40X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C17 | sing | 1.53Å | 1.53Å | |
| O1 | C15 | doub | 1.22Å | 1.23Å | |
| C21 | C17 | sing | 1.53Å | 1.52Å | |
| C | C1 | sing | 1.53Å | 1.53Å | |
| C17 | C16 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.53Å | 1.54Å | |
| O | C14 | sing | 1.35Å | 1.39Å | |
| O | C3 | sing | 1.43Å | 1.46Å | |
| C13 | C14 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C12 | sing | 1.40Å | 1.41Å | Aromatic |
| C15 | C12 | sing | 1.48Å | 1.50Å | |
| C15 | N1 | sing | 1.35Å | 1.33Å | |
| C16 | C8 | sing | 1.51Å | 1.50Å | |
| C14 | C9 | sing | 1.40Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.52Å | 1.51Å | |
| C12 | C11 | doub | 1.40Å | 1.41Å | Aromatic |
| C3 | C2 | sing | 1.53Å | 1.50Å | |
| C3 | C4 | sing | 1.53Å | 1.53Å | |
| C19 | O2 | doub | 1.21Å | 1.23Å | |
| C19 | C7 | sing | 1.47Å | 1.47Å | |
| C8 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | N | sing | 1.33Å | 1.37Å | Aromatic |
| C1 | C2 | sing | 1.53Å | 1.50Å | |
| C9 | N | sing | 1.40Å | 1.44Å | |
| C9 | C10 | doub | 1.38Å | 1.39Å | Aromatic |
| C7 | C6 | sing | 1.45Å | 1.45Å | Aromatic |
| N | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C11 | CL | sing | 1.74Å | 1.73Å | |
| C6 | C5 | doub | 1.34Å | 1.37Å | Aromatic |
| C6 | C22 | sing | 1.51Å | 1.51Å | |
| C5 | C4 | sing | 1.51Å | 1.46Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.09Å | 1.10Å | |
| C10 | H5 | sing | 1.08Å | 1.08Å | |
| C13 | H6 | sing | 1.08Å | 1.08Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C3 | H20 | sing | 1.09Å | 1.10Å | |
| C2 | H21 | sing | 1.09Å | 1.10Å | |
| C2 | H22 | sing | 1.09Å | 1.10Å | |
| C1 | H23 | sing | 1.09Å | 1.10Å | |
| C1 | H24 | sing | 1.09Å | 1.10Å | |
| C | H25 | sing | 1.09Å | 1.10Å | |
| C | H26 | sing | 1.09Å | 1.10Å | |
| C | H27 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C20 | C17 | C21 | 109.0° | 109.1° |
| C20 | C17 | C16 | 109.8° | 109.2° |
| C20 | C17 | C18 | 110.3° | 109.2° |
| C17 | C20 | H7 | 109.5° | 109.5° |
| C17 | C20 | H8 | 109.5° | 109.5° |
| C17 | C20 | H9 | 109.5° | 109.5° |
| O1 | C15 | C12 | 119.8° | 120.0° |
| O1 | C15 | N1 | 121.5° | 120.0° |
| C21 | C17 | C16 | 109.1° | 109.2° |
| C21 | C17 | C18 | 109.8° | 109.2° |
| C17 | C21 | H10 | 109.5° | 109.5° |
| C17 | C21 | H11 | 109.5° | 109.5° |
| C17 | C21 | H12 | 109.5° | 109.4° |
| C | C1 | C2 | 113.5° | 109.5° |
| C | C1 | H23 | 108.5° | 109.5° |
| C | C1 | H24 | 108.5° | 109.5° |
