WQK
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C21 | N4 | sing | 1.47Å | 1.46Å | |
| N4 | S | sing | 1.66Å | 1.61Å | |
| O2 | S | doub | 1.42Å | 1.43Å | |
| S | O1 | doub | 1.42Å | 1.43Å | |
| S | C3 | sing | 1.76Å | 1.76Å | |
| C17 | C18 | sing | 1.55Å | 1.51Å | |
| C17 | C16 | sing | 1.54Å | 1.51Å | |
| C3 | C2 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C2 | C1 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.55Å | 1.53Å | |
| C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | N3 | sing | 1.47Å | 1.47Å | |
| C1 | C | sing | 1.51Å | 1.51Å | |
| C1 | C6 | doub | 1.39Å | 1.41Å | Aromatic |
| C19 | N3 | sing | 1.47Å | 1.49Å | |
| C19 | C20 | sing | 1.53Å | 1.52Å | |
| C5 | C6 | sing | 1.39Å | 1.40Å | Aromatic |
| N3 | C15 | sing | 1.35Å | 1.35Å | |
| C6 | N | sing | 1.40Å | 1.40Å | |
| C15 | O | doub | 1.22Å | 1.22Å | |
| C15 | C12 | sing | 1.48Å | 1.50Å | |
| C13 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C13 | C14 | sing | 1.40Å | 1.41Å | Aromatic |
| N2 | C14 | doub | 1.34Å | 1.37Å | Aromatic |
| N2 | C7 | sing | 1.32Å | 1.35Å | Aromatic |
| N | C7 | sing | 1.38Å | 1.37Å | |
| C12 | C11 | sing | 1.40Å | 1.41Å | Aromatic |
| C14 | C9 | sing | 1.42Å | 1.41Å | Aromatic |
| C7 | N1 | doub | 1.33Å | 1.35Å | Aromatic |
| C11 | C10 | doub | 1.36Å | 1.37Å | Aromatic |
| C9 | C10 | sing | 1.40Å | 1.41Å | Aromatic |
| C9 | C8 | doub | 1.41Å | 1.41Å | Aromatic |
| N1 | C8 | sing | 1.32Å | 1.31Å | Aromatic |
| C8 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C4 | H3 | sing | 1.08Å | 1.08Å | |
| C2 | H4 | sing | 1.08Å | 1.08Å | |
| N4 | H5 | sing | 0.97Å | 1.00Å | |
| N | H6 | sing | 0.97Å | 1.00Å | |
| C | H7 | sing | 1.09Å | 1.10Å | |
| C | H8 | sing | 1.09Å | 1.10Å | |
| C | H9 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C11 | H11 | sing | 1.08Å | 1.08Å | |
| C13 | H12 | sing | 1.08Å | 1.08Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C16 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H20 | sing | 1.09Å | 1.10Å | |
| C20 | H21 | sing | 1.09Å | 1.10Å | |
| C20 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | N4 | S | 119.2° | 120.0° |
| C21 | N4 | H5 | 107.0° | 120.0° |
| N4 | C21 | H23 | 109.5° | 109.5° |
| N4 | C21 | H24 | 109.5° | 109.5° |
| N4 | C21 | H25 | 109.5° | 109.4° |
| N4 | S | O2 | 107.1° | 106.4° |
