XQQ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C26 | C25 | doub | 1.38Å | 1.37Å | Aromatic |
| C26 | C24 | sing | 1.39Å | 1.38Å | Aromatic |
| C25 | N6 | sing | 1.32Å | 1.34Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.37Å | Aromatic |
| N6 | C22 | doub | 1.32Å | 1.34Å | Aromatic |
| C23 | C22 | sing | 1.39Å | 1.40Å | Aromatic |
| C22 | N5 | sing | 1.39Å | 1.40Å | |
| N5 | C20 | sing | 1.35Å | 1.37Å | |
| O2 | C20 | doub | 1.22Å | 1.23Å | |
| C20 | C18 | sing | 1.48Å | 1.50Å | |
| C18 | C16 | doub | 1.40Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.40Å | 1.39Å | Aromatic |
| C16 | C14 | sing | 1.37Å | 1.38Å | Aromatic |
| C17 | C15 | doub | 1.36Å | 1.38Å | Aromatic |
| C14 | C11 | doub | 1.40Å | 1.39Å | Aromatic |
| C15 | C11 | sing | 1.40Å | 1.39Å | Aromatic |
| C11 | C8 | sing | 1.48Å | 1.48Å | |
| C21 | C19 | sing | 1.51Å | 1.50Å | |
| C19 | C13 | doub | 1.33Å | 1.32Å | |
| O1 | C7 | doub | 1.22Å | 1.22Å | |
| C8 | N2 | sing | 1.34Å | 1.40Å | Aromatic |
| C8 | C6 | doub | 1.39Å | 1.40Å | Aromatic |
| C13 | C7 | sing | 1.47Å | 1.35Å | |
| N4 | C10 | sing | 1.39Å | 1.33Å | |
| N2 | C5 | doub | 1.31Å | 1.36Å | Aromatic |
| C7 | N1 | sing | 1.35Å | 1.35Å | |
| C6 | C10 | sing | 1.41Å | 1.42Å | Aromatic |
| C6 | N7 | sing | 1.38Å | 1.39Å | Aromatic |
| C10 | N3 | doub | 1.32Å | 1.36Å | Aromatic |
| N1 | C4 | sing | 1.47Å | 1.47Å | |
| N1 | C1 | sing | 1.47Å | 1.48Å | |
| C5 | N7 | sing | 1.35Å | 1.39Å | Aromatic |
| C5 | C1 | sing | 1.51Å | 1.50Å | |
| C4 | C3 | sing | 1.55Å | 1.51Å | |
| N7 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C1 | C2 | sing | 1.54Å | 1.54Å | |
| N3 | C12 | sing | 1.34Å | 1.33Å | Aromatic |
| C3 | C2 | sing | 1.55Å | 1.50Å | |
| C9 | C12 | doub | 1.35Å | 1.37Å | Aromatic |
| C4 | H10 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C15 | H15 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.08Å | 1.08Å | |
| C26 | H25 | sing | 1.08Å | 1.08Å | |
| C1 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C14 | H14 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C19 | H18 | sing | 1.08Å | 1.08Å | |
| C2 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.08Å | 1.08Å | |
| C25 | H24 | sing | 1.08Å | 1.08Å | |
| C3 | H8 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H11 | sing | 1.08Å | 1.08Å | |
| N4 | H1 | sing | 0.97Å | 1.00Å | |
| N4 | H2 | sing | 0.97Å | 1.00Å | |
| N5 | H3 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C26 | C24 | 118.2° | 119.3° |
