3XG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| S7 | C2 | sing | 1.76Å | 1.75Å | Aromatic |
| S7 | C8 | sing | 1.75Å | 1.75Å | Aromatic |
| C1 | C2 | doub | 1.40Å | 1.38Å | Aromatic |
| C1 | C6 | sing | 1.37Å | 1.40Å | Aromatic |
| O14 | C13 | doub | 1.22Å | 1.25Å | |
| C2 | C3 | sing | 1.39Å | 1.49Å | Aromatic |
| C6 | C5 | doub | 1.39Å | 1.41Å | Aromatic |
| C8 | C13 | sing | 1.42Å | 1.47Å | |
| C8 | C9 | doub | 1.38Å | 1.48Å | Aromatic |
| C13 | N12 | sing | 1.35Å | 1.41Å | |
| C3 | C9 | sing | 1.47Å | 1.48Å | Aromatic |
| C3 | C4 | doub | 1.41Å | 1.39Å | Aromatic |
| C9 | N10 | sing | 1.36Å | 1.36Å | |
| C5 | C4 | sing | 1.37Å | 1.40Å | Aromatic |
| N12 | C15 | sing | 1.46Å | 1.47Å | |
| N12 | C11 | sing | 1.36Å | 1.44Å | |
| C15 | C16 | sing | 1.53Å | 1.53Å | |
| N10 | C11 | doub | 1.31Å | 1.37Å | |
| C11 | S23 | sing | 1.76Å | 1.70Å | |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| S23 | C24 | sing | 1.81Å | 1.78Å | |
| C17 | N18 | sing | 1.47Å | 1.46Å | |
| C24 | C25 | sing | 1.51Å | 1.52Å | |
| N18 | C22 | sing | 1.48Å | 1.46Å | |
| N18 | C19 | sing | 1.48Å | 1.46Å | |
| C22 | C21 | sing | 1.54Å | 1.53Å | |
| C25 | O26 | sing | 1.34Å | 1.46Å | |
| C25 | O29 | doub | 1.21Å | 1.22Å | |
| O26 | C27 | sing | 1.45Å | 1.43Å | |
| C27 | C28 | sing | 1.53Å | 1.52Å | |
| C21 | C20 | sing | 1.55Å | 1.53Å | |
| C19 | C20 | sing | 1.55Å | 1.53Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C5 | H2 | sing | 1.08Å | 1.08Å | |
| C6 | H3 | sing | 1.08Å | 1.08Å | |
| C15 | H4 | sing | 1.09Å | 1.10Å | |
| C15 | H5 | sing | 1.09Å | 1.10Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C1 | H8 | sing | 1.08Å | 1.08Å | |
| C16 | H9 | sing | 1.09Å | 1.10Å | |
| C16 | H10 | sing | 1.09Å | 1.10Å | |
| C27 | H11 | sing | 1.09Å | 1.10Å | |
| C27 | H12 | sing | 1.09Å | 1.10Å | |
| C28 | H13 | sing | 1.09Å | 1.10Å | |
| C28 | H14 | sing | 1.09Å | 1.10Å | |
| C28 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.09Å | 1.10Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | S7 | C8 | 93.2° | 92.9° |
| S7 | C2 | C1 | 127.5° | 129.8° |
| S7 | C2 | C3 | 111.8° | 110.5° |
| S7 | C8 | C13 | 128.0° | 130.2° |
| S7 | C8 | C9 | 112.9° | 110.9° |
| C2 | C1 | C6 | 117.7° | 120.3° |
| C1 | C2 | C3 | 120.7° | 119.7° |
| C2 | C1 | H8 | 121.1° | 119.8° |
| C1 | C6 | C5 | 122.0° | 120.2° |
| C1 | C6 | H3 | 119.0° | 119.9° |