| N4 | S | O1 | 106.1° | 106.4° |
| N4 | S | C3 | 108.0° | 107.2° |
| S | N4 | H5 | 107.0° | 120.0° |
| O2 | S | O1 | 119.3° | 123.2° |
| O2 | S | C3 | 108.3° | 106.4° |
| O1 | S | C3 | 107.6° | 106.4° |
| S | C3 | C2 | 119.7° | 120.0° |
| S | C3 | C4 | 119.5° | 119.9° |
| C18 | C17 | C16 | 103.6° | 102.9° |
| C17 | C18 | C19 | 108.3° | 101.5° |
| C18 | C17 | H15 | 110.9° | 110.7° |
| C18 | C17 | H16 | 110.9° | 110.7° |
| C17 | C18 | H17 | 109.7° | 111.0° |
| C17 | C18 | H18 | 109.8° | 111.0° |
| C17 | C16 | N3 | 103.7° | 107.3° |
| C17 | C16 | H13 | 110.9° | 109.9° |
| C17 | C16 | H14 | 110.9° | 110.0° |
| C16 | C17 | H15 | 110.9° | 110.6° |
| C16 | C17 | H16 | 110.9° | 110.9° |
| C2 | C3 | C4 | 120.8° | 120.1° |
| C3 | C2 | C1 | 120.9° | 120.1° |
| C3 | C2 | H4 | 119.6° | 119.9° |
| C3 | C4 | C5 | 119.1° | 120.1° |
| C3 | C4 | H3 | 120.4° | 120.0° |
| C2 | C1 | C | 120.0° | 120.0° |
| C2 | C1 | C6 | 118.2° | 119.9° |
| C1 | C2 | H4 | 119.5° | 119.9° |
| C18 | C19 | N3 | 102.4° | 104.7° |
| C18 | C19 | C20 | 112.3° | 110.4° |
| C19 | C18 | H17 | 109.8° | 111.2° |
| C19 | C18 | H18 | 109.8° | 110.9° |
| C18 | C19 | H19 | 110.9° | 110.3° |
| C4 | C5 | C6 | 120.9° | 119.9° |
| C4 | C5 | H2 | 119.5° | 120.0° |
| C5 | C4 | H3 | 120.4° | 119.9° |
| C16 | N3 | C19 | 112.1° | 108.7° |
| C16 | N3 | C15 | 119.4° | 125.6° |
| N3 | C16 | H13 | 110.9° | 109.9° |
| N3 | C16 | H14 | 110.9° | 109.9° |
| C | C1 | C6 | 121.8° | 120.1° |
| C1 | C | H7 | 109.5° | 109.5° |
| C1 | C | H8 | 109.5° | 109.5° |
| C1 | C | H9 | 109.5° | 109.5° |
| C1 | C6 | C5 | 120.1° | 119.9° |
| C1 | C6 | N | 121.6° | 120.1° |
| N3 | C19 | C20 | 108.6° | 110.2° |
| C19 | N3 | C15 | 128.5° | 125.7° |
| N3 | C19 | H19 | 111.4° | 110.7° |
| C20 | C19 | H19 | 111.0° | 110.4° |
| C19 | C20 | H20 | 109.5° | 109.5° |
| C19 | C20 | H21 | 109.5° | 109.5° |
| C19 | C20 | H22 | 109.5° | 109.4° |
| C5 | C6 | N | 117.8° | 120.0° |
| C6 | C5 | H2 | 119.5° | 120.1° |
| N3 | C15 | O | 120.0° | 120.0° |
| N3 | C15 | C12 | 120.1° | 120.0° |
| C6 | N | C7 | 127.3° | 120.0° |
| C6 | N | H6 | 116.3° | 120.0° |
| O | C15 | C12 | 119.7° | 120.0° |
| C15 | C12 | C13 | 121.3° | 119.7° |
| C15 | C12 | C11 | 119.2° | 119.7° |
| C12 | C13 | C14 | 120.9° | 119.4° |
| C13 | C12 | C11 | 119.4° | 120.6° |
| C12 | C13 | H12 | 119.5° | 120.3° |
