A1IJI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C15 | sing | 1.53Å | 1.53Å | |
| C13 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.41Å | Aromatic |
| O1 | C15 | sing | 1.43Å | 1.50Å | |
| O1 | C14 | sing | 1.36Å | 1.42Å | |
| C15 | C17 | sing | 1.53Å | 1.52Å | |
| C15 | C18 | sing | 1.53Å | 1.51Å | |
| C12 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
| C14 | C19 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | C10 | sing | 1.48Å | 1.47Å | |
| C11 | C20 | doub | 1.39Å | 1.40Å | Aromatic |
| N1 | C1 | sing | 1.38Å | 1.33Å | |
| C19 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | C2 | sing | 1.46Å | 1.41Å | Aromatic |
| C10 | N4 | doub | 1.31Å | 1.32Å | Aromatic |
| C1 | C2 | sing | 1.40Å | 1.40Å | Aromatic |
| C1 | N6 | doub | 1.33Å | 1.35Å | Aromatic |
| C2 | C3 | doub | 1.41Å | 1.41Å | Aromatic |
| N4 | N2 | sing | 1.40Å | 1.39Å | Aromatic |
| N6 | C21 | sing | 1.32Å | 1.34Å | Aromatic |
| C3 | N2 | sing | 1.36Å | 1.36Å | Aromatic |
| C3 | N5 | sing | 1.33Å | 1.35Å | Aromatic |
| C5 | C4 | sing | 1.53Å | 1.53Å | |
| C5 | C6 | sing | 1.53Å | 1.52Å | |
| N2 | C4 | sing | 1.46Å | 1.48Å | |
| C21 | N5 | doub | 1.32Å | 1.33Å | Aromatic |
| C4 | C9 | sing | 1.53Å | 1.56Å | |
| C6 | N3 | sing | 1.47Å | 1.48Å | |
| N3 | C7 | sing | 1.47Å | 1.47Å | |
| N3 | C8 | sing | 1.47Å | 1.47Å | |
| C9 | C8 | sing | 1.53Å | 1.52Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C17 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H24 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.08Å | 1.08Å | |
| C20 | H27 | sing | 1.08Å | 1.08Å | |
| C21 | H28 | sing | 1.08Å | 1.08Å | |
| N1 | H2 | sing | 0.97Å | 1.00Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.09Å | 1.10Å | |
| C5 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C6 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H10 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C7 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C8 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.08Å | 1.08Å | |
| C13 | H16 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C16 | C15 | O1 | 111.2° | 109.4° |
| C16 | C15 | C17 | 110.8° | 109.4° |
| C16 | C15 | C18 | 108.5° | 109.5° |
| C15 | C16 | H18 | 109.5° | 109.5° |
| C15 | C16 | H19 | 109.5° | 109.5° |
| C15 | C16 | H17 | 109.5° | 109.5° |
| C12 | C13 | C14 | 121.1° | 120.1° |
