WB7
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | S1 | doub | 1.42Å | 1.42Å | |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C19 | C17 | sing | 1.38Å | 1.40Å | Aromatic |
| C18 | S1 | sing | 1.81Å | 1.69Å | |
| S1 | C17 | sing | 1.76Å | 1.66Å | |
| S1 | O2 | doub | 1.42Å | 1.42Å | |
| C20 | C14 | sing | 1.38Å | 1.40Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.51Å | 1.51Å | |
| C14 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | N1 | sing | 1.46Å | 1.46Å | |
| O1 | C12 | doub | 1.22Å | 1.23Å | |
| N1 | C12 | sing | 1.35Å | 1.39Å | |
| C12 | C10 | sing | 1.47Å | 1.46Å | |
| C10 | S | sing | 1.76Å | 1.69Å | Aromatic |
| C10 | C11 | doub | 1.36Å | 1.37Å | Aromatic |
| S | C9 | sing | 1.71Å | 1.68Å | Aromatic |
| C11 | C8 | sing | 1.38Å | 1.42Å | Aromatic |
| CL | C | sing | 1.74Å | 1.73Å | |
| C9 | C8 | doub | 1.36Å | 1.37Å | Aromatic |
| C9 | C5 | sing | 1.51Å | 1.49Å | |
| C4 | C5 | sing | 1.53Å | 1.54Å | |
| C4 | C3 | sing | 1.53Å | 1.52Å | |
| C8 | C7 | sing | 1.52Å | 1.48Å | |
| C5 | C21 | sing | 1.53Å | 1.54Å | |
| C5 | O | sing | 1.43Å | 1.42Å | |
| C3 | N | sing | 1.47Å | 1.47Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| N | C2 | sing | 1.47Å | 1.45Å | |
| N | C22 | sing | 1.47Å | 1.48Å | |
| C | C26 | doub | 1.38Å | 1.38Å | Aromatic |
| C | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.50Å | |
| C7 | C6 | sing | 1.53Å | 1.53Å | |
| C26 | C25 | sing | 1.38Å | 1.39Å | Aromatic |
| O | C6 | sing | 1.43Å | 1.44Å | |
| C1 | C23 | doub | 1.38Å | 1.40Å | Aromatic |
| C25 | C24 | doub | 1.38Å | 1.39Å | Aromatic |
| C23 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | H1 | sing | 1.09Å | 1.10Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| N1 | H5 | sing | 0.97Å | 1.00Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| C3 | H9 | sing | 1.09Å | 1.10Å | |
| C2 | H10 | sing | 1.09Å | 1.10Å | |
| C2 | H11 | sing | 1.09Å | 1.10Å | |
| C18 | H12 | sing | 1.09Å | 1.10Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.08Å | 1.08Å | |
| C15 | H16 | sing | 1.08Å | 1.08Å | |
| C19 | H17 | sing | 1.08Å | 1.08Å | |
| C20 | H18 | sing | 1.08Å | 1.08Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.08Å | 1.08Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H27 | sing | 1.08Å | 1.08Å | |
| C24 | H28 | sing | 1.08Å | 1.08Å | |
| C25 | H29 | sing | 1.08Å | 1.08Å | |
| C26 | H30 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | S1 | C18 | 106.8° | 110.5° |