| C13 | C14 | N2 | 119.2° | 121.8° |
| C13 | C14 | C9 | 119.1° | 119.5° |
| C14 | C13 | H12 | 119.5° | 120.3° |
| C14 | N2 | C7 | 116.2° | 120.2° |
| N2 | C14 | C9 | 121.6° | 118.8° |
| N2 | C7 | N | 118.3° | 118.7° |
| N2 | C7 | N1 | 126.7° | 122.7° |
| N | C7 | N1 | 114.9° | 118.7° |
| C7 | N | H6 | 116.4° | 120.0° |
| C12 | C11 | C10 | 120.8° | 120.9° |
| C12 | C11 | H11 | 119.6° | 119.6° |
| C14 | C9 | C10 | 118.9° | 119.9° |
| C14 | C9 | C8 | 115.0° | 118.3° |
| C7 | N1 | C8 | 115.6° | 121.5° |
| C11 | C10 | C9 | 120.8° | 119.8° |
| C11 | C10 | H10 | 119.6° | 120.1° |
| C10 | C11 | H11 | 119.6° | 119.5° |
| C10 | C9 | C8 | 126.1° | 121.8° |
| C9 | C10 | H10 | 119.6° | 120.1° |
| C9 | C8 | N1 | 124.6° | 118.5° |
| C9 | C8 | H1 | 117.7° | 120.7° |
| N1 | C8 | H1 | 117.7° | 120.7° |
| H7 | C | H8 | 109.5° | 109.5° |
| H7 | C | H9 | 109.5° | 109.4° |
| H8 | C | H9 | 109.5° | 109.4° |
| H13 | C16 | H14 | 109.5° | 109.9° |
| H15 | C17 | H16 | 109.5° | 110.8° |
| H17 | C18 | H18 | 109.5° | 110.9° |
| H20 | C20 | H21 | 109.5° | 109.5° |
| H20 | C20 | H22 | 109.4° | 109.4° |
| H21 | C20 | H22 | 109.5° | 109.5° |
| H23 | C21 | H24 | 109.5° | 109.5° |
| H23 | C21 | H25 | 109.4° | 109.5° |
| H24 | C21 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | N4 | S | H5 | 121.4° | 179.9° |
| C21 | N4 | S | O2 | 38.9° | 178.5° |
| C21 | N4 | S | O1 | 167.3° | 48.5° |
| C21 | N4 | S | C3 | 77.5° | 65.0° |
| N4 | C21 | H23 | H24 | 120.0° | 120.1° |
| N4 | C21 | H23 | H25 | 120.0° | 119.9° |
| N4 | C21 | H24 | H25 | 120.0° | 119.9° |
| N4 | S | O2 | O1 | 120.3° | 123.0° |
| N4 | S | O2 | C3 | 116.3° | 114.1° |
| N4 | S | O1 | C3 | 115.5° | 114.1° |
| N4 | S | C3 | C2 | 134.4° | 90.0° |
| N4 | S | C3 | C4 | 43.9° | 90.0° |
| S | N4 | C21 | H23 | 180.0° | 60.1° |
| S | N4 | C21 | H24 | 60.0° | 60.0° |
| S | N4 | C21 | H25 | 60.0° | 180.0° |
| O2 | S | O1 | C3 | 123.7° | 122.9° |
| O2 | S | C3 | C2 | 18.8° | 23.5° |
| O2 | S | C3 | C4 | 159.5° | 156.4° |
| O2 | S | N4 | H5 | 160.3° | 1.5° |
| O1 | S | C3 | C2 | 111.5° | 156.4° |
| O1 | S | C3 | C4 | 70.2° | 23.5° |
| O1 | S | N4 | H5 | 71.3° | 131.5° |
| S | C3 | C2 | C4 | 178.3° | 180.0° |
| S | C3 | C2 | C1 | 177.4° | 180.0° |
| S | C3 | C4 | C5 | 178.4° | 179.7° |
| S | C3 | C4 | H3 | 1.6° | 0.0° |
| S | C3 | C2 | H4 | 2.6° | 0.1° |
| C3 | S | N4 | H5 | 43.9° | 115.0° |