| C1 | C | H25 | 109.5° | 109.5° |
| C1 | C | H26 | 109.5° | 109.5° |
| C1 | C | H27 | 109.5° | 109.5° |
| C16 | C17 | C18 | 108.8° | 110.8° |
| C17 | C16 | C8 | 113.9° | 109.2° |
| C17 | C16 | H18 | 108.4° | 109.5° |
| C17 | C16 | H19 | 108.4° | 109.5° |
| C17 | C18 | C19 | 116.0° | 108.4° |
| C17 | C18 | H16 | 107.8° | 109.7° |
| C17 | C18 | H17 | 107.8° | 109.7° |
| C14 | O | C3 | 116.0° | 120.4° |
| O | C14 | C13 | 118.7° | 121.3° |
| O | C14 | C9 | 120.0° | 118.9° |
| O | C3 | C2 | 112.0° | 109.4° |
| O | C3 | C4 | 120.0° | 109.7° |
| O | C3 | H20 | 101.2° | 109.4° |
| C14 | C13 | C12 | 119.2° | 119.8° |
| C13 | C14 | C9 | 121.1° | 119.8° |
| C14 | C13 | H6 | 120.4° | 120.1° |
| C13 | C12 | C15 | 117.1° | 120.0° |
| C13 | C12 | C11 | 118.6° | 120.0° |
| C12 | C13 | H6 | 120.4° | 120.1° |
| C12 | C15 | N1 | 118.8° | 120.0° |
| C15 | C12 | C11 | 124.2° | 120.0° |
| C15 | N1 | H1 | 120.0° | 120.0° |
| C15 | N1 | H2 | 120.0° | 120.0° |
| C16 | C8 | C7 | 126.4° | 122.6° |
| C16 | C8 | N | 125.9° | 129.8° |
| C8 | C16 | H18 | 108.3° | 109.5° |
| C8 | C16 | H19 | 108.3° | 109.6° |
| C14 | C9 | N | 120.8° | 117.7° |
| C14 | C9 | C10 | 119.7° | 120.6° |
| C18 | C19 | O2 | 119.5° | 122.4° |
| C18 | C19 | C7 | 119.0° | 115.1° |
| C19 | C18 | H16 | 107.8° | 109.6° |
| C19 | C18 | H17 | 107.8° | 109.7° |
| C12 | C11 | C10 | 121.8° | 120.0° |
| C12 | C11 | CL | 122.2° | 120.0° |
| C2 | C3 | C4 | 117.4° | 109.5° |
| C3 | C2 | C1 | 112.9° | 109.5° |
| C2 | C3 | H20 | 100.9° | 109.4° |
| C3 | C2 | H21 | 108.6° | 109.5° |
| C3 | C2 | H22 | 108.6° | 109.5° |
| C3 | C4 | C5 | 110.6° | 109.4° |
| C3 | C4 | H3 | 109.2° | 109.4° |
| C3 | C4 | H4 | 109.2° | 109.5° |
| C4 | C3 | H20 | 100.7° | 109.4° |
| O2 | C19 | C7 | 121.5° | 122.4° |
| C19 | C7 | C8 | 116.9° | 122.0° |
| C19 | C7 | C6 | 135.5° | 131.1° |
| C7 | C8 | N | 107.7° | 107.6° |
| C8 | C7 | C6 | 107.6° | 106.9° |
| C8 | N | C9 | 130.1° | 128.8° |
| C8 | N | C5 | 109.2° | 110.3° |
| C1 | C2 | H21 | 108.6° | 109.5° |
| C1 | C2 | H22 | 108.6° | 109.4° |
| C2 | C1 | H23 | 108.4° | 109.5° |
| C2 | C1 | H24 | 108.4° | 109.5° |
| N | C9 | C10 | 119.4° | 121.7° |
| C9 | N | C5 | 120.6° | 120.9° |
| C9 | C10 | C11 | 119.4° | 119.8° |
| C9 | C10 | H5 | 120.3° | 120.1° |
| C7 | C6 | C5 | 106.2° | 106.0° |
| C7 | C6 | C22 | 124.6° | 127.0° |
| N | C5 | C6 | 109.3° | 109.2° |
| N | C5 | C4 | 127.3° | 123.4° |
| C10 | C11 | CL | 115.9° | 120.0° |
| C11 | C10 | H5 | 120.3° | 120.1° |