| O3 | S1 | C17 | 110.4° | 104.3° |
| O3 | S1 | O2 | 119.9° | 121.0° |
| C20 | C19 | C17 | 123.0° | 120.0° |
| C19 | C20 | C14 | 119.4° | 120.0° |
| C20 | C19 | H17 | 118.5° | 120.0° |
| C19 | C20 | H18 | 120.3° | 120.0° |
| C19 | C17 | S1 | 122.1° | 120.0° |
| C19 | C17 | C16 | 116.1° | 120.0° |
| C17 | C19 | H17 | 118.5° | 120.0° |
| C18 | S1 | C17 | 98.6° | 104.4° |
| C18 | S1 | O2 | 107.0° | 110.5° |
| S1 | C18 | H12 | 109.5° | 109.5° |
| S1 | C18 | H13 | 109.4° | 109.4° |
| S1 | C18 | H14 | 109.5° | 109.5° |
| C17 | S1 | O2 | 111.8° | 104.3° |
| S1 | C17 | C16 | 121.7° | 120.0° |
| C20 | C14 | C13 | 122.1° | 120.0° |
| C20 | C14 | C15 | 118.7° | 120.0° |
| C14 | C20 | H18 | 120.3° | 120.0° |
| C17 | C16 | C15 | 122.0° | 120.0° |
| C17 | C16 | H15 | 119.0° | 120.0° |
| C13 | C14 | C15 | 119.1° | 120.0° |
| C14 | C13 | N1 | 109.2° | 109.5° |
| C14 | C13 | H19 | 109.5° | 109.5° |
| C14 | C13 | H20 | 109.5° | 109.5° |
| C14 | C15 | C16 | 120.7° | 120.0° |
| C14 | C15 | H16 | 119.6° | 120.0° |
| C15 | C16 | H15 | 119.1° | 119.9° |
| C16 | C15 | H16 | 119.6° | 120.1° |
| C13 | N1 | C12 | 121.8° | 120.0° |
| C13 | N1 | H5 | 119.1° | 120.0° |
| N1 | C13 | H19 | 109.5° | 109.4° |
| N1 | C13 | H20 | 109.5° | 109.5° |
| O1 | C12 | N1 | 122.1° | 120.0° |
| O1 | C12 | C10 | 121.4° | 120.0° |
| N1 | C12 | C10 | 116.4° | 120.0° |
| C12 | N1 | H5 | 119.1° | 120.0° |
| C12 | C10 | S | 117.3° | 125.4° |
| C12 | C10 | C11 | 129.4° | 125.4° |
| S | C10 | C11 | 113.1° | 109.2° |
| C10 | S | C9 | 91.8° | 91.7° |
| C10 | C11 | C8 | 110.5° | 114.0° |
| C10 | C11 | H21 | 124.7° | 123.0° |
| S | C9 | C8 | 112.5° | 111.1° |
| S | C9 | C5 | 125.0° | 125.6° |
| C11 | C8 | C9 | 112.1° | 114.0° |
| C11 | C8 | C7 | 124.7° | 124.3° |
| C8 | C11 | H21 | 124.7° | 123.0° |
| CL | C | C26 | 118.3° | 120.1° |
| CL | C | C1 | 119.4° | 120.0° |
| C8 | C9 | C5 | 122.3° | 123.3° |
| C9 | C8 | C7 | 123.0° | 121.7° |
| C9 | C5 | C4 | 109.0° | 109.5° |
| C9 | C5 | C21 | 115.2° | 109.4° |
| C9 | C5 | O | 111.0° | 108.6° |
| C5 | C4 | C3 | 111.5° | 109.4° |
| C4 | C5 | C21 | 108.1° | 109.6° |
| C4 | C5 | O | 102.8° | 109.9° |
| C5 | C4 | H6 | 109.0° | 109.5° |
| C5 | C4 | H7 | 109.0° | 109.5° |
| C4 | C3 | N | 111.5° | 109.5° |
| C3 | C4 | H6 | 108.9° | 109.5° |
| C3 | C4 | H7 | 109.0° | 109.5° |
| C4 | C3 | H8 | 109.0° | 109.5° |
| C4 | C3 | H9 | 109.0° | 109.5° |
| C8 | C7 | C6 | 109.6° | 108.1° |
