° |
| C33 | C34 | H29 | 109.5° | 109.5° |
| C33 | C34 | H30 | 109.5° | 109.5° |
| C12 | C8 | C9 | 111.3° | 109.5° |
| C12 | C8 | H12 | 109.0° | 109.5° |
| C12 | C8 | H13 | 109.0° | 109.5° |
| C8 | C12 | H16 | 109.1° | 109.4° |
| C8 | C12 | H17 | 109.1° | 109.5° |
| C8 | C9 | N1 | 109.7° | 109.5° |
| C8 | C9 | H11 | 109.0° | 109.5° |
| C9 | C8 | H12 | 109.0° | 109.5° |
| C9 | C8 | H13 | 109.0° | 109.5° |
| C9 | N1 | H8 | 109.5° | 111.0° |
| C9 | N1 | H9 | 109.5° | 111.0° |
| N1 | C9 | H11 | 109.5° | 109.5° |
| H1 | C18 | H2 | 109.5° | 109.5° |
| H1 | C18 | H3 | 109.4° | 109.5° |
| H2 | C18 | H3 | 109.5° | 109.5° |
| H4 | C20 | H5 | 109.4° | 109.5° |
| H4 | C20 | H6 | 109.5° | 109.5° |
| H5 | C20 | H6 | 109.4° | 109.5° |
| H8 | N1 | H9 | 109.4° | 111.0° |
| H12 | C8 | H13 | 109.5° | 109.4° |
| H14 | C13 | H15 | 109.5° | 109.5° |
| H16 | C12 | H17 | 109.4° | 109.5° |
| H22 | C10 | H23 | 109.5° | 109.5° |
| H24 | C31 | H25 | 109.5° | 109.5° |
| H26 | C30 | H27 | 109.5° | 109.5° |
| H28 | C34 | H29 | 109.5° | 109.5° |
| H28 | C34 | H30 | 109.5° | 109.5° |
| H29 | C34 | H30 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C19 | N21 | C1 | 179.8° | 179.7° |
| C20 | C19 | C1 | C2 | 0.7° | 0.3° |
| C20 | C19 | N21 | C23 | 180.0° | 179.7° |
| C20 | C19 | C1 | N22 | 179.8° | 179.7° |
| C19 | C20 | H4 | H5 | 120.0° | 120.0° |
| C19 | C20 | H4 | H6 | 120.0° | 119.9° |
| C19 | C20 | H5 | H6 | 120.0° | 119.9° |
| C18 | O17 | C5 | C4 | 16.9° | 0.3° |
| C18 | O17 | C5 | C6 | 163.1° | 180.0° |
| O17 | C18 | H1 | H2 | 120.0° | 120.0° |
| O17 | C18 | H1 | H3 | 120.0° | 120.0° |
| O17 | C18 | H2 | H3 | 120.0° | 120.0° |
| C3 | C4 | C5 | H19 | 180.0° | 180.0° |
| C4 | C3 | C2 | H18 | 180.0° | 180.0° |
| C3 | C4 | C5 | O17 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.1° | 0.3° |
| C4 | C3 | C2 | C1 | 179.8° | 180.0° |
| C4 | C3 | C2 | C7 | 0.4° | 0.3° |
| C5 | C4 | C3 | C2 | 0.0° | 0.0° |
| C4 | C5 | O17 | C6 | 180.0° | 179.7° |
| C4 | C5 | C6 | C7 | 0.1° | 0.3° |
| C4 | C5 | C6 | S8 | 179.8° | 180.0° |
| C5 | C4 | C3 | H18 | 180.0° | 180.0° |
| C3 | C2 | C1 | C19 | 43.5° | 135.3° |
| C3 | C2 | C1 | C7 | 179.4° | 179.8° |
| C3 | C2 | C1 | N22 | 135.5° | 44.7° |
| C3 | C2 | C7 | C6 | 0.6° | 0.2° |
| C2 | C3 | C4 | H19 | 179.9° | 180.0° |
| C3 | C2 | C7 | H20 | 179.3° | 179.7° |