| C13 | C12 | C11 | 120.0° | 119.9° |
| C13 | C12 | H15 | 120.0° | 120.0° |
| C12 | C13 | H16 | 119.5° | 120.0° |
| C13 | C14 | O1 | 119.6° | 119.9° |
| C13 | C14 | C19 | 118.4° | 120.1° |
| C14 | C13 | H16 | 119.5° | 120.0° |
| C15 | O1 | C14 | 130.4° | 117.0° |
| O1 | C15 | C17 | 109.1° | 109.5° |
| O1 | C15 | C18 | 107.8° | 109.5° |
| O1 | C14 | C19 | 121.7° | 119.9° |
| C17 | C15 | C18 | 109.3° | 109.5° |
| C15 | C17 | H21 | 109.5° | 109.5° |
| C15 | C17 | H22 | 109.5° | 109.5° |
| C15 | C17 | H20 | 109.5° | 109.5° |
| C15 | C18 | H24 | 109.5° | 109.5° |
| C15 | C18 | H25 | 109.5° | 109.5° |
| C15 | C18 | H23 | 109.4° | 109.4° |
| C12 | C11 | C10 | 124.4° | 120.0° |
| C12 | C11 | C20 | 118.2° | 119.9° |
| C11 | C12 | H15 | 120.0° | 120.1° |
| C14 | C19 | C20 | 120.2° | 120.1° |
| C14 | C19 | H26 | 119.9° | 119.9° |
| C10 | C11 | C20 | 117.3° | 120.1° |
| C11 | C10 | C2 | 134.2° | 126.3° |
| C11 | C10 | N4 | 116.2° | 126.3° |
| C11 | C20 | C19 | 122.0° | 119.9° |
| C11 | C20 | H27 | 119.0° | 120.1° |
| N1 | C1 | C2 | 121.9° | 120.9° |
| N1 | C1 | N6 | 118.3° | 120.8° |
| C1 | N1 | H2 | 109.5° | 120.0° |
| C1 | N1 | H1 | 109.5° | 120.0° |
| C20 | C19 | H26 | 119.9° | 120.0° |
| C19 | C20 | H27 | 119.0° | 120.0° |
| C2 | C10 | N4 | 108.9° | 107.4° |
| C10 | C2 | C1 | 138.0° | 135.0° |
| C10 | C2 | C3 | 106.3° | 106.5° |
| C10 | N4 | N2 | 108.8° | 109.9° |
| C2 | C1 | N6 | 119.7° | 118.3° |
| C1 | C2 | C3 | 115.6° | 118.6° |
| C1 | N6 | C21 | 118.2° | 121.1° |
| C2 | C3 | N2 | 107.1° | 106.9° |
| C2 | C3 | N5 | 125.4° | 118.7° |
| N4 | N2 | C3 | 108.7° | 109.4° |
| N4 | N2 | C4 | 120.2° | 125.3° |
| N6 | C21 | N5 | 128.2° | 122.7° |
| N6 | C21 | H28 | 115.9° | 118.6° |
| N2 | C3 | N5 | 127.5° | 134.4° |
| C3 | N2 | C4 | 130.4° | 125.3° |
| C3 | N5 | C21 | 112.9° | 120.6° |
| C4 | C5 | C6 | 109.8° | 109.3° |
| C5 | C4 | N2 | 113.7° | 109.5° |
| C5 | C4 | C9 | 112.0° | 109.2° |
| C5 | C4 | H3 | 107.5° | 109.6° |
| C4 | C5 | H4 | 109.4° | 109.5° |
| C4 | C5 | H5 | 109.4° | 109.5° |
| C5 | C6 | N3 | 110.7° | 109.5° |
| C6 | C5 | H4 | 109.4° | 109.5° |
| C6 | C5 | H5 | 109.4° | 109.5° |
| C5 | C6 | H6 | 109.2° | 109.5° |
| C5 | C6 | H7 | 109.2° | 109.4° |
| N2 | C4 | C9 | 108.3° | 109.5° |
| N2 | C4 | H3 | 108.0° | 109.6° |
| N5 | C21 | H28 | 115.9° | 118.7° |
| C4 | C9 | C8 | 113.4° | 109.3° |
| C9 | C4 | H3 | 107.2° | 109.4° |
| C4 | C9 | H14 | 108.5° | 109.5° |