| C8 | C7 | H1 | 109.5° | 109.7° |
| C8 | C7 | H2 | 109.4° | 109.8° |
| C21 | C5 | O | 109.9° | 109.8° |
| C5 | C21 | C22 | 107.9° | 109.3° |
| C5 | C21 | H22 | 109.9° | 109.5° |
| C5 | C21 | H23 | 109.8° | 109.5° |
| C5 | O | C6 | 117.2° | 113.8° |
| C3 | N | C2 | 124.6° | 111.0° |
| C3 | N | C22 | 112.4° | 111.3° |
| N | C3 | H8 | 108.9° | 109.5° |
| N | C3 | H9 | 109.0° | 109.4° |
| C21 | C22 | N | 111.7° | 109.4° |
| C22 | C21 | H22 | 109.8° | 109.5° |
| C22 | C21 | H23 | 109.9° | 109.5° |
| C21 | C22 | H24 | 108.9° | 109.4° |
| C21 | C22 | H25 | 108.9° | 109.5° |
| C2 | N | C22 | 121.7° | 111.0° |
| N | C2 | C1 | 116.7° | 109.4° |
| N | C2 | H10 | 107.6° | 109.5° |
| N | C2 | H11 | 107.6° | 109.5° |
| N | C22 | H24 | 108.9° | 109.5° |
| N | C22 | H25 | 108.9° | 109.5° |
| C26 | C | C1 | 122.2° | 119.9° |
| C | C26 | C25 | 117.7° | 120.1° |
| C | C26 | H30 | 121.2° | 120.0° |
| C | C1 | C2 | 119.4° | 120.0° |
| C | C1 | C23 | 119.0° | 120.0° |
| C2 | C1 | C23 | 121.7° | 120.0° |
| C1 | C2 | H10 | 107.6° | 109.4° |
| C1 | C2 | H11 | 107.7° | 109.5° |
| C7 | C6 | O | 110.7° | 109.5° |
| C6 | C7 | H1 | 109.4° | 109.8° |
| C6 | C7 | H2 | 109.5° | 109.7° |
| C7 | C6 | H3 | 109.2° | 109.4° |
| C7 | C6 | H4 | 109.2° | 109.4° |
| C26 | C25 | C24 | 121.7° | 120.0° |
| C26 | C25 | H29 | 119.2° | 120.0° |
| C25 | C26 | H30 | 121.2° | 120.0° |
| O | C6 | H3 | 109.1° | 109.5° |
| O | C6 | H4 | 109.2° | 109.5° |
| C1 | C23 | C24 | 120.1° | 120.1° |
| C1 | C23 | H27 | 119.9° | 119.9° |
| C25 | C24 | C23 | 119.2° | 120.0° |
| C25 | C24 | H28 | 120.4° | 120.0° |
| C24 | C25 | H29 | 119.1° | 120.0° |
| C24 | C23 | H27 | 119.9° | 120.0° |
| C23 | C24 | H28 | 120.4° | 120.0° |
| H1 | C7 | H2 | 109.5° | 109.7° |
| H3 | C6 | H4 | 109.5° | 109.5° |
| H6 | C4 | H7 | 109.5° | 109.5° |
| H8 | C3 | H9 | 109.5° | 109.5° |
| H10 | C2 | H11 | 109.5° | 109.5° |
| H12 | C18 | H13 | 109.5° | 109.5° |
| H12 | C18 | H14 | 109.5° | 109.5° |
| H13 | C18 | H14 | 109.5° | 109.5° |
| H19 | C13 | H20 | 109.5° | 109.5° |
| H22 | C21 | H23 | 109.5° | 109.5° |
| H24 | C22 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | S1 | C17 | C19 | 28.5° | 25.8° |
| O3 | S1 | C18 | C17 | 114.4° | 111.6° |
| O3 | S1 | C18 | O2 | 129.5° | 136.7° |
| O3 | S1 | C17 | O2 | 136.1° | 127.9° |
| O3 | S1 | C17 | C16 | 151.5° | 154.0° |
| O3 | S1 | C18 | H12 | 180.0° | 68.4° |
| O3 | S1 | C18 | H13 | 60.0° | 171.6° |
| O3 | S1 | C18 | H14 | 60.0° | 51.6° |