| N21 | C19 | C1 | C2 | 179.4° | 180.0° |
| N21 | C19 | C1 | N22 | 0.3° | 0.0° |
| C19 | N21 | C23 | N22 | 0.1° | 0.0° |
| C19 | N21 | C23 | C27 | 179.9° | 180.0° |
| N21 | C19 | C20 | H4 | 0.0° | 89.9° |
| N21 | C19 | C20 | H5 | 120.0° | 150.0° |
| N21 | C19 | C20 | H6 | 120.0° | 30.0° |
| C19 | C1 | C2 | N22 | 179.0° | 180.0° |
| C19 | C1 | C2 | C7 | 135.9° | 45.0° |
| C1 | C19 | N21 | C23 | 0.2° | 0.0° |
| C19 | C1 | N22 | C23 | 0.4° | 0.0° |
| C19 | C1 | N22 | N24 | 179.9° | 180.0° |
| C1 | C19 | C20 | H4 | 179.7° | 89.7° |
| C1 | C19 | C20 | H5 | 59.8° | 30.4° |
| C1 | C19 | C20 | H6 | 60.2° | 150.3° |
| O17 | C5 | C6 | C7 | 179.8° | 180.0° |
| O17 | C5 | C6 | S8 | 0.3° | 0.3° |
| C5 | O17 | C18 | H1 | 180.0° | 180.0° |
| C5 | O17 | C18 | H2 | 60.0° | 60.0° |
| C5 | O17 | C18 | H3 | 60.0° | 60.0° |
| O17 | C5 | C4 | H19 | 0.0° | 0.0° |
| C5 | C6 | C7 | C2 | 0.5° | 0.0° |
| C5 | C6 | C7 | S8 | 179.9° | 179.7° |
| C5 | C6 | S8 | O10 | 61.4° | 178.6° |
| C5 | C6 | S8 | N11 | 59.0° | 65.0° |
| C5 | C6 | S8 | O9 | 179.1° | 48.5° |
| C6 | C5 | C4 | H19 | 179.9° | 179.7° |
| C5 | C6 | C7 | H20 | 179.5° | 180.0° |
| C1 | C2 | C7 | C6 | 180.0° | 180.0° |
| C2 | C1 | N22 | C23 | 179.7° | 180.0° |
| C2 | C1 | N22 | N24 | 0.7° | 0.0° |
| C1 | C2 | C3 | H18 | 0.2° | 0.0° |
| C1 | C2 | C7 | H20 | 0.1° | 0.1° |
| C7 | C2 | C1 | N22 | 45.1° | 135.0° |
| C2 | C7 | C6 | H20 | 180.0° | 179.9° |
| C2 | C7 | C6 | S8 | 179.4° | 179.7° |
| C7 | C2 | C3 | H18 | 179.6° | 179.7° |
| N21 | C23 | N22 | C1 | 0.3° | 0.0° |
| N21 | C23 | N22 | C27 | 180.0° | 179.9° |
| N21 | C23 | N22 | N24 | 180.0° | 180.0° |
| N21 | C23 | C27 | N29 | 0.1° | 0.1° |
| N21 | C23 | C27 | C26 | 179.9° | 180.0° |
| C1 | N22 | C23 | N24 | 179.7° | 180.0° |
| C1 | N22 | C23 | C27 | 179.7° | 180.0° |
| C1 | N22 | N24 | C25 | 179.6° | 180.0° |
| C7 | C6 | S8 | O10 | 118.7° | 1.1° |
| C7 | C6 | S8 | N11 | 120.9° | 114.7° |
| C7 | C6 | S8 | O9 | 0.8° | 131.8° |
| C6 | S8 | O10 | N11 | 120.6° | 114.1° |
| C6 | S8 | O10 | O9 | 120.1° | 123.0° |
| C6 | S8 | N11 | O9 | 120.4° | 113.5° |
| C6 | S8 | N11 | C11 | 60.1° | 65.0° |
| S8 | C6 | C7 | H20 | 0.6° | 0.4° |
| C6 | S8 | N11 | H31 | 60.0° | 115.0° |
| O10 | S8 | N11 | O9 | 119.2° | 132.9° |
| O10 | S8 | N11 | C11 | 179.6° | 178.6° |
| O10 | S8 | N11 | H31 | 60.3° | 1.4° |