| C18 | C17 | C16 | H15 | 119.0° | 118.3° |
| C18 | C17 | C16 | H16 | 119.1° | 118.4° |
| C17 | C18 | C19 | H17 | 119.8° | 118.1° |
| C17 | C18 | C19 | H18 | 119.8° | 118.0° |
| C18 | C17 | C16 | N3 | 31.1° | 22.2° |
| C17 | C18 | C19 | N3 | 14.3° | 37.3° |
| C17 | C18 | C19 | C20 | 130.5° | 155.9° |
| C18 | C17 | C16 | H13 | 150.1° | 97.3° |
| C18 | C17 | C16 | H14 | 88.0° | 141.7° |
| C18 | C17 | H15 | H16 | 122.7° | 123.2° |
| C17 | C18 | H17 | H18 | 120.6° | 123.9° |
| C17 | C18 | C19 | H19 | 104.6° | 81.8° |
| C16 | C17 | C18 | C19 | 28.7° | 35.7° |
| C17 | C16 | N3 | H13 | 119.1° | 119.4° |
| C17 | C16 | N3 | H14 | 119.1° | 119.6° |
| C17 | C16 | N3 | C19 | 23.8° | 1.3° |
| C17 | C16 | N3 | C15 | 156.4° | 179.0° |
| C17 | C16 | H13 | H14 | 122.7° | 121.1° |
| C16 | C17 | H15 | H16 | 122.7° | 123.4° |
| C16 | C17 | C18 | H17 | 91.1° | 82.5° |
| C16 | C17 | C18 | H18 | 148.5° | 153.6° |
| C3 | C2 | C1 | H4 | 180.0° | 180.0° |
| C2 | C3 | C4 | C5 | 0.1° | 0.3° |
| C3 | C2 | C1 | C | 175.9° | 180.0° |
| C3 | C2 | C1 | C6 | 1.5° | 0.3° |
| C2 | C3 | C4 | H3 | 179.9° | 180.0° |
| C4 | C3 | C2 | C1 | 0.9° | 0.0° |
| C3 | C4 | C5 | H3 | 180.0° | 179.7° |
| C3 | C4 | C5 | C6 | 0.4° | 0.3° |
| C3 | C4 | C5 | H2 | 179.5° | 179.8° |
| C4 | C3 | C2 | H4 | 179.1° | 180.0° |
| C2 | C1 | C | C6 | 177.3° | 179.7° |
| C2 | C1 | C6 | C5 | 1.2° | 0.2° |
| C2 | C1 | C6 | N | 170.6° | 179.7° |
| C2 | C1 | C | H7 | 88.7° | 90.3° |
| C2 | C1 | C | H8 | 151.3° | 29.7° |
| C2 | C1 | C | H9 | 31.3° | 149.7° |
| C18 | C19 | N3 | C16 | 6.1° | 24.4° |
| C18 | C19 | N3 | C20 | 118.9° | 118.7° |
| C18 | C19 | N3 | H19 | 118.5° | 118.9° |
| C18 | C19 | C20 | H19 | 124.7° | 122.3° |
| C18 | C19 | N3 | C15 | 174.1° | 155.9° |
| C19 | C18 | C17 | H15 | 90.4° | 153.9° |
| C19 | C18 | C17 | H16 | 147.7° | 82.9° |
| C19 | C18 | H17 | H18 | 120.6° | 124.0° |
| C18 | C19 | C20 | H20 | 180.0° | 61.4° |
| C18 | C19 | C20 | H21 | 60.0° | 178.5° |
| C18 | C19 | C20 | H22 | 60.0° | 58.5° |
| C4 | C5 | C6 | C1 | 0.2° | 0.0° |
| C4 | C5 | C6 | H2 | 180.0° | 179.9° |
| C4 | C5 | C6 | N | 171.9° | 180.0° |
| C16 | N3 | C19 | C15 | 179.8° | 179.7° |
| C16 | N3 | C19 | C20 | 112.8° | 143.2° |
| C16 | N3 | C15 | O | 9.0° | 174.7° |
| C16 | N3 | C15 | C12 | 174.6° | 5.4° |
| N3 | C16 | H13 | H14 | 122.7° | 121.0° |