| C5 | C6 | C22 | 129.2° | 127.0° |
| C6 | C5 | C4 | 123.3° | 127.4° |
| C6 | C22 | H13 | 109.5° | 109.5° |
| C6 | C22 | H14 | 109.4° | 109.5° |
| C6 | C22 | H15 | 109.5° | 109.5° |
| C5 | C4 | H3 | 109.2° | 109.5° |
| C5 | C4 | H4 | 109.2° | 109.5° |
| H1 | N1 | H2 | 120.0° | 120.0° |
| H3 | C4 | H4 | 109.5° | 109.5° |
| H7 | C20 | H8 | 109.4° | 109.4° |
| H7 | C20 | H9 | 109.4° | 109.5° |
| H8 | C20 | H9 | 109.5° | 109.4° |
| H10 | C21 | H11 | 109.5° | 109.5° |
| H10 | C21 | H12 | 109.4° | 109.5° |
| H11 | C21 | H12 | 109.5° | 109.4° |
| H13 | C22 | H14 | 109.5° | 109.5° |
| H13 | C22 | H15 | 109.5° | 109.5° |
| H14 | C22 | H15 | 109.5° | 109.4° |
| H16 | C18 | H17 | 109.5° | 109.7° |
| H18 | C16 | H19 | 109.4° | 109.6° |
| H21 | C2 | H22 | 109.5° | 109.4° |
| H23 | C1 | H24 | 109.5° | 109.4° |
| H25 | C | H26 | 109.4° | 109.5° |
| H25 | C | H27 | 109.5° | 109.5° |
| H26 | C | H27 | 109.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C20 | C17 | C21 | C16 | 119.9° | 119.4° |
| C20 | C17 | C21 | C18 | 120.9° | 119.4° |
| C20 | C17 | C16 | C18 | 120.8° | 120.4° |
| C20 | C17 | C16 | C8 | 77.7° | 67.5° |
| C20 | C17 | C18 | C19 | 71.3° | 55.7° |
| C17 | C20 | H7 | H8 | 120.0° | 120.0° |
| C17 | C20 | H7 | H9 | 120.0° | 120.0° |
| C17 | C20 | H8 | H9 | 120.0° | 120.1° |
| C20 | C17 | C21 | H10 | 180.0° | 59.4° |
| C20 | C17 | C21 | H11 | 60.0° | 60.7° |
| C20 | C17 | C21 | H12 | 60.0° | 179.4° |
| C20 | C17 | C18 | H16 | 167.7° | 175.3° |
| C20 | C17 | C18 | H17 | 49.6° | 64.1° |
| C20 | C17 | C16 | H18 | 43.0° | 172.7° |
| C20 | C17 | C16 | H19 | 161.6° | 52.5° |
| O1 | C15 | C12 | C13 | 39.1° | 179.9° |
| O1 | C15 | C12 | N1 | 178.8° | 179.9° |
| O1 | C15 | C12 | C11 | 138.7° | 0.0° |
| O1 | C15 | N1 | H1 | 0.0° | 180.0° |
| O1 | C15 | N1 | H2 | 180.0° | 0.4° |
| C21 | C17 | C16 | C18 | 119.8° | 120.3° |
| C21 | C17 | C16 | C8 | 162.9° | 173.2° |
| C21 | C17 | C18 | C19 | 168.5° | 175.0° |
| C21 | C17 | C20 | H7 | 180.0° | 179.4° |
| C21 | C17 | C20 | H8 | 60.0° | 60.6° |
| C21 | C17 | C20 | H9 | 60.0° | 59.4° |
| C17 | C21 | H10 | H11 | 120.0° | 120.0° |
| C17 | C21 | H10 | H12 | 120.0° | 120.0° |
| C17 | C21 | H11 | H12 | 120.0° | 119.9° |
| C21 | C17 | C18 | H16 | 47.5° | 65.4° |
| C21 | C17 | C18 | H17 | 70.5° | 55.2° |
| C21 | C17 | C16 | H18 | 76.5° | 53.3° |
| C21 | C17 | C16 | H19 | 42.2° | 66.8° |
| C | C1 | C2 | C3 | 67.1° | 180.0° |
| C | C1 | C2 | H23 | 120.6° | 120.0° |
| C | C1 | C2 | H24 | 120.6° | 120.0° |