| C23 | N22 | N24 | C25 | 0.0° | 0.0° |
| N22 | C23 | C27 | N29 | 179.9° | 180.0° |
| N22 | C23 | C27 | C26 | 0.1° | 0.1° |
| C27 | C23 | N22 | N24 | 0.0° | 0.0° |
| C23 | C27 | N29 | C26 | 179.8° | 179.9° |
| C23 | C27 | N29 | C30 | 148.7° | 180.0° |
| C23 | C27 | C26 | C25 | 0.2° | 0.1° |
| C23 | C27 | C26 | H7 | 179.8° | 180.0° |
| C23 | C27 | N29 | H32 | 27.3° | 0.0° |
| N22 | N24 | C25 | C26 | 0.1° | 0.0° |
| N22 | N24 | C25 | CL1 | 180.0° | 180.0° |
| S8 | N11 | C11 | H31 | 120.1° | 180.0° |
| S8 | N11 | C11 | C10 | 151.5° | 145.0° |
| S8 | N11 | C11 | C12 | 88.3° | 95.0° |
| S8 | N11 | C11 | H21 | 31.6° | 25.0° |
| O9 | S8 | N11 | C11 | 60.3° | 48.5° |
| O9 | S8 | N11 | H31 | 179.6° | 131.5° |
| N11 | C11 | C10 | C12 | 121.1° | 120.0° |
| N11 | C11 | C10 | H21 | 120.3° | 120.0° |
| N11 | C11 | C12 | H21 | 120.3° | 119.9° |
| N11 | C11 | C10 | C13 | 179.0° | 180.0° |
| N11 | C11 | C12 | C8 | 179.3° | 180.0° |
| N11 | C11 | C12 | H16 | 59.1° | 60.0° |
| N11 | C11 | C12 | H17 | 60.5° | 60.0° |
| N11 | C11 | C10 | H22 | 60.8° | 60.0° |
| N11 | C11 | C10 | H23 | 58.8° | 60.0° |
| N24 | C25 | C26 | C27 | 0.2° | 0.1° |
| N24 | C25 | C26 | CL1 | 179.9° | 179.9° |
| N24 | C25 | C26 | H7 | 179.8° | 180.0° |
| C27 | N29 | C30 | H32 | 121.5° | 180.0° |
| C27 | N29 | C30 | C31 | 100.2° | 180.0° |
| N29 | C27 | C26 | C25 | 180.0° | 180.0° |
| N29 | C27 | C26 | H7 | 0.0° | 0.1° |
| C27 | N29 | C30 | H26 | 139.4° | 60.0° |
| C27 | N29 | C30 | H27 | 20.3° | 60.0° |
| C26 | C27 | N29 | C30 | 31.5° | 0.0° |
| C27 | C26 | C25 | H7 | 180.0° | 179.9° |
| C27 | C26 | C25 | CL1 | 179.9° | 180.0° |
| C26 | C27 | N29 | H32 | 153.0° | 179.9° |
| N29 | C30 | C31 | H26 | 120.4° | 120.0° |
| N29 | C30 | C31 | H27 | 120.4° | 119.9° |
| N29 | C30 | C31 | N32 | 158.8° | 180.0° |
| N29 | C30 | C31 | H24 | 80.9° | 60.0° |
| N29 | C30 | C31 | H25 | 38.6° | 60.0° |
| N29 | C30 | H26 | H27 | 118.7° | 119.9° |
| C10 | C11 | C12 | H21 | 118.7° | 120.1° |
| C11 | C10 | C13 | H22 | 120.2° | 120.0° |
| C11 | C10 | C13 | H23 | 120.2° | 119.9° |
| C11 | C10 | C13 | C9 | 58.0° | 60.0° |
| C10 | C11 | C12 | C8 | 58.2° | 60.0° |
| C11 | C10 | C13 | H14 | 62.3° | 180.0° |
| C11 | C10 | C13 | H15 | 178.3° | 60.0° |
| C10 | C11 | C12 | H16 | 62.0° | 180.0° |
| C10 | C11 | C12 | H17 | 178.5° | 60.0° |