| N3 | C16 | C17 | H15 | 88.0° | 140.5° |
| N3 | C16 | C17 | H16 | 150.1° | 96.2° |
| C16 | N3 | C19 | H19 | 124.7° | 94.5° |
| C | C1 | C6 | C5 | 176.2° | 179.9° |
| C | C1 | C6 | N | 12.0° | 0.0° |
| C | C1 | C2 | H4 | 4.1° | 0.1° |
| C1 | C | H7 | H8 | 120.0° | 120.1° |
| C1 | C | H7 | H9 | 120.0° | 120.0° |
| C1 | C | H8 | H9 | 120.0° | 120.0° |
| C1 | C6 | C5 | N | 172.1° | 180.0° |
| C1 | C6 | N | C7 | 147.3° | 154.9° |
| C1 | C6 | C5 | H2 | 179.8° | 180.0° |
| C6 | C1 | C2 | H4 | 178.5° | 179.8° |
| C1 | C6 | N | H6 | 32.7° | 25.1° |
| C6 | C1 | C | H7 | 88.6° | 90.0° |
| C6 | C1 | C | H8 | 31.4° | 150.0° |
| C6 | C1 | C | H9 | 151.4° | 30.0° |
| N3 | C19 | C20 | H19 | 122.8° | 122.5° |
| C19 | N3 | C15 | O | 170.8° | 5.0° |
| C19 | N3 | C15 | C12 | 5.6° | 175.0° |
| C19 | N3 | C16 | H13 | 142.8° | 120.7° |
| C19 | N3 | C16 | H14 | 95.3° | 118.3° |
| N3 | C19 | C18 | H17 | 105.5° | 80.8° |
| N3 | C19 | C18 | H18 | 134.1° | 155.3° |
| N3 | C19 | C20 | H20 | 67.6° | 176.6° |
| N3 | C19 | C20 | H21 | 52.5° | 63.3° |
| N3 | C19 | C20 | H22 | 172.5° | 56.7° |
| C20 | C19 | N3 | C15 | 67.0° | 37.1° |
| C20 | C19 | C18 | H17 | 10.8° | 37.8° |
| C20 | C19 | C18 | H18 | 109.6° | 86.2° |
| C19 | C20 | H20 | H21 | 120.0° | 120.1° |
| C19 | C20 | H20 | H22 | 120.0° | 119.9° |
| C19 | C20 | H21 | H22 | 120.0° | 120.0° |
| C5 | C6 | N | C7 | 40.7° | 25.1° |
| C6 | C5 | C4 | H3 | 179.6° | 180.0° |
| C5 | C6 | N | H6 | 139.3° | 154.9° |
| N3 | C15 | O | C12 | 176.4° | 179.9° |
| N3 | C15 | C12 | C13 | 53.2° | 8.2° |
| N3 | C15 | C12 | C11 | 130.5° | 171.8° |
| C15 | N3 | C16 | H13 | 37.3° | 59.6° |
| C15 | N3 | C16 | H14 | 84.6° | 61.4° |
| C15 | N3 | C19 | H19 | 55.5° | 85.2° |
| C6 | N | C7 | N2 | 6.4° | 173.7° |
| C6 | N | C7 | H6 | 180.0° | 180.0° |
| C6 | N | C7 | N1 | 170.0° | 6.2° |
| N | C6 | C5 | H2 | 8.1° | 0.0° |
| O | C15 | C12 | C13 | 130.5° | 171.9° |
| O | C15 | C12 | C11 | 45.8° | 8.1° |
| C15 | C12 | C13 | C11 | 176.3° | 180.0° |
| C15 | C12 | C13 | C14 | 176.2° | 180.0° |
| C15 | C12 | C11 | C10 | 175.0° | 180.0° |
| C15 | C12 | C11 | H11 | 4.9° | 0.1° |
| C15 | C12 | C13 | H12 | 3.8° | 0.1° |
| C12 | C13 | C14 | H12 | 180.0° | 180.0° |
| C12 | C13 | C14 | N2 | 177.6° | 180.0° |
| C12 | C13 | C14 | C9 | 1.3° | 0.1° |
| C13 | C12 | C11 | C10 | 1.4° | 0.1° |