| C26 | C25 | N6 | 123.8° | 120.8° |
| C25 | C26 | H25 | 120.9° | 120.4° |
| C26 | C25 | H24 | 118.1° | 119.6° |
| C26 | C24 | C23 | 119.8° | 118.5° |
| C26 | C24 | H23 | 120.1° | 120.8° |
| C24 | C26 | H25 | 120.9° | 120.3° |
| C25 | N6 | C22 | 117.2° | 121.6° |
| N6 | C25 | H24 | 118.1° | 119.6° |
| C24 | C23 | C22 | 118.1° | 119.1° |
| C23 | C24 | H23 | 120.1° | 120.7° |
| C24 | C23 | H22 | 121.0° | 120.4° |
| N6 | C22 | C23 | 122.9° | 120.6° |
| N6 | C22 | N5 | 112.6° | 119.7° |
| C23 | C22 | N5 | 124.4° | 119.7° |
| C22 | C23 | H22 | 121.0° | 120.5° |
| C22 | N5 | C20 | 128.2° | 120.0° |
| C22 | N5 | H3 | 115.9° | 120.0° |
| N5 | C20 | O2 | 123.5° | 120.0° |
| N5 | C20 | C18 | 115.9° | 120.0° |
| C20 | N5 | H3 | 115.9° | 120.0° |
| O2 | C20 | C18 | 120.6° | 120.0° |
| C20 | C18 | C16 | 121.9° | 120.0° |
| C20 | C18 | C17 | 119.8° | 120.1° |
| C16 | C18 | C17 | 118.3° | 119.9° |
| C18 | C16 | C14 | 120.9° | 120.0° |
| C18 | C16 | H16 | 119.6° | 120.0° |
| C18 | C17 | C15 | 120.8° | 120.0° |
| C18 | C17 | H17 | 119.6° | 119.9° |
| C16 | C14 | C11 | 120.7° | 120.0° |
| C16 | C14 | H14 | 119.6° | 119.9° |
| C14 | C16 | H16 | 119.6° | 120.0° |
| C17 | C15 | C11 | 120.8° | 120.0° |
| C17 | C15 | H15 | 119.6° | 120.0° |
| C15 | C17 | H17 | 119.6° | 120.0° |
| C14 | C11 | C15 | 118.4° | 120.0° |
| C14 | C11 | C8 | 120.7° | 120.0° |
| C11 | C14 | H14 | 119.7° | 120.0° |
| C15 | C11 | C8 | 120.9° | 120.0° |
| C11 | C15 | H15 | 119.6° | 119.9° |
| C11 | C8 | N2 | 120.6° | 126.5° |
| C11 | C8 | C6 | 129.5° | 126.5° |
| C21 | C19 | C13 | 125.1° | 120.0° |
| C19 | C21 | H20 | 109.5° | 109.5° |
| C19 | C21 | H21 | 109.5° | 109.5° |
| C19 | C21 | H19 | 109.5° | 109.4° |
| C21 | C19 | H18 | 117.4° | 120.0° |
| C19 | C13 | C7 | 123.8° | 120.0° |
| C19 | C13 | H13 | 118.1° | 120.0° |
| C13 | C19 | H18 | 117.4° | 120.0° |
| O1 | C7 | C13 | 120.9° | 120.0° |
| O1 | C7 | N1 | 118.4° | 120.0° |
| N2 | C8 | C6 | 109.8° | 107.0° |
| C8 | N2 | C5 | 106.2° | 109.8° |
| C8 | C6 | C10 | 133.5° | 134.6° |
| C8 | C6 | N7 | 105.8° | 106.2° |
| C13 | C7 | N1 | 120.6° | 120.0° |
| C7 | C13 | H13 | 118.1° | 120.0° |
| N4 | C10 | C6 | 123.6° | 120.3° |
| N4 | C10 | N3 | 117.6° | 120.3° |
| C10 | N4 | H1 | 109.5° | 120.0° |
| C10 | N4 | H2 | 109.5° | 120.0° |
| N2 | C5 | N7 | 110.0° | 109.7° |
| N2 | C5 | C1 | 124.2° | 125.1° |
| C7 | N1 | C4 | 122.9° | 125.7° |
| C7 | N1 | C1 | 125.5° | 125.6° |