| C20 | C19 | C17 | H17 | 180.0° | 180.0° |
| C20 | C19 | C17 | S1 | 179.8° | 180.0° |
| C19 | C20 | C14 | H18 | 180.0° | 180.0° |
| C20 | C19 | C17 | C16 | 0.2° | 0.3° |
| C19 | C20 | C14 | C13 | 175.9° | 180.0° |
| C19 | C20 | C14 | C15 | 1.3° | 0.3° |
| C19 | C17 | S1 | C18 | 83.1° | 90.3° |
| C19 | C17 | S1 | C16 | 180.0° | 179.7° |
| C19 | C17 | S1 | O2 | 164.6° | 153.6° |
| C17 | C19 | C20 | C14 | 0.6° | 0.0° |
| C19 | C17 | C16 | C15 | 0.2° | 0.2° |
| C19 | C17 | C16 | H15 | 179.9° | 179.7° |
| C17 | C19 | C20 | H18 | 179.4° | 180.0° |
| C18 | S1 | C17 | O2 | 112.3° | 116.1° |
| C18 | S1 | C17 | C16 | 96.9° | 90.0° |
| S1 | C18 | H12 | H13 | 120.0° | 120.0° |
| S1 | C18 | H12 | H14 | 120.0° | 120.0° |
| S1 | C18 | H13 | H14 | 120.0° | 120.0° |
| S1 | C17 | C16 | C15 | 179.8° | 180.0° |
| C17 | S1 | C18 | H12 | 65.6° | 180.0° |
| C17 | S1 | C18 | H13 | 54.4° | 60.0° |
| C17 | S1 | C18 | H14 | 174.4° | 60.0° |
| S1 | C17 | C16 | H15 | 0.2° | 0.0° |
| S1 | C17 | C19 | H17 | 0.2° | 0.0° |
| O2 | S1 | C17 | C16 | 15.4° | 26.1° |
| O2 | S1 | C18 | H12 | 50.5° | 68.3° |
| O2 | S1 | C18 | H13 | 170.5° | 51.6° |
| O2 | S1 | C18 | H14 | 69.6° | 171.7° |
| C20 | C14 | C13 | C15 | 177.2° | 179.7° |
| C20 | C14 | C15 | C16 | 1.4° | 0.4° |
| C20 | C14 | C13 | N1 | 140.2° | 90.0° |
| C20 | C14 | C15 | H16 | 178.6° | 179.7° |
| C14 | C20 | C19 | H17 | 179.4° | 180.0° |
| C20 | C14 | C13 | H19 | 99.9° | 30.0° |
| C20 | C14 | C13 | H20 | 20.2° | 150.0° |
| C17 | C16 | C15 | C14 | 0.6° | 0.1° |
| C17 | C16 | C15 | H15 | 180.0° | 180.0° |
| C17 | C16 | C15 | H16 | 179.4° | 180.0° |
| C16 | C17 | C19 | H17 | 179.8° | 179.7° |
| C13 | C14 | C15 | C16 | 176.0° | 179.9° |
| C14 | C13 | N1 | H19 | 119.9° | 120.0° |
| C14 | C13 | N1 | H20 | 119.9° | 120.0° |
| C14 | C13 | N1 | C12 | 82.9° | 180.0° |
| C14 | C13 | N1 | H5 | 97.0° | 0.1° |
| C13 | C14 | C15 | H16 | 4.1° | 0.0° |
| C13 | C14 | C20 | H18 | 4.1° | 0.0° |
| C14 | C13 | H19 | H20 | 120.1° | 120.0° |
| C14 | C15 | C16 | H16 | 180.0° | 179.9° |
| C15 | C14 | C13 | N1 | 37.1° | 90.3° |
| C14 | C15 | C16 | H15 | 179.4° | 179.9° |
| C15 | C14 | C20 | H18 | 178.7° | 179.7° |
| C15 | C14 | C13 | H19 | 82.9° | 149.7° |
| C15 | C14 | C13 | H20 | 157.0° | 29.7° |
| C13 | N1 | C12 | O1 | 7.3° | 0.0° |
| C13 | N1 | C12 | H5 | 180.0° | 179.9° |
| C13 | N1 | C12 | C10 | 174.4° | 180.0° |
| N1 | C13 | H19 | H20 | 120.1° | 120.0° |
| O1 | C12 | N1 | C10 | 178.2° | 180.0° |