| C13 | C12 | C11 | H11 | 178.7° | 180.0° |
| C13 | C14 | N2 | C9 | 178.9° | 179.9° |
| C13 | C14 | N2 | C7 | 179.3° | 179.9° |
| C14 | C13 | C12 | C11 | 0.1° | 0.0° |
| C13 | C14 | C9 | C10 | 1.6° | 0.1° |
| C13 | C14 | C9 | C8 | 178.6° | 180.0° |
| C14 | N2 | C7 | N | 172.1° | 180.0° |
| C14 | N2 | C7 | N1 | 3.9° | 0.0° |
| N2 | C14 | C9 | C10 | 177.3° | 180.0° |
| N2 | C14 | C9 | C8 | 2.5° | 0.1° |
| N2 | C14 | C13 | H12 | 2.4° | 0.0° |
| N2 | C7 | N | N1 | 176.5° | 180.0° |
| C7 | N2 | C14 | C9 | 0.4° | 0.0° |
| N2 | C7 | N1 | C8 | 5.5° | 0.0° |
| N2 | C7 | N | H6 | 173.6° | 6.3° |
| N | C7 | N1 | C8 | 170.6° | 180.0° |
| C12 | C11 | C10 | H11 | 180.0° | 179.9° |
| C12 | C11 | C10 | C9 | 1.1° | 0.1° |
| C12 | C11 | C10 | H10 | 178.9° | 179.9° |
| C11 | C12 | C13 | H12 | 179.9° | 180.0° |
| C14 | C9 | C10 | C11 | 0.4° | 0.0° |
| C14 | C9 | C10 | C8 | 179.8° | 180.0° |
| C14 | C9 | C8 | N1 | 0.8° | 0.1° |
| C14 | C9 | C8 | H1 | 179.2° | 180.0° |
| C14 | C9 | C10 | H10 | 179.6° | 180.0° |
| C9 | C14 | C13 | H12 | 178.7° | 179.9° |
| C7 | N1 | C8 | C9 | 2.9° | 0.0° |
| C7 | N1 | C8 | H1 | 177.1° | 180.0° |
| N1 | C7 | N | H6 | 10.0° | 173.7° |
| C11 | C10 | C9 | H10 | 180.0° | 180.0° |
| C11 | C10 | C9 | C8 | 179.8° | 180.0° |
| C10 | C9 | C8 | N1 | 179.0° | 180.0° |
| C10 | C9 | C8 | H1 | 1.0° | 0.0° |
| C9 | C10 | C11 | H11 | 178.9° | 179.9° |
| C9 | C8 | N1 | H1 | 180.0° | 180.0° |
| C8 | C9 | C10 | H10 | 0.2° | 0.0° |
| H2 | C5 | C4 | H3 | 0.4° | 0.0° |
| H5 | N4 | C21 | H23 | 58.6° | 120.0° |
| H5 | N4 | C21 | H24 | 61.4° | 120.0° |
| H5 | N4 | C21 | H25 | 178.6° | 0.0° |
| H7 | C | H8 | H9 | 120.0° | 119.9° |
| H10 | C10 | C11 | H11 | 1.1° | 0.1° |
| H13 | C16 | C17 | H15 | 31.1° | 21.0° |
| H13 | C16 | C17 | H16 | 90.8° | 144.3° |
| H14 | C16 | C17 | H15 | 152.9° | 100.0° |
| H14 | C16 | C17 | H16 | 31.0° | 23.3° |
| H15 | C17 | C18 | H17 | 149.8° | 35.7° |
| H15 | C17 | C18 | H18 | 29.4° | 88.2° |
| H16 | C17 | C18 | H17 | 27.9° | 158.9° |
| H16 | C17 | C18 | H18 | 92.5° | 35.1° |
| H17 | C18 | C19 | H19 | 135.6° | 160.1° |
| H18 | C18 | C19 | H19 | 15.2° | 36.1° |
| H19 | C19 | C20 | H20 | 55.2° | 60.9° |
| H19 | C19 | C20 | H21 | 175.3° | 59.2° |
| H19 | C19 | C20 | H22 | 64.7° | 179.2° |
| H20 | C20 | H21 | H22 | 120.0° | 120.0° |
| H23 | C21 | H24 | H25 | 120.0° | 120.0° |