| C | C1 | C2 | H21 | 53.4° | 60.0° |
| C | C1 | C2 | H22 | 172.4° | 60.0° |
| C | C1 | H23 | H24 | 118.2° | 120.0° |
| C1 | C | H25 | H26 | 120.0° | 120.1° |
| C1 | C | H25 | H27 | 120.0° | 120.0° |
| C1 | C | H26 | H27 | 120.0° | 120.0° |
| C17 | C16 | C8 | H18 | 120.7° | 119.9° |
| C17 | C16 | C8 | H19 | 120.7° | 120.0° |
| C16 | C17 | C18 | C19 | 49.2° | 64.7° |
| C17 | C16 | C8 | C7 | 20.5° | 20.7° |
| C17 | C16 | C8 | N | 157.3° | 159.0° |
| C16 | C17 | C20 | H7 | 60.5° | 60.0° |
| C16 | C17 | C20 | H8 | 179.5° | 180.0° |
| C16 | C17 | C20 | H9 | 59.4° | 60.0° |
| C16 | C17 | C21 | H10 | 60.1° | 60.0° |
| C16 | C17 | C21 | H11 | 59.9° | 180.0° |
| C16 | C17 | C21 | H12 | 179.9° | 60.1° |
| C16 | C17 | C18 | H16 | 71.8° | 55.0° |
| C16 | C17 | C18 | H17 | 170.1° | 175.6° |
| C17 | C16 | H18 | H19 | 118.0° | 120.1° |
| C18 | C17 | C16 | C8 | 43.1° | 52.9° |
| C17 | C18 | C19 | H16 | 121.0° | 119.7° |
| C17 | C18 | C19 | H17 | 120.9° | 119.8° |
| C17 | C18 | C19 | O2 | 148.8° | 137.7° |
| C17 | C18 | C19 | C7 | 30.7° | 42.3° |
| C18 | C17 | C20 | H7 | 59.4° | 61.3° |
| C18 | C17 | C20 | H8 | 60.6° | 58.7° |
| C18 | C17 | C20 | H9 | 179.4° | 178.7° |
| C18 | C17 | C21 | H10 | 59.1° | 178.7° |
| C18 | C17 | C21 | H11 | 179.1° | 58.7° |
| C18 | C17 | C21 | H12 | 60.9° | 61.2° |
| C17 | C18 | H16 | H17 | 117.0° | 120.6° |
| C18 | C17 | C16 | H18 | 163.8° | 67.0° |
| C18 | C17 | C16 | H19 | 77.5° | 172.9° |
| O | C14 | C13 | C9 | 175.4° | 176.6° |
| O | C14 | C13 | C12 | 172.9° | 174.8° |
| C14 | O | C3 | C2 | 96.0° | 75.7° |
| C14 | O | C3 | C4 | 47.8° | 44.4° |
| O | C14 | C9 | N | 0.8° | 6.4° |
| O | C14 | C9 | C10 | 175.5° | 174.1° |
| O | C14 | C13 | H6 | 7.1° | 5.1° |
| C14 | O | C3 | H20 | 157.3° | 164.4° |
| C3 | O | C14 | C13 | 115.0° | 102.5° |
| C3 | O | C14 | C9 | 69.6° | 80.9° |
| O | C3 | C2 | C4 | 144.8° | 120.2° |
| O | C3 | C2 | H20 | 106.9° | 119.9° |
| O | C3 | C4 | H20 | 109.8° | 120.0° |
| O | C3 | C2 | C1 | 129.4° | 65.0° |
| O | C3 | C4 | C5 | 29.4° | 42.2° |
| O | C3 | C4 | H3 | 149.6° | 77.8° |
| O | C3 | C4 | H4 | 90.8° | 162.2° |
| O | C3 | C2 | H21 | 8.9° | 55.1° |
| O | C3 | C2 | H22 | 110.1° | 175.0° |
| C14 | C13 | C12 | H6 | 180.0° | 179.9° |
| C14 | C13 | C12 | C15 | 175.8° | 179.9° |
| C14 | C13 | C12 | C11 | 2.2° | 0.1° |
| C13 | C14 | C9 | N | 176.2° | 176.9° |
| C13 | C14 | C9 | C10 | 0.2° | 2.6° |
| C13 | C12 | C15 | C11 | 177.9° | 180.0° |
| C13 | C12 | C15 | N1 | 139.6° | 0.0° |