| C11 | C10 | H22 | H23 | 119.4° | 120.0° |
| C10 | C11 | N11 | H31 | 31.4° | 35.0° |
| C12 | C11 | C10 | C13 | 58.0° | 60.0° |
| C11 | C12 | C8 | H16 | 120.2° | 120.0° |
| C11 | C12 | C8 | H17 | 120.2° | 120.0° |
| C11 | C12 | C8 | C9 | 58.4° | 60.0° |
| C11 | C12 | C8 | H12 | 178.7° | 60.0° |
| C11 | C12 | C8 | H13 | 61.8° | 180.0° |
| C11 | C12 | H16 | H17 | 119.4° | 120.0° |
| C12 | C11 | C10 | H22 | 178.2° | 60.0° |
| C12 | C11 | C10 | H23 | 62.2° | 180.0° |
| C12 | C11 | N11 | H31 | 151.6° | 85.0° |
| O35 | C33 | N32 | C31 | 22.8° | 0.0° |
| O35 | C33 | N32 | C34 | 179.6° | 179.9° |
| O35 | C33 | C34 | H28 | 0.0° | 90.1° |
| O35 | C33 | C34 | H29 | 120.0° | 29.9° |
| O35 | C33 | C34 | H30 | 120.0° | 150.0° |
| O35 | C33 | N32 | H33 | 157.2° | 179.9° |
| C10 | C13 | C9 | H14 | 120.3° | 120.0° |
| C10 | C13 | C9 | H15 | 120.3° | 120.0° |
| C10 | C13 | C9 | C8 | 56.0° | 60.0° |
| C10 | C13 | C9 | N1 | 176.7° | 180.0° |
| C10 | C13 | C9 | H11 | 63.1° | 60.0° |
| C10 | C13 | H14 | H15 | 119.1° | 120.1° |
| C13 | C10 | C11 | H21 | 60.7° | 60.0° |
| C13 | C10 | H22 | H23 | 119.4° | 120.0° |
| C30 | C31 | N32 | H24 | 120.3° | 120.0° |
| C30 | C31 | N32 | H25 | 120.2° | 120.0° |
| C30 | C31 | N32 | C33 | 142.3° | 180.0° |
| C30 | C31 | H24 | H25 | 119.2° | 120.0° |
| C31 | C30 | H26 | H27 | 118.7° | 120.1° |
| C31 | C30 | N29 | H32 | 21.3° | 0.0° |
| C30 | C31 | N32 | H33 | 37.7° | 0.1° |
| C31 | N32 | C33 | H33 | 180.0° | 179.9° |
| C31 | N32 | C33 | C34 | 156.7° | 179.9° |
| N32 | C31 | H24 | H25 | 119.3° | 120.1° |
| N32 | C31 | C30 | H26 | 38.4° | 60.0° |
| N32 | C31 | C30 | H27 | 80.7° | 60.1° |
| CL1 | C25 | C26 | H7 | 0.1° | 0.1° |
| C13 | C9 | C8 | C12 | 56.2° | 60.0° |
| C13 | C9 | C8 | N1 | 121.1° | 120.0° |
| C13 | C9 | C8 | H11 | 119.1° | 120.0° |
| C13 | C9 | N1 | H11 | 119.9° | 120.0° |
| C13 | C9 | N1 | H8 | 180.0° | 60.0° |
| C13 | C9 | N1 | H9 | 60.0° | 176.0° |
| C13 | C9 | C8 | H12 | 176.5° | 60.0° |
| C13 | C9 | C8 | H13 | 64.1° | 180.0° |
| C9 | C13 | H14 | H15 | 119.1° | 120.0° |
| C9 | C13 | C10 | H22 | 178.2° | 60.0° |
| C9 | C13 | C10 | H23 | 62.2° | 180.0° |
| C33 | N32 | C31 | H24 | 97.4° | 60.0° |
| C33 | N32 | C31 | H25 | 22.1° | 60.0° |
| N32 | C33 | C34 | H28 | 179.6° | 90.0° |
| N32 | C33 | C34 | H29 | 59.6° | 150.0° |
| N32 | C33 | C34 | H30 | 60.4° | 30.0° |