| O1 | C12 | C10 | S | 4.4° | 180.0° |
| O1 | C12 | C10 | C11 | 170.2° | 0.1° |
| O1 | C12 | N1 | H5 | 172.7° | 179.9° |
| N1 | C12 | C10 | S | 173.9° | 0.0° |
| N1 | C12 | C10 | C11 | 11.5° | 180.0° |
| C12 | N1 | C13 | H19 | 157.1° | 60.0° |
| C12 | N1 | C13 | H20 | 37.0° | 60.0° |
| C12 | C10 | S | C11 | 175.5° | 179.9° |
| C12 | C10 | S | C9 | 175.2° | 180.0° |
| C12 | C10 | C11 | C8 | 174.1° | 180.0° |
| C10 | C12 | N1 | H5 | 5.6° | 0.0° |
| C12 | C10 | C11 | H21 | 5.9° | 0.1° |
| S | C10 | C11 | C8 | 0.7° | 0.0° |
| C10 | S | C9 | C8 | 0.1° | 0.1° |
| C10 | S | C9 | C5 | 175.4° | 179.9° |
| S | C10 | C11 | H21 | 179.3° | 180.0° |
| C11 | C10 | S | C9 | 0.3° | 0.1° |
| C10 | C11 | C8 | H21 | 180.0° | 180.0° |
| C10 | C11 | C8 | C9 | 0.8° | 0.0° |
| C10 | C11 | C8 | C7 | 173.7° | 180.0° |
| S | C9 | C8 | C11 | 0.6° | 0.1° |
| S | C9 | C8 | C5 | 175.4° | 180.0° |
| S | C9 | C5 | C4 | 50.7° | 45.1° |
| S | C9 | C8 | C7 | 174.1° | 180.0° |
| S | C9 | C5 | C21 | 71.0° | 75.0° |
| S | C9 | C5 | O | 163.3° | 165.1° |
| C11 | C8 | C9 | C7 | 174.6° | 179.9° |
| C11 | C8 | C9 | C5 | 176.0° | 179.9° |
| C11 | C8 | C7 | C6 | 167.9° | 163.4° |
| C11 | C8 | C7 | H1 | 72.1° | 43.8° |
| C11 | C8 | C7 | H2 | 47.8° | 76.9° |
| CL | C | C26 | C1 | 176.2° | 179.4° |
| CL | C | C1 | C2 | 8.5° | 0.2° |
| CL | C | C26 | C25 | 174.3° | 180.0° |
| CL | C | C1 | C23 | 172.6° | 180.0° |
| CL | C | C26 | H30 | 5.6° | 0.2° |
| C8 | C9 | C5 | C4 | 124.1° | 134.9° |
| C8 | C9 | C5 | C21 | 114.2° | 105.0° |
| C8 | C9 | C5 | O | 11.6° | 14.9° |
| C9 | C8 | C7 | C6 | 18.2° | 16.7° |
| C9 | C8 | C7 | H1 | 101.8° | 136.3° |
| C9 | C8 | C7 | H2 | 138.2° | 103.0° |
| C9 | C8 | C11 | H21 | 179.2° | 179.9° |
| C9 | C5 | C4 | C21 | 125.9° | 120.0° |
| C9 | C5 | C4 | O | 117.9° | 119.2° |
| C9 | C5 | C4 | C3 | 176.3° | 177.2° |
| C5 | C9 | C8 | C7 | 1.4° | 0.0° |
| C9 | C5 | C21 | O | 126.3° | 119.2° |
| C9 | C5 | C21 | C22 | 178.3° | 177.3° |
| C9 | C5 | O | C6 | 42.6° | 50.6° |
| C9 | C5 | C4 | H6 | 63.4° | 57.2° |
| C9 | C5 | C4 | H7 | 56.0° | 62.8° |
| C9 | C5 | C21 | H22 | 58.6° | 62.8° |
| C9 | C5 | C21 | H23 | 61.9° | 57.3° |
| C5 | C4 | C3 | H6 | 120.3° | 120.0° |
| C5 | C4 | C3 | H7 | 120.3° | 119.9° |
| C4 | C5 | C21 | O | 111.5° | 120.8° |
| C5 | C4 | C3 | N | 54.5° | 58.8° |
| C4 | C5 | C21 | C22 | 59.5° | 57.2° |
| C4 | C5 | O | C6 | 159.0° | 170.3° |
| C5 | C4 | H6 | H7 | 119.1° | 120.0° |