| C6 | C1 | H8 | 121.1° | 119.9° |
| O14 | C13 | C8 | 120.7° | 120.5° |
| O14 | C13 | N12 | 122.5° | 120.5° |
| C2 | C3 | C9 | 111.4° | 112.7° |
| C2 | C3 | C4 | 119.9° | 119.1° |
| C6 | C5 | C4 | 121.4° | 120.3° |
| C6 | C5 | H2 | 119.3° | 119.8° |
| C5 | C6 | H3 | 119.0° | 120.0° |
| C13 | C8 | C9 | 119.1° | 118.9° |
| C8 | C13 | N12 | 116.9° | 118.9° |
| C8 | C9 | C3 | 110.1° | 113.0° |
| C8 | C9 | N10 | 120.6° | 119.0° |
| C13 | N12 | C15 | 118.1° | 120.0° |
| C13 | N12 | C11 | 120.4° | 119.9° |
| C9 | C3 | C4 | 128.6° | 128.2° |
| C3 | C9 | N10 | 128.5° | 128.1° |
| C3 | C4 | C5 | 118.2° | 120.3° |
| C3 | C4 | H1 | 120.9° | 119.9° |
| C9 | N10 | C11 | 120.6° | 121.6° |
| C5 | C4 | H1 | 120.9° | 119.8° |
| C4 | C5 | H2 | 119.3° | 119.8° |
| C15 | N12 | C11 | 121.5° | 120.1° |
| N12 | C15 | C16 | 109.4° | 109.5° |
| N12 | C15 | H4 | 109.5° | 109.5° |
| N12 | C15 | H5 | 109.5° | 109.4° |
| N12 | C11 | N10 | 122.4° | 121.7° |
| N12 | C11 | S23 | 120.1° | 119.2° |
| C15 | C16 | C17 | 111.1° | 109.5° |
| C16 | C15 | H4 | 109.5° | 109.5° |
| C16 | C15 | H5 | 109.5° | 109.5° |
| C15 | C16 | H9 | 109.0° | 109.4° |
| C15 | C16 | H10 | 109.0° | 109.5° |
| N10 | C11 | S23 | 117.6° | 119.2° |
| C11 | S23 | C24 | 110.0° | 100.0° |
| C16 | C17 | N18 | 108.1° | 109.5° |
| C16 | C17 | H6 | 109.8° | 109.5° |
| C16 | C17 | H7 | 109.8° | 109.5° |
| C17 | C16 | H9 | 109.1° | 109.5° |
| C17 | C16 | H10 | 109.1° | 109.4° |
| S23 | C24 | C25 | 114.8° | 109.4° |
| S23 | C24 | H16 | 108.1° | 109.5° |
| S23 | C24 | H17 | 108.1° | 109.5° |
| C17 | N18 | C22 | 118.8° | 111.0° |
| C17 | N18 | C19 | 119.9° | 111.0° |
| N18 | C17 | H6 | 109.8° | 109.5° |
| N18 | C17 | H7 | 109.8° | 109.5° |
| C24 | C25 | O26 | 118.7° | 120.0° |
| C24 | C25 | O29 | 122.5° | 120.0° |
| C25 | C24 | H16 | 108.1° | 109.5° |
| C25 | C24 | H17 | 108.2° | 109.5° |
| C22 | N18 | C19 | 114.2° | 105.8° |
| N18 | C22 | C21 | 102.6° | 107.0° |
| N18 | C22 | H19 | 111.2° | 110.0° |
| N18 | C22 | H20 | 111.2° | 109.9° |
| N18 | C19 | C20 | 102.6° | 103.2° |
| N18 | C19 | H25 | 111.2° | 110.7° |
| N18 | C19 | H26 | 111.2° | 110.7° |
| C22 | C21 | C20 | 107.6° | 105.1° |
| C21 | C22 | H19 | 111.2° | 109.9° |
| C21 | C22 | H20 | 111.2° | 109.9° |
| C22 | C21 | H21 | 110.0° | 110.2° |
| C22 | C21 | H22 | 110.0° | 110.3° |
| O26 | C25 | O29 | 118.8° | 120.0° |
| C25 | O26 | C27 | 123.3° | 117.0° |
