A1JWM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.52Å | |
| C17 | C16 | sing | 1.52Å | 1.51Å | |
| C23 | N5 | sing | 1.47Å | 1.50Å | |
| C23 | C15 | sing | 1.54Å | 1.56Å | |
| C16 | C15 | sing | 1.54Å | 1.54Å | |
| C15 | C12 | sing | 1.52Å | 1.53Å | |
| C15 | C14 | sing | 1.52Å | 1.53Å | |
| C12 | C11 | sing | 1.53Å | 1.51Å | |
| C14 | C13 | sing | 1.53Å | 1.51Å | |
| C11 | N4 | sing | 1.47Å | 1.46Å | |
| C13 | N4 | sing | 1.47Å | 1.46Å | |
| N4 | C10 | sing | 1.39Å | 1.37Å | |
| C9 | C10 | sing | 1.41Å | 1.44Å | Aromatic |
| C9 | N3 | doub | 1.31Å | 1.33Å | Aromatic |
| C10 | N6 | doub | 1.32Å | 1.35Å | Aromatic |
| N3 | C8 | sing | 1.34Å | 1.35Å | Aromatic |
| N6 | C24 | sing | 1.34Å | 1.37Å | Aromatic |
| C8 | C24 | sing | 1.47Å | 1.41Å | Aromatic |
| C8 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C24 | N7 | doub | 1.32Å | 1.34Å | Aromatic |
| C7 | N2 | sing | 1.38Å | 1.36Å | |
| C7 | N1 | sing | 1.35Å | 1.38Å | Aromatic |
| N7 | N1 | sing | 1.40Å | 1.38Å | Aromatic |
| CL1 | C1 | sing | 1.74Å | 1.73Å | |
| N1 | C6 | sing | 1.40Å | 1.43Å | |
| C6 | C1 | doub | 1.39Å | 1.39Å | Aromatic |
| C6 | C5 | sing | 1.39Å | 1.38Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | CL2 | sing | 1.74Å | 1.73Å | |
| C2 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.37Å | Aromatic |
| C3 | H1 | sing | 1.08Å | 1.08Å | |
| C4 | H2 | sing | 1.08Å | 1.08Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C11 | H5 | sing | 1.09Å | 1.10Å | |
| C12 | H6 | sing | 1.09Å | 1.10Å | |
| C12 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C14 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.08Å | 1.08Å | |
| C19 | H15 | sing | 1.08Å | 1.08Å | |
| C20 | H16 | sing | 1.08Å | 1.08Å | |
| C21 | H17 | sing | 1.08Å | 1.08Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C9 | H19 | sing | 1.08Å | 1.08Å | |
| N2 | H20 | sing | 0.97Å | 1.00Å | |
| N2 | H21 | sing | 0.97Å | 1.00Å | |
| N5 | H22 | sing | 1.01Å | 1.00Å | |
| N5 | H23 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C20 | C21 | 120.7° | 119.9° |
| C20 | C19 | C18 | 120.6° | 120.0° |
| C20 | C19 | H15 | 119.7° | 120.0° |
| C19 | C20 | H16 | 119.7° | 120.1° |
| C20 | C21 | C22 | 118.9° | 120.3° |
| C21 | C20 | H16 | 119.6° | 120.0° |
| C20 | C21 | H17 | 120.6° | 119.9° |
| C19 | C18 | C17 | 118.8° | 120.2° |
| C19 | C18 | H14 | 120.6° | 119.9° |
| C18 | C19 | H15 | 119.7° | 120.0° |
| C21 | C22 | C17 | 120.5° | 119.8° |
| C21 | C22 | C23 | 128.2° | 130.4° |
| C22 | C21 | H17 | 120.6° | 119.8° |