| C4 | C9 | H13 | 108.5° | 109.5° |
| C6 | N3 | C7 | 110.7° | 111.0° |
| C6 | N3 | C8 | 112.2° | 111.2° |
| N3 | C6 | H6 | 109.1° | 109.5° |
| N3 | C6 | H7 | 109.2° | 109.4° |
| C7 | N3 | C8 | 110.4° | 111.0° |
| N3 | C7 | H10 | 109.5° | 109.5° |
| N3 | C7 | H8 | 109.5° | 109.5° |
| N3 | C7 | H9 | 109.4° | 109.5° |
| N3 | C8 | C9 | 112.2° | 109.5° |
| N3 | C8 | H11 | 108.8° | 109.4° |
| N3 | C8 | H12 | 108.8° | 109.5° |
| C9 | C8 | H11 | 108.8° | 109.4° |
| C9 | C8 | H12 | 108.8° | 109.4° |
| C8 | C9 | H14 | 108.5° | 109.5° |
| C8 | C9 | H13 | 108.5° | 109.5° |
| H18 | C16 | H19 | 109.5° | 109.5° |
| H18 | C16 | H17 | 109.5° | 109.4° |
| H19 | C16 | H17 | 109.5° | 109.4° |
| H21 | C17 | H22 | 109.5° | 109.5° |
| H21 | C17 | H20 | 109.4° | 109.4° |
| H22 | C17 | H20 | 109.5° | 109.5° |
| H24 | C18 | H25 | 109.4° | 109.4° |
| H24 | C18 | H23 | 109.5° | 109.5° |
| H25 | C18 | H23 | 109.5° | 109.5° |
| H2 | N1 | H1 | 109.4° | 120.0° |
| H4 | C5 | H5 | 109.5° | 109.5° |
| H6 | C6 | H7 | 109.5° | 109.4° |
| H10 | C7 | H8 | 109.4° | 109.5° |
| H10 | C7 | H9 | 109.5° | 109.5° |
| H8 | C7 | H9 | 109.5° | 109.4° |
| H11 | C8 | H12 | 109.5° | 109.5° |
| H14 | C9 | H13 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C16 | C15 | O1 | C17 | 122.6° | 119.9° |
| C16 | C15 | O1 | C18 | 118.8° | 120.0° |
| C16 | C15 | O1 | C14 | 153.0° | 176.8° |
| C16 | C15 | C17 | C18 | 119.5° | 120.0° |
| C15 | C16 | H18 | H19 | 120.0° | 120.0° |
| C15 | C16 | H18 | H17 | 120.0° | 120.0° |
| C15 | C16 | H19 | H17 | 120.0° | 120.0° |
| C16 | C15 | C17 | H21 | 180.0° | 169.5° |
| C16 | C15 | C17 | H22 | 60.0° | 49.6° |
| C16 | C15 | C17 | H20 | 60.0° | 70.5° |
| C16 | C15 | C18 | H24 | 180.0° | 79.4° |
| C16 | C15 | C18 | H25 | 60.0° | 40.5° |
| C16 | C15 | C18 | H23 | 60.0° | 160.5° |
| C12 | C13 | C14 | H16 | 180.0° | 179.7° |
| C12 | C13 | C14 | O1 | 175.5° | 180.0° |
| C13 | C12 | C11 | H15 | 180.0° | 179.9° |
| C12 | C13 | C14 | C19 | 1.2° | 0.6° |
| C13 | C12 | C11 | C10 | 179.8° | 180.0° |
| C13 | C12 | C11 | C20 | 2.2° | 0.0° |
| C13 | C14 | O1 | C15 | 148.3° | 174.4° |
| C13 | C14 | O1 | C19 | 174.1° | 179.5° |
| C14 | C13 | C12 | C11 | 2.0° | 0.3° |
| C13 | C14 | C19 | C20 | 4.2° | 0.6° |
| C13 | C14 | C19 | H26 | 175.8° | 179.7° |
| C14 | C13 | C12 | H15 | 178.0° | 179.8° |
| O1 | C15 | C17 | C18 | 117.7° | 120.1° |
| C15 | O1 | C14 | C19 | 37.5° | 5.0° |