| O26 | C27 | C28 | 111.1° | 109.5° |
| O26 | C27 | H11 | 109.1° | 109.5° |
| O26 | C27 | H12 | 109.0° | 109.5° |
| C28 | C27 | H11 | 109.1° | 109.5° |
| C28 | C27 | H12 | 109.1° | 109.4° |
| C27 | C28 | H13 | 109.5° | 109.5° |
| C27 | C28 | H14 | 109.4° | 109.5° |
| C27 | C28 | H15 | 109.5° | 109.4° |
| C21 | C20 | C19 | 107.6° | 102.9° |
| C20 | C21 | H21 | 110.0° | 110.3° |
| C20 | C21 | H22 | 109.9° | 110.3° |
| C21 | C20 | H23 | 109.9° | 110.7° |
| C21 | C20 | H24 | 109.9° | 110.7° |
| C19 | C20 | H23 | 109.9° | 110.7° |
| C19 | C20 | H24 | 109.9° | 110.9° |
| C20 | C19 | H25 | 111.2° | 110.7° |
| C20 | C19 | H26 | 111.2° | 110.7° |
| H4 | C15 | H5 | 109.5° | 109.5° |
| H6 | C17 | H7 | 109.5° | 109.4° |
| H9 | C16 | H10 | 109.5° | 109.5° |
| H11 | C27 | H12 | 109.5° | 109.4° |
| H13 | C28 | H14 | 109.5° | 109.5° |
| H13 | C28 | H15 | 109.5° | 109.5° |
| H14 | C28 | H15 | 109.5° | 109.5° |
| H16 | C24 | H17 | 109.5° | 109.5° |
| H19 | C22 | H20 | 109.5° | 110.0° |
| H21 | C21 | H22 | 109.4° | 110.4° |
| H23 | C20 | H24 | 109.5° | 110.6° |
| H25 | C19 | H26 | 109.5° | 110.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| S7 | C2 | C1 | C3 | 179.7° | 179.7° |
| S7 | C2 | C1 | C6 | 179.5° | 180.0° |
| C2 | S7 | C8 | C13 | 173.4° | 179.9° |
| C2 | S7 | C8 | C9 | 5.1° | 0.2° |
| S7 | C2 | C3 | C9 | 4.3° | 0.2° |
| S7 | C2 | C3 | C4 | 179.6° | 179.7° |
| S7 | C2 | C1 | H8 | 0.4° | 0.3° |
| C8 | S7 | C2 | C1 | 179.3° | 180.0° |
| S7 | C8 | C13 | O14 | 1.5° | 0.2° |
| C8 | S7 | C2 | C3 | 0.4° | 0.3° |
| S7 | C8 | C13 | C9 | 178.3° | 179.8° |
| S7 | C8 | C13 | N12 | 178.8° | 179.8° |
| S7 | C8 | C9 | C3 | 8.3° | 0.2° |
| S7 | C8 | C9 | N10 | 179.0° | 179.9° |
| C2 | C1 | C6 | H8 | 180.0° | 179.8° |
| C2 | C1 | C6 | C5 | 0.6° | 0.0° |
| C1 | C2 | C3 | C9 | 175.9° | 180.0° |
| C1 | C2 | C3 | C4 | 0.1° | 0.5° |
| C2 | C1 | C6 | H3 | 179.4° | 180.0° |
| C6 | C1 | C2 | C3 | 0.1° | 0.3° |
| C1 | C6 | C5 | H3 | 180.0° | 180.0° |
| C1 | C6 | C5 | C4 | 1.0° | 0.0° |
| C1 | C6 | C5 | H2 | 178.9° | 180.0° |
| O14 | C13 | C8 | N12 | 179.7° | 180.0° |
| O14 | C13 | C8 | C9 | 179.8° | 180.0° |
| O14 | C13 | N12 | C15 | 0.4° | 0.1° |
| O14 | C13 | N12 | C11 | 179.7° | 179.6° |
| C2 | C3 | C9 | C8 | 7.9° | 0.0° |
| C2 | C3 | C9 | C4 | 175.7° | 179.5° |
| C2 | C3 | C9 | N10 | 177.7° | 179.7° |
| C2 | C3 | C4 | C5 | 0.6° | 0.5° |