| C18 | C17 | C22 | 120.5° | 119.9° |
| C18 | C17 | C16 | 129.0° | 130.3° |
| C17 | C18 | H14 | 120.6° | 119.9° |
| C17 | C22 | C23 | 111.3° | 109.8° |
| C22 | C17 | C16 | 110.5° | 109.8° |
| C22 | C23 | N5 | 110.1° | 110.3° |
| C22 | C23 | C15 | 104.2° | 105.1° |
| C22 | C23 | H18 | 109.9° | 110.3° |
| C17 | C16 | C15 | 105.6° | 105.1° |
| C17 | C16 | H12 | 110.5° | 110.3° |
| C17 | C16 | H13 | 110.4° | 110.4° |
| N5 | C23 | C15 | 112.8° | 110.3° |
| N5 | C23 | H18 | 110.3° | 110.3° |
| C23 | N5 | H22 | 109.5° | 111.0° |
| C23 | N5 | H23 | 109.4° | 110.9° |
| C23 | C15 | C16 | 105.4° | 103.2° |
| C23 | C15 | C12 | 110.6° | 110.7° |
| C23 | C15 | C14 | 111.4° | 110.5° |
| C15 | C23 | H18 | 109.4° | 110.4° |
| C16 | C15 | C12 | 109.6° | 110.7° |
| C16 | C15 | C14 | 109.0° | 110.5° |
| C15 | C16 | H12 | 110.4° | 110.3° |
| C15 | C16 | H13 | 110.4° | 110.3° |
| C12 | C15 | C14 | 110.6° | 110.9° |
| C15 | C12 | C11 | 112.1° | 109.4° |
| C15 | C12 | H6 | 108.8° | 109.4° |
| C15 | C12 | H7 | 108.8° | 109.5° |
| C15 | C14 | C13 | 111.9° | 109.4° |
| C15 | C14 | H10 | 108.8° | 109.5° |
| C15 | C14 | H11 | 108.9° | 109.5° |
| C12 | C11 | N4 | 107.8° | 109.4° |
| C12 | C11 | H4 | 109.9° | 109.5° |
| C12 | C11 | H5 | 109.9° | 109.5° |
| C11 | C12 | H6 | 108.8° | 109.5° |
| C11 | C12 | H7 | 108.8° | 109.5° |
| C14 | C13 | N4 | 107.1° | 109.4° |
| C14 | C13 | H8 | 110.0° | 109.4° |
| C14 | C13 | H9 | 110.0° | 109.5° |
| C13 | C14 | H10 | 108.9° | 109.4° |
| C13 | C14 | H11 | 108.8° | 109.5° |
| C11 | N4 | C13 | 113.3° | 111.3° |
| C11 | N4 | C10 | 123.2° | 111.0° |
| N4 | C11 | H4 | 109.9° | 109.5° |
| N4 | C11 | H5 | 109.9° | 109.5° |
| C13 | N4 | C10 | 122.0° | 111.0° |
| N4 | C13 | H8 | 110.1° | 109.5° |
| N4 | C13 | H9 | 110.1° | 109.5° |
| N4 | C10 | C9 | 119.9° | 119.4° |
| N4 | C10 | N6 | 119.4° | 119.3° |
| C10 | C9 | N3 | 121.4° | 121.4° |
| C9 | C10 | N6 | 120.6° | 121.3° |
| C10 | C9 | H19 | 119.3° | 119.3° |
| C9 | N3 | C8 | 117.6° | 119.8° |
| N3 | C9 | H19 | 119.3° | 119.3° |
| C10 | N6 | C24 | 117.4° | 119.5° |
| N3 | C8 | C24 | 122.1° | 119.2° |
| N3 | C8 | C7 | 131.0° | 134.5° |
| N6 | C24 | C8 | 120.8° | 118.8° |
| N6 | C24 | N7 | 130.0° | 134.3° |
| C24 | C8 | C7 | 107.0° | 106.3° |
| C8 | C24 | N7 | 109.2° | 106.9° |
| C8 | C7 | N2 | 128.6° | 126.2° |
| C8 | C7 | N1 | 106.6° | 107.6° |
| C24 | N7 | N1 | 107.6° | 109.3° |
| N2 | C7 | N1 | 124.7° | 126.2° |
| C7 | N2 | H20 | 109.5° | 120.0° |
| C7 | N2 | H21 | 109.5° | 120.0° |
| C7 | N1 | N7 | 109.6° | 109.9° |
| C7 | N1 | C6 | 129.7° | 125.1° |