| C12 | C13 | C14 | C9 | 2.5° | 1.8° |
| C13 | C12 | C11 | C10 | 0.6° | 0.8° |
| C13 | C12 | C11 | CL | 175.3° | 179.1° |
| C15 | C12 | C11 | C10 | 178.5° | 179.2° |
| C15 | C12 | C11 | CL | 2.6° | 0.9° |
| C12 | C15 | N1 | H1 | 178.7° | 0.1° |
| C12 | C15 | N1 | H2 | 1.2° | 179.7° |
| C15 | C12 | C13 | H6 | 4.3° | 0.0° |
| N1 | C15 | C12 | C11 | 42.5° | 180.0° |
| C15 | N1 | H1 | H2 | 180.0° | 179.6° |
| C16 | C8 | C7 | C19 | 0.8° | 0.1° |
| C16 | C8 | C7 | N | 178.1° | 179.8° |
| C16 | C8 | N | C9 | 2.1° | 0.4° |
| C16 | C8 | C7 | C6 | 177.2° | 179.9° |
| C16 | C8 | N | C5 | 177.9° | 179.9° |
| C8 | C16 | H18 | H19 | 117.9° | 120.2° |
| C14 | C9 | N | C8 | 128.4° | 135.1° |
| C14 | C9 | N | C10 | 176.3° | 179.5° |
| C14 | C9 | N | C5 | 46.9° | 44.5° |
| C14 | C9 | C10 | C11 | 3.0° | 1.6° |
| C14 | C9 | C10 | H5 | 177.0° | 178.4° |
| C9 | C14 | C13 | H6 | 177.5° | 178.3° |
| C18 | C19 | O2 | C7 | 179.4° | 179.9° |
| C18 | C19 | C7 | C8 | 4.1° | 11.2° |
| C18 | C19 | C7 | C6 | 178.5° | 168.8° |
| C19 | C18 | H16 | H17 | 117.0° | 120.5° |
| C12 | C11 | C10 | C9 | 3.3° | 0.1° |
| C12 | C11 | C10 | CL | 176.1° | 179.9° |
| C12 | C11 | C10 | H5 | 176.8° | 179.9° |
| C11 | C12 | C13 | H6 | 177.7° | 179.9° |
| C2 | C3 | C4 | H20 | 108.4° | 119.9° |
| C3 | C2 | C1 | H21 | 120.5° | 120.0° |
| C3 | C2 | C1 | H22 | 120.5° | 120.0° |
| C2 | C3 | C4 | C5 | 171.3° | 162.3° |
| C2 | C3 | C4 | H3 | 68.5° | 42.3° |
| C2 | C3 | C4 | H4 | 51.1° | 77.7° |
| C3 | C2 | H21 | H22 | 118.4° | 120.0° |
| C3 | C2 | C1 | H23 | 53.5° | 60.0° |
| C3 | C2 | C1 | H24 | 172.3° | 60.0° |
| C4 | C3 | C2 | C1 | 85.8° | 174.8° |
| C3 | C4 | C5 | N | 58.1° | 69.4° |
| C3 | C4 | C5 | C6 | 117.6° | 110.6° |
| C3 | C4 | C5 | H3 | 120.2° | 120.0° |
| C3 | C4 | C5 | H4 | 120.2° | 120.0° |
| C3 | C4 | H3 | H4 | 119.4° | 120.0° |
| C4 | C3 | C2 | H21 | 153.7° | 65.2° |
| C4 | C3 | C2 | H22 | 34.7° | 54.8° |
| O2 | C19 | C7 | C8 | 175.4° | 168.7° |
| O2 | C19 | C7 | C6 | 2.0° | 11.3° |
| O2 | C19 | C18 | H16 | 90.2° | 102.6° |
| O2 | C19 | C18 | H17 | 27.8° | 17.9° |
| C19 | C7 | C8 | C6 | 178.1° | 180.0° |
| C19 | C7 | C8 | N | 179.0° | 180.0° |
| C19 | C7 | C6 | C5 | 178.7° | 180.0° |
| C19 | C7 | C6 | C22 | 2.0° | 0.1° |
| C7 | C19 | C18 | H16 | 90.3° | 77.4° |
| C7 | C19 | C18 | H17 | 151.6° | 162.1° |
| C7 | C8 | N | C9 | 176.0° | 179.4° |
| C7 | C8 | N | C5 | 0.2° | 0.1° |
| C8 | C7 | C6 | C5 | 1.2° | 0.0° |
| C8 | C7 | C6 | C22 | 175.6° | 179.9° |