| C5 | C4 | C3 | H8 | 174.7° | 178.9° |
| C5 | C4 | C3 | H9 | 65.8° | 61.1° |
| C4 | C5 | C21 | H22 | 179.3° | 177.2° |
| C4 | C5 | C21 | H23 | 60.2° | 62.8° |
| C3 | C4 | C5 | C21 | 57.8° | 57.2° |
| C3 | C4 | C5 | O | 58.5° | 63.5° |
| C4 | C3 | N | H8 | 120.3° | 120.0° |
| C4 | C3 | N | H9 | 120.3° | 120.0° |
| C4 | C3 | N | C2 | 139.3° | 174.0° |
| C4 | C3 | N | C22 | 53.6° | 61.8° |
| C3 | C4 | H6 | H7 | 119.1° | 120.1° |
| C4 | C3 | H8 | H9 | 119.1° | 120.0° |
| C8 | C7 | C6 | H1 | 120.0° | 119.6° |
| C8 | C7 | C6 | H2 | 120.0° | 119.7° |
| C8 | C7 | C6 | O | 45.2° | 49.0° |
| C8 | C7 | H1 | H2 | 119.9° | 120.7° |
| C8 | C7 | C6 | H3 | 165.4° | 169.0° |
| C8 | C7 | C6 | H4 | 75.0° | 71.0° |
| C7 | C8 | C11 | H21 | 6.3° | 0.0° |
| C5 | C21 | C22 | H22 | 119.7° | 119.9° |
| C5 | C21 | C22 | H23 | 119.7° | 120.0° |
| C5 | C21 | C22 | N | 60.4° | 58.9° |
| C21 | C5 | O | C6 | 86.1° | 69.1° |
| C21 | C5 | C4 | H6 | 62.5° | 62.8° |
| C21 | C5 | C4 | H7 | 178.1° | 177.2° |
| C5 | C21 | H22 | H23 | 120.7° | 120.0° |
| C5 | C21 | C22 | H24 | 59.9° | 61.1° |
| C5 | C21 | C22 | H25 | 179.2° | 178.9° |
| O | C5 | C21 | C22 | 52.0° | 63.5° |
| C5 | O | C6 | C7 | 61.7° | 71.2° |
| C5 | O | C6 | H3 | 178.1° | 168.9° |
| C5 | O | C6 | H4 | 58.5° | 48.8° |
| O | C5 | C4 | H6 | 178.8° | 176.5° |
| O | C5 | C4 | H7 | 61.8° | 56.4° |
| O | C5 | C21 | H22 | 67.7° | 56.4° |
| O | C5 | C21 | H23 | 171.8° | 176.5° |
| C3 | N | C22 | C21 | 57.7° | 61.9° |
| C3 | N | C2 | C22 | 166.0° | 124.3° |
| C3 | N | C2 | C1 | 167.9° | 164.2° |
| N | C3 | C4 | H6 | 65.9° | 61.1° |
| N | C3 | C4 | H7 | 174.8° | 178.8° |
| N | C3 | H8 | H9 | 119.1° | 119.9° |
| C3 | N | C2 | H10 | 71.1° | 75.8° |
| C3 | N | C2 | H11 | 46.8° | 44.2° |
| C3 | N | C22 | H24 | 62.6° | 58.1° |
| C3 | N | C22 | H25 | 178.0° | 178.2° |
| C21 | C22 | N | C2 | 134.8° | 174.0° |
| C21 | C22 | N | H24 | 120.3° | 119.9° |
| C21 | C22 | N | H25 | 120.4° | 120.0° |
| C22 | C21 | H22 | H23 | 120.7° | 120.1° |
| C21 | C22 | H24 | H25 | 119.0° | 120.0° |
| N | C2 | C1 | C | 98.7° | 74.6° |
| N | C2 | C1 | H10 | 121.0° | 120.0° |
| N | C2 | C1 | H11 | 121.0° | 120.0° |
| N | C2 | C1 | C23 | 80.3° | 105.2° |
| C2 | N | C3 | H8 | 19.0° | 54.0° |
| C2 | N | C3 | H9 | 100.4° | 66.0° |
| N | C2 | H10 | H11 | 116.7° | 120.0° |
| C2 | N | C22 | H24 | 104.9° | 66.0° |
| C2 | N | C22 | H25 | 14.4° | 54.0° |
| C22 | N | C2 | C1 | 1.9° | 71.5° |
| C22 | N | C3 | H8 | 173.9° | 178.1° |