| N7 | N1 | C6 | 120.7° | 125.0° |
| CL1 | C1 | C6 | 120.4° | 120.0° |
| CL1 | C1 | C2 | 119.0° | 120.1° |
| N1 | C6 | C1 | 121.0° | 120.1° |
| N1 | C6 | C5 | 119.8° | 120.1° |
| C1 | C6 | C5 | 119.1° | 119.8° |
| C6 | C1 | C2 | 120.6° | 119.9° |
| C6 | C5 | C4 | 119.8° | 120.0° |
| C6 | C5 | H3 | 120.1° | 120.0° |
| C1 | C2 | CL2 | 120.2° | 120.0° |
| C1 | C2 | C3 | 119.8° | 120.1° |
| C5 | C4 | C3 | 121.2° | 120.1° |
| C5 | C4 | H2 | 119.4° | 120.0° |
| C4 | C5 | H3 | 120.1° | 120.0° |
| CL2 | C2 | C3 | 119.9° | 119.9° |
| C2 | C3 | C4 | 119.5° | 120.1° |
| C2 | C3 | H1 | 120.3° | 120.0° |
| C4 | C3 | H1 | 120.3° | 119.9° |
| C3 | C4 | H2 | 119.4° | 120.0° |
| H4 | C11 | H5 | 109.4° | 109.5° |
| H6 | C12 | H7 | 109.5° | 109.5° |
| H8 | C13 | H9 | 109.5° | 109.5° |
| H10 | C14 | H11 | 109.5° | 109.5° |
| H12 | C16 | H13 | 109.4° | 110.3° |
| H20 | N2 | H21 | 109.5° | 120.0° |
| H22 | N5 | H23 | 109.5° | 111.1° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C20 | C21 | H16 | 180.0° | 180.0° |
| C20 | C19 | C18 | H15 | 180.0° | 180.0° |
| C19 | C20 | C21 | C22 | 0.0° | 0.0° |
| C20 | C19 | C18 | C17 | 0.8° | 0.1° |
| C20 | C19 | C18 | H14 | 179.2° | 180.0° |
| C19 | C20 | C21 | H17 | 180.0° | 179.9° |
| C21 | C20 | C19 | C18 | 0.3° | 0.0° |
| C20 | C21 | C22 | H17 | 180.0° | 179.9° |
| C20 | C21 | C22 | C17 | 0.2° | 0.0° |
| C20 | C21 | C22 | C23 | 179.5° | 179.9° |
| C21 | C20 | C19 | H15 | 179.7° | 180.0° |
| C19 | C18 | C17 | H14 | 180.0° | 180.0° |
| C19 | C18 | C17 | C22 | 1.0° | 0.1° |
| C19 | C18 | C17 | C16 | 179.2° | 180.0° |
| C18 | C19 | C20 | H16 | 179.7° | 179.9° |
| C21 | C22 | C17 | C18 | 0.7° | 0.0° |
| C21 | C22 | C17 | C23 | 179.8° | 179.9° |
| C21 | C22 | C17 | C16 | 179.3° | 180.0° |
| C21 | C22 | C23 | N5 | 68.8° | 77.4° |
| C21 | C22 | C23 | C15 | 170.0° | 163.6° |
| C22 | C21 | C20 | H16 | 180.0° | 180.0° |
| C21 | C22 | C23 | H18 | 52.9° | 44.7° |
| C18 | C17 | C22 | C16 | 178.5° | 180.0° |
| C18 | C17 | C22 | C23 | 179.1° | 179.9° |
| C18 | C17 | C16 | C15 | 170.3° | 163.6° |
| C18 | C17 | C16 | H12 | 70.3° | 44.7° |
| C18 | C17 | C16 | H13 | 51.0° | 77.4° |
| C17 | C18 | C19 | H15 | 179.2° | 179.9° |
| C17 | C22 | C23 | N5 | 111.0° | 102.4° |
| C17 | C22 | C23 | C15 | 10.2° | 16.5° |
| C22 | C17 | C16 | C15 | 11.3° | 16.3° |
| C22 | C17 | C16 | H12 | 108.1° | 135.3° |
| C22 | C17 | C16 | H13 | 130.7° | 102.6° |
| C22 | C17 | C18 | H14 | 179.0° | 180.0° |
| C17 | C22 | C21 | H17 | 179.8° | 179.9° |
| C17 | C22 | C23 | H18 | 127.3° | 135.4° |