| C2 | C3 | C4 | H1 | 179.5° | 179.7° |
| C3 | C2 | C1 | H8 | 179.9° | 180.0° |
| C6 | C5 | C4 | C3 | 1.0° | 0.2° |
| C6 | C5 | C4 | H2 | 180.0° | 180.0° |
| C6 | C5 | C4 | H1 | 179.0° | 180.0° |
| C5 | C6 | C1 | H8 | 179.4° | 179.7° |
| C13 | C8 | C9 | C3 | 170.3° | 180.0° |
| C13 | C8 | C9 | N10 | 0.4° | 0.2° |
| C8 | C13 | N12 | C15 | 179.9° | 180.0° |
| C8 | C13 | N12 | C11 | 0.0° | 0.4° |
| C9 | C8 | C13 | N12 | 0.5° | 0.0° |
| C8 | C9 | C3 | N10 | 169.8° | 179.7° |
| C8 | C9 | C3 | C4 | 176.5° | 179.5° |
| C8 | C9 | N10 | C11 | 0.1° | 0.0° |
| C13 | N12 | C15 | C11 | 179.9° | 179.7° |
| C13 | N12 | C15 | C16 | 88.8° | 90.0° |
| C13 | N12 | C11 | N10 | 0.5° | 0.6° |
| C13 | N12 | C11 | S23 | 179.5° | 179.8° |
| C13 | N12 | C15 | H4 | 151.2° | 30.0° |
| C13 | N12 | C15 | H5 | 31.2° | 150.0° |
| C9 | C3 | C4 | C5 | 174.8° | 180.0° |
| C3 | C9 | N10 | C11 | 168.9° | 179.8° |
| C9 | C3 | C4 | H1 | 5.2° | 0.3° |
| C4 | C3 | C9 | N10 | 6.7° | 0.3° |
| C3 | C4 | C5 | H1 | 180.0° | 179.8° |
| C3 | C4 | C5 | H2 | 179.0° | 179.7° |
| C9 | N10 | C11 | N12 | 0.6° | 0.4° |
| C9 | N10 | C11 | S23 | 179.5° | 180.0° |
| C4 | C5 | C6 | H3 | 179.0° | 180.0° |
| N12 | C15 | C16 | H4 | 120.0° | 120.0° |
| N12 | C15 | C16 | H5 | 120.0° | 120.0° |
| C15 | N12 | C11 | N10 | 179.4° | 179.8° |
| C15 | N12 | C11 | S23 | 0.5° | 0.1° |
| N12 | C15 | C16 | C17 | 163.0° | 180.0° |
| N12 | C15 | H4 | H5 | 120.0° | 120.0° |
| N12 | C15 | C16 | H9 | 76.7° | 60.1° |
| N12 | C15 | C16 | H10 | 42.8° | 60.0° |
| C11 | N12 | C15 | C16 | 91.1° | 90.3° |
| N12 | C11 | N10 | S23 | 179.9° | 179.6° |
| N12 | C11 | S23 | C24 | 175.5° | 179.6° |
| C11 | N12 | C15 | H4 | 28.9° | 149.6° |
| C11 | N12 | C15 | H5 | 148.9° | 29.6° |
| C15 | C16 | C17 | H9 | 120.2° | 120.0° |
| C15 | C16 | C17 | H10 | 120.2° | 120.0° |
| C15 | C16 | C17 | N18 | 165.4° | 180.0° |
| C16 | C15 | H4 | H5 | 120.0° | 120.0° |
| C15 | C16 | C17 | H6 | 74.9° | 60.0° |
| C15 | C16 | C17 | H7 | 45.6° | 60.0° |
| C15 | C16 | H9 | H10 | 119.2° | 120.0° |
| N10 | C11 | S23 | C24 | 4.4° | 0.0° |
| C11 | S23 | C24 | C25 | 58.8° | 180.0° |
| C11 | S23 | C24 | H16 | 62.0° | 60.0° |
| C11 | S23 | C24 | H17 | 179.6° | 60.0° |
| C16 | C17 | N18 | H6 | 119.8° | 120.1° |
| C16 | C17 | N18 | H7 | 119.8° | 120.0° |
| C16 | C17 | N18 | C22 | 146.8° | 170.0° |
| C16 | C17 | N18 | C19 | 64.5° | 72.6° |