| C22 | N | C3 | H9 | 66.7° | 58.2° |
| C22 | N | C2 | H10 | 122.9° | 48.4° |
| C22 | N | C2 | H11 | 119.1° | 168.5° |
| N | C22 | C21 | H22 | 179.8° | 178.8° |
| N | C22 | C21 | H23 | 59.3° | 61.0° |
| N | C22 | H24 | H25 | 119.0° | 120.1° |
| C26 | C | C1 | C2 | 175.4° | 179.7° |
| C | C26 | C25 | H30 | 180.0° | 179.7° |
| C26 | C | C1 | C23 | 3.6° | 0.6° |
| C | C26 | C25 | C24 | 1.0° | 0.3° |
| C | C26 | C25 | H29 | 179.0° | 179.7° |
| C | C1 | C2 | C23 | 178.9° | 179.8° |
| C1 | C | C26 | C25 | 1.8° | 0.6° |
| C | C1 | C23 | C24 | 2.5° | 0.3° |
| C | C1 | C2 | H10 | 22.4° | 165.4° |
| C | C1 | C2 | H11 | 140.3° | 45.4° |
| C | C1 | C23 | H27 | 177.5° | 179.8° |
| C1 | C | C26 | H30 | 178.2° | 179.7° |
| C2 | C1 | C23 | C24 | 176.4° | 180.0° |
| C1 | C2 | H10 | H11 | 116.8° | 120.0° |
| C2 | C1 | C23 | H27 | 3.6° | 0.0° |
| C7 | C6 | O | H3 | 120.2° | 119.9° |
| C7 | C6 | O | H4 | 120.2° | 120.0° |
| C6 | C7 | H1 | H2 | 119.9° | 120.7° |
| C7 | C6 | H3 | H4 | 119.5° | 119.9° |
| C26 | C25 | C24 | H29 | 180.0° | 180.0° |
| C26 | C25 | C24 | C23 | 2.0° | 0.0° |
| C26 | C25 | C24 | H28 | 178.0° | 180.0° |
| O | C6 | C7 | H1 | 74.8° | 168.6° |
| O | C6 | C7 | H2 | 165.2° | 70.7° |
| O | C6 | H3 | H4 | 119.4° | 120.1° |
| C1 | C23 | C24 | C25 | 0.2° | 0.0° |
| C1 | C23 | C24 | H27 | 180.0° | 180.0° |
| C23 | C1 | C2 | H10 | 158.7° | 14.8° |
| C23 | C1 | C2 | H11 | 40.8° | 134.8° |
| C1 | C23 | C24 | H28 | 179.8° | 180.0° |
| C25 | C24 | C23 | H28 | 180.0° | 180.0° |
| C25 | C24 | C23 | H27 | 179.8° | 179.9° |
| C24 | C25 | C26 | H30 | 179.0° | 180.0° |
| C23 | C24 | C25 | H29 | 178.0° | 180.0° |
| H1 | C7 | C6 | H3 | 45.3° | 71.4° |
| H1 | C7 | C6 | H4 | 165.0° | 48.6° |
| H2 | C7 | C6 | H3 | 74.6° | 49.3° |
| H2 | C7 | C6 | H4 | 45.1° | 169.3° |
| H5 | N1 | C13 | H19 | 22.9° | 120.0° |
| H5 | N1 | C13 | H20 | 143.0° | 120.0° |
| H6 | C4 | C3 | H8 | 54.4° | 58.9° |
| H6 | C4 | C3 | H9 | 173.9° | 178.9° |
| H7 | C4 | C3 | H8 | 64.9° | 61.2° |
| H7 | C4 | C3 | H9 | 54.5° | 58.8° |
| H12 | C18 | H13 | H14 | 120.0° | 120.0° |
| H15 | C16 | C15 | H16 | 0.6° | 0.0° |
| H17 | C19 | C20 | H18 | 0.6° | 0.0° |
| H22 | C21 | C22 | H24 | 59.8° | 58.9° |
| H22 | C21 | C22 | H25 | 59.5° | 61.2° |
| H23 | C21 | C22 | H24 | 179.6° | 179.0° |
| H23 | C21 | C22 | H25 | 61.0° | 59.0° |
| H27 | C23 | C24 | H28 | 0.2° | 0.1° |
| H28 | C24 | C25 | H29 | 2.0° | 0.0° |
| H29 | C25 | C26 | H30 | 1.0° | 0.0° |