| C33 | C34 | H28 | H29 | 120.0° | 120.0° |
| C33 | C34 | H28 | H30 | 120.0° | 120.0° |
| C33 | C34 | H29 | H30 | 120.0° | 120.1° |
| C34 | C33 | N32 | H33 | 23.3° | 0.0° |
| C12 | C8 | C9 | H12 | 120.3° | 120.0° |
| C12 | C8 | C9 | H13 | 120.2° | 120.0° |
| C12 | C8 | C9 | N1 | 177.3° | 180.0° |
| C12 | C8 | C9 | H11 | 62.9° | 60.0° |
| C12 | C8 | H12 | H13 | 119.2° | 120.0° |
| C8 | C12 | H16 | H17 | 119.4° | 120.0° |
| C8 | C12 | C11 | H21 | 60.4° | 60.0° |
| C8 | C9 | N1 | H11 | 119.5° | 120.0° |
| C8 | C9 | N1 | H8 | 59.4° | 180.0° |
| C8 | C9 | N1 | H9 | 60.6° | 56.0° |
| C9 | C8 | H12 | H13 | 119.2° | 120.0° |
| C8 | C9 | C13 | H14 | 64.3° | 180.0° |
| C8 | C9 | C13 | H15 | 176.3° | 60.0° |
| C9 | C8 | C12 | H16 | 61.8° | 180.0° |
| C9 | C8 | C12 | H17 | 178.7° | 60.0° |
| C9 | N1 | H8 | H9 | 120.0° | 124.0° |
| N1 | C9 | C8 | H12 | 62.4° | 60.0° |
| N1 | C9 | C8 | H13 | 57.0° | 60.0° |
| N1 | C9 | C13 | H14 | 56.4° | 60.0° |
| N1 | C9 | C13 | H15 | 63.0° | 60.0° |
| H1 | C18 | H2 | H3 | 119.9° | 120.1° |
| H4 | C20 | H5 | H6 | 120.0° | 120.1° |
| H8 | N1 | C9 | H11 | 60.1° | 60.0° |
| H9 | N1 | C9 | H11 | 179.9° | 64.0° |
| H11 | C9 | C8 | H12 | 57.4° | 180.0° |
| H11 | C9 | C8 | H13 | 176.8° | 60.0° |
| H11 | C9 | C13 | H14 | 176.6° | 60.0° |
| H11 | C9 | C13 | H15 | 57.2° | 180.0° |
| H12 | C8 | C12 | H16 | 58.5° | 60.0° |
| H12 | C8 | C12 | H17 | 61.1° | 180.0° |
| H13 | C8 | C12 | H16 | 178.0° | 60.0° |
| H13 | C8 | C12 | H17 | 58.4° | 60.0° |
| H14 | C13 | C10 | H22 | 57.9° | 60.0° |
| H14 | C13 | C10 | H23 | 177.5° | 60.1° |
| H15 | C13 | C10 | H22 | 61.6° | 180.0° |
| H15 | C13 | C10 | H23 | 58.0° | 60.0° |
| H16 | C12 | C11 | H21 | 179.4° | 59.9° |
| H17 | C12 | C11 | H21 | 59.8° | 180.0° |
| H18 | C3 | C4 | H19 | 0.1° | 0.0° |
| H21 | C11 | C10 | H22 | 59.5° | 180.0° |
| H21 | C11 | C10 | H23 | 179.1° | 60.0° |
| H21 | C11 | N11 | H31 | 88.5° | 155.1° |
| H24 | C31 | C30 | H26 | 158.7° | 60.0° |
| H24 | C31 | C30 | H27 | 39.5° | 180.0° |
| H24 | C31 | N32 | H33 | 82.6° | 120.0° |
| H25 | C31 | C30 | H26 | 81.8° | 180.0° |
| H25 | C31 | C30 | H27 | 159.0° | 60.0° |
| H25 | C31 | N32 | H33 | 157.9° | 119.9° |
| H26 | C30 | N29 | H32 | 99.1° | 120.0° |
| H27 | C30 | N29 | H32 | 141.7° | 120.0° |
| H28 | C34 | H29 | H30 | 120.0° | 120.0° |