| C17 | C16 | C15 | H4 | 43.0° | 60.0° |
| C17 | C16 | C15 | H5 | 77.0° | 60.0° |
| C16 | C17 | H6 | H7 | 120.6° | 120.0° |
| C17 | C16 | H9 | H10 | 119.3° | 120.0° |
| S23 | C24 | C25 | H16 | 120.8° | 120.0° |
| S23 | C24 | C25 | H17 | 120.8° | 120.0° |
| S23 | C24 | C25 | O26 | 164.6° | 180.0° |
| S23 | C24 | C25 | O29 | 16.1° | 0.0° |
| S23 | C24 | H16 | H17 | 117.5° | 120.0° |
| C17 | N18 | C22 | C19 | 150.4° | 120.5° |
| C17 | N18 | C22 | C21 | 174.4° | 145.9° |
| C17 | N18 | C19 | C20 | 173.8° | 159.7° |
| N18 | C17 | H6 | H7 | 120.6° | 120.0° |
| N18 | C17 | C16 | H9 | 45.1° | 60.0° |
| N18 | C17 | C16 | H10 | 74.4° | 60.0° |
| C17 | N18 | C22 | H19 | 55.5° | 26.5° |
| C17 | N18 | C22 | H20 | 66.7° | 94.8° |
| C17 | N18 | C19 | H25 | 67.3° | 81.8° |
| C17 | N18 | C19 | H26 | 54.9° | 41.3° |
| C24 | C25 | O26 | O29 | 179.3° | 180.0° |
| C24 | C25 | O26 | C27 | 168.2° | 180.0° |
| C25 | C24 | H16 | H17 | 117.6° | 120.0° |
| N18 | C22 | C21 | H19 | 118.9° | 119.4° |
| N18 | C22 | C21 | H20 | 118.9° | 119.3° |
| N18 | C22 | C21 | C20 | 13.6° | 1.3° |
| C22 | N18 | C19 | C20 | 23.7° | 39.2° |
| C22 | N18 | C17 | H6 | 93.4° | 69.9° |
| C22 | N18 | C17 | H7 | 27.0° | 50.0° |
| N18 | C22 | H19 | H20 | 123.2° | 121.2° |
| N18 | C22 | C21 | H21 | 133.3° | 120.1° |
| N18 | C22 | C21 | H22 | 106.1° | 117.7° |
| C22 | N18 | C19 | H25 | 142.6° | 157.7° |
| C22 | N18 | C19 | H26 | 95.2° | 79.2° |
| C19 | N18 | C22 | C21 | 23.9° | 25.4° |
| N18 | C19 | C20 | C21 | 13.1° | 37.4° |
| N18 | C19 | C20 | H25 | 118.9° | 118.5° |
| N18 | C19 | C20 | H26 | 118.9° | 118.5° |
| C19 | N18 | C17 | H6 | 55.3° | 47.4° |
| C19 | N18 | C17 | H7 | 175.7° | 167.3° |
| C19 | N18 | C22 | H19 | 95.0° | 94.0° |
| C19 | N18 | C22 | H20 | 142.8° | 144.7° |
| N18 | C19 | C20 | H23 | 132.8° | 155.8° |
| N18 | C19 | C20 | H24 | 106.6° | 81.0° |
| N18 | C19 | H25 | H26 | 123.2° | 123.1° |
| C22 | C21 | C20 | H21 | 119.7° | 118.8° |
| C22 | C21 | C20 | H22 | 119.7° | 118.9° |
| C22 | C21 | C20 | C19 | 0.3° | 21.9° |
| C21 | C22 | H19 | H20 | 123.2° | 121.2° |
| C22 | C21 | H21 | H22 | 120.9° | 122.1° |
| C22 | C21 | C20 | H23 | 119.4° | 140.3° |
| C22 | C21 | C20 | H24 | 120.0° | 96.6° |
| C25 | O26 | C27 | C28 | 78.3° | 180.0° |
| C25 | O26 | C27 | H11 | 42.0° | 59.9° |
| C25 | O26 | C27 | H12 | 161.5° | 60.0° |
| O26 | C25 | C24 | H16 | 43.8° | 60.0° |