| C23 | C22 | C17 | C16 | 0.5° | 0.1° |
| C22 | C23 | N5 | C15 | 115.9° | 115.7° |
| C22 | C23 | N5 | H18 | 121.5° | 122.1° |
| C22 | C23 | C15 | H18 | 117.5° | 118.9° |
| C22 | C23 | C15 | C16 | 16.5° | 25.3° |
| C22 | C23 | C15 | C12 | 101.9° | 93.2° |
| C22 | C23 | C15 | C14 | 134.6° | 143.5° |
| C23 | C22 | C21 | H17 | 0.4° | 0.2° |
| C22 | C23 | N5 | H22 | 180.0° | 61.5° |
| C22 | C23 | N5 | H23 | 60.0° | 62.5° |
| C17 | C16 | C15 | C23 | 17.0° | 25.3° |
| C17 | C16 | C15 | H12 | 119.4° | 118.9° |
| C17 | C16 | C15 | H13 | 119.4° | 119.0° |
| C17 | C16 | C15 | C12 | 102.0° | 93.2° |
| C17 | C16 | C15 | C14 | 136.7° | 143.5° |
| C17 | C16 | H12 | H13 | 121.8° | 122.2° |
| C16 | C17 | C18 | H14 | 0.7° | 0.0° |
| N5 | C23 | C15 | H18 | 123.1° | 122.1° |
| N5 | C23 | C15 | C16 | 102.9° | 93.6° |
| N5 | C23 | C15 | C12 | 138.7° | 147.9° |
| N5 | C23 | C15 | C14 | 15.3° | 24.6° |
| C23 | N5 | H22 | H23 | 120.0° | 123.9° |
| C23 | C15 | C16 | C12 | 119.0° | 118.5° |
| C23 | C15 | C16 | C14 | 119.8° | 118.2° |
| C23 | C15 | C12 | C14 | 123.9° | 123.1° |
| C23 | C15 | C12 | C11 | 173.6° | 67.4° |
| C23 | C15 | C14 | C13 | 174.5° | 67.5° |
| C23 | C15 | C12 | H6 | 66.0° | 52.5° |
| C23 | C15 | C12 | H7 | 53.2° | 172.6° |
| C23 | C15 | C14 | H10 | 54.1° | 172.6° |
| C23 | C15 | C14 | H11 | 65.1° | 52.5° |
| C23 | C15 | C16 | H12 | 102.4° | 144.2° |
| C23 | C15 | C16 | H13 | 136.4° | 93.7° |
| C15 | C23 | N5 | H22 | 64.1° | 177.1° |
| C15 | C23 | N5 | H23 | 175.9° | 53.2° |
| C16 | C15 | C12 | C14 | 120.3° | 123.1° |
| C16 | C15 | C12 | C11 | 70.6° | 178.8° |
| C16 | C15 | C14 | C13 | 69.5° | 179.0° |
| C16 | C15 | C12 | H6 | 49.8° | 61.3° |
| C16 | C15 | C12 | H7 | 169.0° | 58.8° |
| C16 | C15 | C14 | H10 | 170.1° | 59.0° |
| C16 | C15 | C14 | H11 | 50.9° | 61.0° |
| C15 | C16 | H12 | H13 | 121.8° | 122.2° |
| C16 | C15 | C23 | H18 | 134.0° | 144.3° |
| C15 | C12 | C11 | H6 | 120.4° | 119.9° |
| C15 | C12 | C11 | H7 | 120.4° | 120.1° |
| C12 | C15 | C14 | C13 | 51.1° | 55.8° |
| C15 | C12 | C11 | N4 | 54.6° | 57.9° |
| C15 | C12 | C11 | H4 | 65.2° | 177.9° |
| C15 | C12 | C11 | H5 | 174.3° | 62.1° |
| C15 | C12 | H6 | H7 | 118.8° | 120.1° |
| C12 | C15 | C14 | H10 | 69.3° | 64.2° |
| C12 | C15 | C14 | H11 | 171.5° | 175.8° |
| C12 | C15 | C16 | H12 | 138.5° | 25.7° |
| C12 | C15 | C16 | H13 | 17.3° | 147.8° |
| C12 | C15 | C23 | H18 | 15.5° | 25.8° |
| C14 | C15 | C12 | C11 | 49.7° | 55.7° |
| C15 | C14 | C13 | H10 | 120.4° | 120.0° |
| C15 | C14 | C13 | H11 | 120.4° | 120.0° |