| C10 | C6 | N7 | 120.8° | 119.1° |
| C6 | C10 | N3 | 118.8° | 119.5° |
| C6 | N7 | C5 | 108.2° | 107.2° |
| C6 | N7 | C9 | 118.0° | 118.7° |
| C10 | N3 | C12 | 119.8° | 121.2° |
| C4 | N1 | C1 | 111.6° | 108.7° |
| N1 | C4 | C3 | 102.8° | 104.8° |
| N1 | C4 | H10 | 111.1° | 110.4° |
| N1 | C4 | H9 | 111.1° | 110.4° |
| N1 | C1 | C5 | 113.8° | 109.9° |
| N1 | C1 | C2 | 101.4° | 107.3° |
| N1 | C1 | H4 | 109.2° | 109.9° |
| N7 | C5 | C1 | 125.7° | 125.1° |
| C5 | N7 | C9 | 133.8° | 134.0° |
| C5 | C1 | C2 | 114.9° | 109.9° |
| C5 | C1 | H4 | 108.9° | 109.9° |
| C4 | C3 | C2 | 102.5° | 101.5° |
| C3 | C4 | H10 | 111.1° | 110.3° |
| C3 | C4 | H9 | 111.1° | 110.4° |
| C4 | C3 | H8 | 111.2° | 111.0° |
| C4 | C3 | H7 | 111.2° | 111.0° |
| N7 | C9 | C12 | 119.0° | 119.8° |
| N7 | C9 | H11 | 120.5° | 120.0° |
| C1 | C2 | C3 | 102.8° | 102.9° |
| C2 | C1 | H4 | 108.4° | 110.0° |
| C1 | C2 | H5 | 111.1° | 110.7° |
| C1 | C2 | H6 | 111.1° | 110.7° |
| N3 | C12 | C9 | 123.6° | 121.6° |
| N3 | C12 | H12 | 118.2° | 119.2° |
| C3 | C2 | H5 | 111.1° | 110.7° |
| C3 | C2 | H6 | 111.1° | 110.8° |
| C2 | C3 | H8 | 111.2° | 111.0° |
| C2 | C3 | H7 | 111.2° | 111.0° |
| C9 | C12 | H12 | 118.2° | 119.2° |
| C12 | C9 | H11 | 120.5° | 120.1° |
| H10 | C4 | H9 | 109.5° | 110.4° |
| H20 | C21 | H21 | 109.4° | 109.5° |
| H20 | C21 | H19 | 109.5° | 109.4° |
| H21 | C21 | H19 | 109.4° | 109.5° |
| H5 | C2 | H6 | 109.5° | 110.7° |
| H8 | C3 | H7 | 109.5° | 111.0° |
| H1 | N4 | H2 | 109.5° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C26 | C24 | H25 | 180.0° | 179.8° |
| C26 | C25 | N6 | H24 | 180.0° | 179.9° |
| C25 | C26 | C24 | C23 | 0.0° | 0.1° |
| C26 | C25 | N6 | C22 | 0.1° | 0.1° |
| C25 | C26 | C24 | H23 | 180.0° | 179.8° |
| C24 | C26 | C25 | N6 | 0.0° | 0.2° |
| C26 | C24 | C23 | H23 | 180.0° | 179.9° |
| C26 | C24 | C23 | C22 | 0.1° | 0.1° |
| C26 | C24 | C23 | H22 | 179.9° | 180.0° |
| C24 | C26 | C25 | H24 | 180.0° | 180.0° |
| C25 | N6 | C22 | C23 | 0.2° | 0.4° |
| C25 | N6 | C22 | N5 | 179.9° | 180.0° |
| N6 | C25 | C26 | H25 | 180.0° | 180.0° |
| C24 | C23 | C22 | N6 | 0.2° | 0.4° |
| C24 | C23 | C22 | H22 | 180.0° | 179.9° |
| C24 | C23 | C22 | N5 | 179.9° | 180.0° |
| C23 | C24 | C26 | H25 | 180.0° | 179.9° |
| N6 | C22 | C23 | N5 | 179.7° | 179.7° |
| N6 | C22 | N5 | C20 | 175.9° | 5.0° |
| N6 | C22 | C23 | H22 | 179.9° | 179.7° |
| C22 | N6 | C25 | H24 | 179.9° | 179.8° |
| N6 | C22 | N5 | H3 | 4.1° | 175.0° |