| C7 | C8 | C16 | H18 | 141.2° | 99.1° |
| C7 | C8 | C16 | H19 | 100.2° | 140.7° |
| C8 | N | C9 | C5 | 175.4° | 179.5° |
| C8 | N | C9 | C10 | 47.9° | 45.4° |
| N | C8 | C7 | C6 | 0.9° | 0.1° |
| C8 | N | C5 | C6 | 0.5° | 0.1° |
| C8 | N | C5 | C4 | 176.7° | 179.8° |
| N | C8 | C16 | H18 | 36.6° | 81.1° |
| N | C8 | C16 | H19 | 82.0° | 39.1° |
| C1 | C2 | C3 | H20 | 22.5° | 54.9° |
| C1 | C2 | H21 | H22 | 118.4° | 119.9° |
| C2 | C1 | H23 | H24 | 118.2° | 120.0° |
| C2 | C1 | C | H25 | 180.0° | 60.0° |
| C2 | C1 | C | H26 | 60.0° | 60.1° |
| C2 | C1 | C | H27 | 60.0° | 180.0° |
| N | C9 | C10 | C11 | 173.4° | 177.9° |
| C9 | N | C5 | C6 | 175.8° | 179.5° |
| C9 | N | C5 | C4 | 0.5° | 0.6° |
| N | C9 | C10 | H5 | 6.6° | 2.1° |
| C10 | C9 | N | C5 | 136.7° | 135.1° |
| C9 | C10 | C11 | H5 | 180.0° | 180.0° |
| C9 | C10 | C11 | CL | 172.9° | 179.8° |
| C7 | C6 | C5 | N | 1.0° | 0.1° |
| C7 | C6 | C5 | C22 | 176.6° | 180.0° |
| C7 | C6 | C5 | C4 | 177.4° | 179.9° |
| C7 | C6 | C22 | H13 | 88.2° | 90.0° |
| C7 | C6 | C22 | H14 | 151.8° | 30.0° |
| C7 | C6 | C22 | H15 | 31.9° | 149.9° |
| N | C5 | C6 | C4 | 176.4° | 180.0° |
| N | C5 | C6 | C22 | 175.6° | 179.8° |
| N | C5 | C4 | H3 | 178.3° | 50.6° |
| N | C5 | C4 | H4 | 62.0° | 170.6° |
| CL | C11 | C10 | H5 | 7.1° | 0.1° |
| C6 | C5 | C4 | H3 | 2.6° | 129.4° |
| C6 | C5 | C4 | H4 | 122.2° | 9.4° |
| C5 | C6 | C22 | H13 | 87.8° | 90.0° |
| C5 | C6 | C22 | H14 | 32.2° | 150.0° |
| C5 | C6 | C22 | H15 | 152.1° | 30.0° |
| C22 | C6 | C5 | C4 | 0.9° | 0.2° |
| C6 | C22 | H13 | H14 | 120.0° | 120.0° |
| C6 | C22 | H13 | H15 | 120.0° | 120.0° |
| C6 | C22 | H14 | H15 | 120.0° | 120.0° |
| C5 | C4 | H3 | H4 | 119.5° | 120.0° |
| C5 | C4 | C3 | H20 | 80.4° | 77.8° |
| H3 | C4 | C3 | H20 | 39.8° | 162.2° |
| H4 | C4 | C3 | H20 | 159.5° | 42.2° |
| H7 | C20 | H8 | H9 | 119.9° | 119.9° |
| H10 | C21 | H11 | H12 | 120.0° | 120.0° |
| H13 | C22 | H14 | H15 | 120.0° | 120.0° |
| H20 | C3 | C2 | H21 | 98.0° | 174.9° |
| H20 | C3 | C2 | H22 | 143.0° | 65.1° |
| H21 | C2 | C1 | H23 | 174.0° | 180.0° |
| H21 | C2 | C1 | H24 | 67.2° | 60.1° |
| H22 | C2 | C1 | H23 | 67.0° | 60.0° |
| H22 | C2 | C1 | H24 | 51.8° | 180.0° |
| H23 | C1 | C | H25 | 59.4° | 180.0° |
| H23 | C1 | C | H26 | 60.6° | 59.9° |
| H23 | C1 | C | H27 | 179.4° | 60.0° |
| H24 | C1 | C | H25 | 59.4° | 60.0° |
| H24 | C1 | C | H26 | 179.4° | 179.9° |
| H24 | C1 | C | H27 | 60.6° | 60.0° |
| H25 | C | H26 | H27 | 120.0° | 120.0° |