| C15 | C14 | C13 | N4 | 57.1° | 58.0° |
| C14 | C15 | C12 | H6 | 170.0° | 175.6° |
| C14 | C15 | C12 | H7 | 70.7° | 64.3° |
| C15 | C14 | C13 | H8 | 176.7° | 62.0° |
| C15 | C14 | C13 | H9 | 62.6° | 178.0° |
| C15 | C14 | H10 | H11 | 118.9° | 120.1° |
| C14 | C15 | C16 | H12 | 17.3° | 97.6° |
| C14 | C15 | C16 | H13 | 103.9° | 24.5° |
| C14 | C15 | C23 | H18 | 107.9° | 97.5° |
| C12 | C11 | N4 | H4 | 119.8° | 120.0° |
| C12 | C11 | N4 | H5 | 119.8° | 120.0° |
| C12 | C11 | N4 | C13 | 64.2° | 62.3° |
| C12 | C11 | N4 | C10 | 102.2° | 173.5° |
| C12 | C11 | H4 | H5 | 120.8° | 120.0° |
| C11 | C12 | H6 | H7 | 118.8° | 120.0° |
| C14 | C13 | N4 | C11 | 65.4° | 62.4° |
| C14 | C13 | N4 | H8 | 119.6° | 119.9° |
| C14 | C13 | N4 | H9 | 119.6° | 120.0° |
| C14 | C13 | N4 | C10 | 101.3° | 173.5° |
| C14 | C13 | H8 | H9 | 121.1° | 120.0° |
| C13 | C14 | H10 | H11 | 118.9° | 120.0° |
| C11 | N4 | C13 | C10 | 166.6° | 124.2° |
| C11 | N4 | C10 | C9 | 22.9° | 179.9° |
| C11 | N4 | C10 | N6 | 160.2° | 0.0° |
| N4 | C11 | H4 | H5 | 120.7° | 120.0° |
| N4 | C11 | C12 | H6 | 175.0° | 177.8° |
| N4 | C11 | C12 | H7 | 65.8° | 62.1° |
| C11 | N4 | C13 | H8 | 175.0° | 57.6° |
| C11 | N4 | C13 | H9 | 54.3° | 177.7° |
| C13 | N4 | C10 | C9 | 142.4° | 55.7° |
| C13 | N4 | C10 | N6 | 34.5° | 124.3° |
| C13 | N4 | C11 | H4 | 55.5° | 177.7° |
| C13 | N4 | C11 | H5 | 176.0° | 57.7° |
| N4 | C13 | H8 | H9 | 121.1° | 120.1° |
| N4 | C13 | C14 | H10 | 63.3° | 62.0° |
| N4 | C13 | C14 | H11 | 177.5° | 178.1° |
| N4 | C10 | C9 | N6 | 176.9° | 180.0° |
| N4 | C10 | C9 | N3 | 178.1° | 180.0° |
| N4 | C10 | N6 | C24 | 178.3° | 180.0° |
| C10 | N4 | C11 | H4 | 138.0° | 53.5° |
| C10 | N4 | C11 | H5 | 17.6° | 66.5° |
| C10 | N4 | C13 | H8 | 18.4° | 66.6° |
| C10 | N4 | C13 | H9 | 139.1° | 53.5° |
| N4 | C10 | C9 | H19 | 1.9° | 0.1° |
| C10 | C9 | N3 | H19 | 180.0° | 179.9° |
| C10 | C9 | N3 | C8 | 0.3° | 0.0° |
| C9 | C10 | N6 | C24 | 1.4° | 0.0° |
| N3 | C9 | C10 | N6 | 1.2° | 0.1° |
| C9 | N3 | C8 | C24 | 0.4° | 0.1° |
| C9 | N3 | C8 | C7 | 180.0° | 180.0° |
| C10 | N6 | C24 | C8 | 0.7° | 0.1° |
| C10 | N6 | C24 | N7 | 179.1° | 180.0° |
| N6 | C10 | C9 | H19 | 178.8° | 180.0° |
| N3 | C8 | C24 | N6 | 0.2° | 0.2° |
| N3 | C8 | C24 | C7 | 179.7° | 179.9° |
| N3 | C8 | C24 | N7 | 180.0° | 179.9° |
| N3 | C8 | C7 | N2 | 0.8° | 0.1° |
| N3 | C8 | C7 | N1 | 179.9° | 179.9° |
| C8 | N3 | C9 | H19 | 179.7° | 179.9° |
| N6 | C24 | C8 | N7 | 179.8° | 179.9° |
| N6 | C24 | C8 | C7 | 179.9° | 180.0° |
| N6 | C24 | N7 | N1 | 179.8° | 179.9° |