| C23 | C22 | N5 | C20 | 4.4° | 174.7° |
| C22 | C23 | C24 | H23 | 179.9° | 180.0° |
| C23 | C22 | N5 | H3 | 175.6° | 5.3° |
| C22 | N5 | C20 | H3 | 180.0° | 180.0° |
| C22 | N5 | C20 | O2 | 6.5° | 5.0° |
| C22 | N5 | C20 | C18 | 175.8° | 174.9° |
| N5 | C22 | C23 | H22 | 0.2° | 0.0° |
| N5 | C20 | O2 | C18 | 177.7° | 179.9° |
| N5 | C20 | C18 | C16 | 28.9° | 180.0° |
| N5 | C20 | C18 | C17 | 150.0° | 0.7° |
| O2 | C20 | C18 | C16 | 153.3° | 0.1° |
| O2 | C20 | C18 | C17 | 27.9° | 179.2° |
| O2 | C20 | N5 | H3 | 173.5° | 175.0° |
| C20 | C18 | C16 | C17 | 178.8° | 179.3° |
| C20 | C18 | C16 | C14 | 179.9° | 180.0° |
| C20 | C18 | C17 | C15 | 179.8° | 179.8° |
| C20 | C18 | C17 | H17 | 0.2° | 0.1° |
| C20 | C18 | C16 | H16 | 0.1° | 0.4° |
| C18 | C20 | N5 | H3 | 4.2° | 5.1° |
| C18 | C16 | C14 | H16 | 180.0° | 179.5° |
| C16 | C18 | C17 | C15 | 0.9° | 0.5° |
| C18 | C16 | C14 | C11 | 1.3° | 0.4° |
| C16 | C18 | C17 | H17 | 179.1° | 179.4° |
| C18 | C16 | C14 | H14 | 178.7° | 179.5° |
| C17 | C18 | C16 | C14 | 1.2° | 0.7° |
| C18 | C17 | C15 | H17 | 180.0° | 180.0° |
| C18 | C17 | C15 | C11 | 0.7° | 0.0° |
| C18 | C17 | C15 | H15 | 179.2° | 179.7° |
| C17 | C18 | C16 | H16 | 178.8° | 179.7° |
| C16 | C14 | C11 | H14 | 180.0° | 180.0° |
| C16 | C14 | C11 | C15 | 1.1° | 0.1° |
| C16 | C14 | C11 | C8 | 179.4° | 179.9° |
| C17 | C15 | C11 | C14 | 0.8° | 0.3° |
| C17 | C15 | C11 | H15 | 180.0° | 179.7° |
| C17 | C15 | C11 | C8 | 179.7° | 179.7° |
| C14 | C11 | C15 | C8 | 179.5° | 180.0° |
| C14 | C11 | C8 | N2 | 63.6° | 44.4° |
| C14 | C11 | C8 | C6 | 114.1° | 135.6° |
| C14 | C11 | C15 | H15 | 179.2° | 180.0° |
| C11 | C14 | C16 | H16 | 178.6° | 180.0° |
| C15 | C11 | C8 | N2 | 115.9° | 135.6° |
| C15 | C11 | C8 | C6 | 66.5° | 44.4° |
| C11 | C15 | C17 | H17 | 179.2° | 180.0° |
| C15 | C11 | C14 | H14 | 178.9° | 180.0° |
| C11 | C8 | N2 | C6 | 178.1° | 180.0° |
| C11 | C8 | N2 | C5 | 179.5° | 180.0° |
| C11 | C8 | C6 | C10 | 1.4° | 0.1° |
| C11 | C8 | C6 | N7 | 178.6° | 180.0° |
| C8 | C11 | C15 | H15 | 0.3° | 0.0° |
| C8 | C11 | C14 | H14 | 0.6° | 0.0° |
| C21 | C19 | C13 | H18 | 180.0° | 180.0° |
| C21 | C19 | C13 | C7 | 167.5° | 179.9° |
| C21 | C19 | C13 | H13 | 12.6° | 0.0° |
| C19 | C21 | H20 | H21 | 120.0° | 120.0° |
| C19 | C21 | H20 | H19 | 120.0° | 120.0° |
| C19 | C21 | H21 | H19 | 120.0° | 120.0° |
| C19 | C13 | C7 | O1 | 22.4° | 0.1° |
| C19 | C13 | C7 | H13 | 180.0° | 179.9° |