| O26 | C25 | C24 | H17 | 74.6° | 60.0° |
| O29 | C25 | O26 | C27 | 12.4° | 0.0° |
| O29 | C25 | C24 | H16 | 136.9° | 120.0° |
| O29 | C25 | C24 | H17 | 104.6° | 120.0° |
| O26 | C27 | C28 | H11 | 120.3° | 120.1° |
| O26 | C27 | C28 | H12 | 120.2° | 120.0° |
| O26 | C27 | H11 | H12 | 119.2° | 120.0° |
| O26 | C27 | C28 | H13 | 180.0° | 180.0° |
| O26 | C27 | C28 | H14 | 60.0° | 60.0° |
| O26 | C27 | C28 | H15 | 60.0° | 60.0° |
| C28 | C27 | H11 | H12 | 119.3° | 119.9° |
| C27 | C28 | H13 | H14 | 120.0° | 120.0° |
| C27 | C28 | H13 | H15 | 120.0° | 120.0° |
| C27 | C28 | H14 | H15 | 120.0° | 120.0° |
| C21 | C20 | C19 | H23 | 119.7° | 118.4° |
| C21 | C20 | C19 | H24 | 119.7° | 118.4° |
| C20 | C21 | C22 | H19 | 105.3° | 118.2° |
| C20 | C21 | C22 | H20 | 132.5° | 120.6° |
| C20 | C21 | H21 | H22 | 120.9° | 122.2° |
| C21 | C20 | H23 | H24 | 120.9° | 123.1° |
| C21 | C20 | C19 | H25 | 132.0° | 155.9° |
| C21 | C20 | C19 | H26 | 105.8° | 81.1° |
| C19 | C20 | C21 | H21 | 120.1° | 96.9° |
| C19 | C20 | C21 | H22 | 119.4° | 140.8° |
| C19 | C20 | H23 | H24 | 120.8° | 123.3° |
| C20 | C19 | H25 | H26 | 123.2° | 123.1° |
| H1 | C4 | C5 | H2 | 1.0° | 0.0° |
| H2 | C5 | C6 | H3 | 1.1° | 0.0° |
| H3 | C6 | C1 | H8 | 0.6° | 0.2° |
| H4 | C15 | C16 | H9 | 163.3° | 60.0° |
| H4 | C15 | C16 | H10 | 77.2° | 180.0° |
| H5 | C15 | C16 | H9 | 43.2° | 180.0° |
| H5 | C15 | C16 | H10 | 162.7° | 60.0° |
| H6 | C17 | C16 | H9 | 164.9° | 179.9° |
| H6 | C17 | C16 | H10 | 45.4° | 60.0° |
| H7 | C17 | C16 | H9 | 74.7° | 60.0° |
| H7 | C17 | C16 | H10 | 165.8° | 180.0° |
| H11 | C27 | C28 | H13 | 59.7° | 59.9° |
| H11 | C27 | C28 | H14 | 179.7° | 179.9° |
| H11 | C27 | C28 | H15 | 60.3° | 60.1° |
| H12 | C27 | C28 | H13 | 59.8° | 60.0° |
| H12 | C27 | C28 | H14 | 60.2° | 60.0° |
| H12 | C27 | C28 | H15 | 179.8° | 180.0° |
| H13 | C28 | H14 | H15 | 120.0° | 120.0° |
| H19 | C22 | C21 | H21 | 14.5° | 0.7° |
| H19 | C22 | C21 | H22 | 135.0° | 122.9° |
| H20 | C22 | C21 | H21 | 107.8° | 120.5° |
| H20 | C22 | C21 | H22 | 12.8° | 1.7° |
| H21 | C21 | C20 | H23 | 0.4° | 21.5° |
| H21 | C21 | C20 | H24 | 120.2° | 144.6° |
| H22 | C21 | C20 | H23 | 120.9° | 100.8° |
| H22 | C21 | C20 | H24 | 0.3° | 22.3° |
| H23 | C20 | C19 | H25 | 108.3° | 85.7° |
| H23 | C20 | C19 | H26 | 13.9° | 37.3° |
| H24 | C20 | C19 | H25 | 12.3° | 37.4° |
| H24 | C20 | C19 | H26 | 134.5° | 160.5° |