| C24 | C8 | C7 | N2 | 179.5° | 180.0° |
| C24 | C8 | C7 | N1 | 0.5° | 0.0° |
| C8 | C24 | N7 | N1 | 0.0° | 0.0° |
| C7 | C8 | C24 | N7 | 0.3° | 0.0° |
| C8 | C7 | N2 | N1 | 178.9° | 180.0° |
| C8 | C7 | N1 | N7 | 0.5° | 0.0° |
| C8 | C7 | N1 | C6 | 179.5° | 180.0° |
| C8 | C7 | N2 | H20 | 180.0° | 175.1° |
| C8 | C7 | N2 | H21 | 60.0° | 4.9° |
| C24 | N7 | N1 | C7 | 0.3° | 0.0° |
| C24 | N7 | N1 | C6 | 179.7° | 180.0° |
| N2 | C7 | N1 | N7 | 179.6° | 180.0° |
| N2 | C7 | N1 | C6 | 0.4° | 0.1° |
| C7 | N2 | H20 | H21 | 120.1° | 180.0° |
| C7 | N1 | N7 | C6 | 180.0° | 180.0° |
| C7 | N1 | C6 | C1 | 68.7° | 131.4° |
| C7 | N1 | C6 | C5 | 107.6° | 48.6° |
| N1 | C7 | N2 | H20 | 1.1° | 4.8° |
| N1 | C7 | N2 | H21 | 118.9° | 175.2° |
| N7 | N1 | C6 | C1 | 111.4° | 48.6° |
| N7 | N1 | C6 | C5 | 72.4° | 131.4° |
| CL1 | C1 | C6 | N1 | 3.3° | 0.3° |
| CL1 | C1 | C6 | C2 | 177.7° | 179.7° |
| CL1 | C1 | C6 | C5 | 179.6° | 179.7° |
| CL1 | C1 | C2 | CL2 | 0.9° | 0.3° |
| CL1 | C1 | C2 | C3 | 179.9° | 179.7° |
| N1 | C6 | C1 | C5 | 176.3° | 180.0° |
| N1 | C6 | C1 | C2 | 179.0° | 180.0° |
| N1 | C6 | C5 | C4 | 178.2° | 180.0° |
| N1 | C6 | C5 | H3 | 1.8° | 0.0° |
| C1 | C6 | C5 | C4 | 1.9° | 0.0° |
| C6 | C1 | C2 | CL2 | 178.6° | 180.0° |
| C6 | C1 | C2 | C3 | 2.2° | 0.0° |
| C1 | C6 | C5 | H3 | 178.2° | 180.0° |
| C5 | C6 | C1 | C2 | 2.7° | 0.0° |
| C6 | C5 | C4 | H3 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 0.5° | 0.0° |
| C6 | C5 | C4 | H2 | 179.5° | 180.0° |
| C1 | C2 | CL2 | C3 | 179.2° | 180.0° |
| C1 | C2 | C3 | C4 | 0.8° | 0.0° |
| C1 | C2 | C3 | H1 | 179.2° | 180.0° |
| C5 | C4 | C3 | C2 | 0.0° | 0.0° |
| C5 | C4 | C3 | H2 | 180.0° | 180.0° |
| C5 | C4 | C3 | H1 | 180.0° | 179.9° |
| CL2 | C2 | C3 | C4 | 180.0° | 180.0° |
| CL2 | C2 | C3 | H1 | 0.0° | 0.0° |
| C2 | C3 | C4 | H1 | 180.0° | 180.0° |
| C2 | C3 | C4 | H2 | 180.0° | 180.0° |
| C3 | C4 | C5 | H3 | 179.5° | 180.0° |
| H1 | C3 | C4 | H2 | 0.0° | 0.0° |
| H2 | C4 | C5 | H3 | 0.5° | 0.0° |
| H4 | C11 | C12 | H6 | 55.2° | 62.1° |
| H4 | C11 | C12 | H7 | 174.4° | 57.9° |
| H5 | C11 | C12 | H6 | 65.3° | 57.9° |
| H5 | C11 | C12 | H7 | 53.9° | 177.9° |
| H8 | C13 | C14 | H10 | 56.4° | 178.1° |
| H8 | C13 | C14 | H11 | 62.9° | 58.1° |
| H9 | C13 | C14 | H10 | 177.1° | 58.0° |
| H9 | C13 | C14 | H11 | 57.8° | 62.0° |
| H14 | C18 | C19 | H15 | 0.8° | 0.0° |
| H15 | C19 | C20 | H16 | 0.3° | 0.1° |
| H16 | C20 | C21 | H17 | 0.0° | 0.1° |
| H18 | C23 | N5 | H22 | 58.5° | 60.7° |
| H18 | C23 | N5 | H23 | 61.5° | 175.4° |