| C19 | C13 | C7 | N1 | 155.4° | 180.0° |
| C13 | C19 | C21 | H20 | 180.0° | 179.9° |
| C13 | C19 | C21 | H21 | 60.0° | 60.0° |
| C13 | C19 | C21 | H19 | 60.0° | 60.0° |
| O1 | C7 | C13 | N1 | 177.8° | 179.9° |
| O1 | C7 | N1 | C4 | 5.1° | 180.0° |
| O1 | C7 | N1 | C1 | 172.5° | 0.2° |
| O1 | C7 | C13 | H13 | 157.6° | 180.0° |
| N2 | C8 | C6 | C10 | 179.3° | 180.0° |
| N2 | C8 | C6 | N7 | 0.8° | 0.0° |
| C8 | N2 | C5 | N7 | 1.5° | 0.0° |
| C8 | N2 | C5 | C1 | 180.0° | 180.0° |
| C8 | C6 | C10 | N4 | 0.4° | 0.0° |
| C6 | C8 | N2 | C5 | 1.4° | 0.0° |
| C8 | C6 | C10 | N7 | 179.9° | 180.0° |
| C8 | C6 | C10 | N3 | 179.4° | 180.0° |
| C8 | C6 | N7 | C5 | 0.1° | 0.0° |
| C8 | C6 | N7 | C9 | 179.4° | 180.0° |
| C13 | C7 | N1 | C4 | 177.0° | 0.1° |
| C13 | C7 | N1 | C1 | 5.4° | 179.7° |
| C7 | C13 | C19 | H18 | 12.6° | 0.1° |
| N4 | C10 | C6 | N3 | 179.8° | 179.9° |
| N4 | C10 | C6 | N7 | 179.7° | 180.0° |
| N4 | C10 | N3 | C12 | 179.9° | 179.9° |
| C10 | N4 | H1 | H2 | 120.0° | 179.9° |
| N2 | C5 | N7 | C6 | 1.0° | 0.0° |
| N2 | C5 | C1 | N1 | 10.0° | 43.6° |
| N2 | C5 | N7 | C1 | 178.5° | 180.0° |
| N2 | C5 | N7 | C9 | 179.9° | 180.0° |
| N2 | C5 | C1 | C2 | 106.3° | 74.2° |
| N2 | C5 | C1 | H4 | 132.0° | 164.6° |
| C7 | N1 | C4 | C1 | 177.9° | 179.8° |
| C7 | N1 | C1 | C5 | 71.3° | 61.9° |
| C7 | N1 | C4 | C3 | 168.6° | 155.6° |
| C7 | N1 | C1 | C2 | 164.7° | 178.7° |
| C7 | N1 | C4 | H10 | 72.5° | 36.8° |
| C7 | N1 | C4 | H9 | 49.6° | 85.5° |
| N1 | C7 | C13 | H13 | 24.6° | 0.1° |
| C7 | N1 | C1 | H4 | 50.5° | 59.1° |
| C10 | C6 | N7 | C5 | 179.8° | 180.0° |
| C10 | C6 | N7 | C9 | 0.6° | 0.0° |
| C6 | C10 | N3 | C12 | 0.3° | 0.1° |
| C6 | C10 | N4 | H1 | 179.8° | 17.8° |
| C6 | C10 | N4 | H2 | 59.8° | 162.3° |
| N7 | C6 | C10 | N3 | 0.5° | 0.1° |
| C6 | N7 | C5 | C9 | 179.1° | 180.0° |
| C6 | N7 | C5 | C1 | 179.5° | 180.0° |
| C6 | N7 | C9 | C12 | 0.4° | 0.0° |
| C6 | N7 | C9 | H11 | 179.6° | 180.0° |
| C10 | N3 | C12 | C9 | 0.2° | 0.1° |
| C10 | N3 | C12 | H12 | 179.8° | 180.0° |
| N3 | C10 | N4 | H1 | 0.0° | 162.2° |
| N3 | C10 | N4 | H2 | 120.0° | 17.7° |
| C4 | N1 | C1 | C5 | 110.8° | 118.3° |
| N1 | C4 | C3 | H10 | 118.9° | 118.8° |
| N1 | C4 | C3 | H9 | 118.9° | 118.9° |
| C4 | N1 | C1 | C2 | 13.1° | 1.1° |
| N1 | C4 | C3 | C2 | 35.3° | 37.1° |
| N1 | C4 | H10 | H9 | 123.1° | 122.3° |
| C4 | N1 | C1 | H4 | 127.3° | 120.7° |
| N1 | C4 | C3 | H8 | 154.2° | 81.0° |
| N1 | C4 | C3 | H7 | 83.6° | 155.1° |
| N1 | C1 | C5 | N7 | 168.2° | 136.4° |
| N1 | C1 | C5 | C2 | 116.3° | 117.8° |
| N1 | C1 | C5 | H4 | 122.0° | 121.0° |
| C1 | N1 | C4 | C3 | 13.6° | 24.2° |
| N1 | C1 | C2 | H4 | 114.8° | 119.5° |
| N1 | C1 | C2 | C3 | 34.8° | 22.2° |
| C1 | N1 | C4 | H10 | 105.4° | 143.0° |
| C1 | N1 | C4 | H9 | 132.5° | 94.7° |
| N1 | C1 | C2 | H5 | 153.7° | 96.2° |
| N1 | C1 | C2 | H6 | 84.1° | 140.7° |
| N7 | C5 | C1 | C2 | 75.5° | 105.8° |
| C5 | N7 | C9 | C12 | 179.4° | 180.0° |
| N7 | C5 | C1 | H4 | 46.2° | 15.4° |
| C5 | N7 | C9 | H11 | 0.6° | 0.1° |
| C1 | C5 | N7 | C9 | 1.4° | 0.0° |
| C5 | C1 | C2 | H4 | 122.0° | 121.1° |
| C5 | C1 | C2 | C3 | 88.4° | 141.6° |
| C5 | C1 | C2 | H5 | 30.5° | 23.2° |
| C5 | C1 | C2 | H6 | 152.7° | 99.9° |
| C4 | C3 | C2 | C1 | 44.0° | 35.6° |
| C4 | C3 | C2 | H8 | 118.9° | 118.1° |
| C4 | C3 | C2 | H7 | 118.9° | 118.0° |
| C3 | C4 | H10 | H9 | 123.1° | 122.3° |
| C4 | C3 | C2 | H5 | 163.0° | 82.8° |
| C4 | C3 | C2 | H6 | 74.9° | 154.0° |
| C4 | C3 | H8 | H7 | 123.2° | 123.9° |
| N7 | C9 | C12 | N3 | 0.2° | 0.1° |
| N7 | C9 | C12 | H11 | 180.0° | 179.9° |
| N7 | C9 | C12 | H12 | 179.8° | 179.9° |
| C1 | C2 | C3 | H5 | 118.9° | 118.4° |
| C1 | C2 | C3 | H6 | 118.9° | 118.4° |
| C1 | C2 | H5 | H6 | 123.1° | 123.1° |
| C1 | C2 | C3 | H8 | 162.9° | 82.5° |
| C1 | C2 | C3 | H7 | 74.8° | 153.6° |
| N3 | C12 | C9 | H12 | 180.0° | 179.9° |
| N3 | C12 | C9 | H11 | 179.8° | 180.0° |
| C2 | C3 | C4 | H10 | 83.7° | 155.9° |
| C2 | C3 | C4 | H9 | 154.2° | 81.8° |
| C3 | C2 | C1 | H4 | 149.6° | 97.3° |
| C3 | C2 | H5 | H6 | 123.1° | 123.3° |
| C2 | C3 | H8 | H7 | 123.2° | 123.9° |
| H10 | C4 | C3 | H8 | 35.2° | 37.8° |
| H10 | C4 | C3 | H7 | 157.5° | 86.1° |
| H9 | C4 | C3 | H8 | 86.9° | 160.1° |
| H9 | C4 | C3 | H7 | 35.3° | 36.2° |
| H13 | C13 | C19 | H18 | 167.4° | 180.0° |
| H15 | C15 | C17 | H17 | 0.8° | 0.4° |
| H20 | C21 | H21 | H19 | 120.0° | 120.0° |
| H20 | C21 | C19 | H18 | 0.0° | 0.0° |
| H21 | C21 | C19 | H18 | 120.0° | 120.0° |
| H19 | C21 | C19 | H18 | 120.1° | 120.0° |
| H23 | C24 | C26 | H25 | 0.0° | 0.0° |
| H23 | C24 | C23 | H22 | 0.1° | 0.1° |
| H25 | C26 | C25 | H24 | 0.0° | 0.2° |
| H4 | C1 | C2 | H5 | 91.5° | 144.3° |
| H4 | C1 | C2 | H6 | 30.7° | 21.2° |
| H12 | C12 | C9 | H11 | 0.2° | 0.1° |
| H14 | C14 | C16 | H16 | 1.4° | 0.0° |
| H5 | C2 | C3 | H8 | 78.2° | 159.1° |
| H5 | C2 | C3 | H7 | 44.1° | 35.2° |
| H6 | C2 | C3 | H8 | 44.0° | 35.9° |
| H6 | C2 | C3 | H7 | 166.2° | 88.0° |