| O1 | C15 | C16 | H18 | 180.0° | 60.0° |
| O1 | C15 | C16 | H19 | 60.0° | 60.0° |
| O1 | C15 | C16 | H17 | 60.0° | 180.0° |
| O1 | C15 | C17 | H21 | 57.2° | 49.6° |
| O1 | C15 | C17 | H22 | 177.2° | 70.4° |
| O1 | C15 | C17 | H20 | 62.8° | 169.5° |
| O1 | C15 | C18 | H24 | 59.5° | 160.6° |
| O1 | C15 | C18 | H25 | 60.5° | 79.5° |
| O1 | C15 | C18 | H23 | 179.5° | 40.5° |
| C14 | O1 | C15 | C17 | 30.4° | 56.9° |
| C14 | O1 | C15 | C18 | 88.2° | 63.2° |
| O1 | C14 | C19 | C20 | 178.4° | 180.0° |
| O1 | C14 | C19 | H26 | 1.6° | 0.2° |
| O1 | C14 | C13 | H16 | 4.4° | 0.3° |
| C17 | C15 | C16 | H18 | 58.4° | 60.0° |
| C17 | C15 | C16 | H19 | 178.4° | 180.0° |
| C17 | C15 | C16 | H17 | 61.6° | 60.0° |
| C15 | C17 | H21 | H22 | 120.0° | 120.0° |
| C15 | C17 | H21 | H20 | 120.0° | 119.9° |
| C15 | C17 | H22 | H20 | 120.0° | 120.1° |
| C17 | C15 | C18 | H24 | 59.1° | 40.5° |
| C17 | C15 | C18 | H25 | 179.0° | 160.5° |
| C17 | C15 | C18 | H23 | 61.0° | 79.5° |
| C18 | C15 | C16 | H18 | 61.6° | 180.0° |
| C18 | C15 | C16 | H19 | 58.4° | 60.0° |
| C18 | C15 | C16 | H17 | 178.4° | 60.0° |
| C18 | C15 | C17 | H21 | 60.5° | 70.5° |
| C18 | C15 | C17 | H22 | 59.5° | 169.5° |
| C18 | C15 | C17 | H20 | 179.5° | 49.4° |
| C15 | C18 | H24 | H25 | 120.0° | 120.0° |
| C15 | C18 | H24 | H23 | 120.0° | 120.0° |
| C15 | C18 | H25 | H23 | 120.0° | 120.0° |
| C12 | C11 | C10 | C20 | 177.6° | 179.9° |
| C12 | C11 | C20 | C19 | 0.8° | 0.1° |
| C12 | C11 | C10 | C2 | 50.3° | 52.2° |
| C12 | C11 | C10 | N4 | 140.5° | 128.0° |
| C12 | C11 | C20 | H27 | 179.2° | 179.9° |
| C11 | C12 | C13 | H16 | 178.0° | 180.0° |
| C14 | C19 | C20 | C11 | 4.1° | 0.3° |
| C14 | C19 | C20 | H26 | 180.0° | 179.7° |
| C14 | C19 | C20 | H27 | 175.9° | 179.8° |
| C19 | C14 | C13 | H16 | 178.8° | 179.7° |
| C10 | C11 | C20 | C19 | 176.9° | 180.0° |
| C11 | C10 | C2 | N4 | 169.8° | 179.8° |
| C11 | C10 | C2 | C1 | 8.4° | 0.0° |
| C11 | C10 | C2 | C3 | 172.4° | 179.8° |
| C11 | C10 | N4 | N2 | 175.8° | 179.8° |
| C10 | C11 | C20 | H27 | 3.1° | 0.2° |
| C10 | C11 | C12 | H15 | 0.2° | 0.1° |
| C11 | C20 | C19 | H27 | 180.0° | 179.9° |
| C20 | C11 | C10 | C2 | 127.3° | 127.9° |
| C20 | C11 | C10 | N4 | 42.0° | 52.0° |
| C11 | C20 | C19 | H26 | 176.0° | 180.0° |
| C20 | C11 | C12 | H15 | 177.8° | 180.0° |
| N1 | C1 | C2 | C10 | 4.3° | 0.0° |
| N1 | C1 | C2 | N6 | 175.8° | 180.0° |
| N1 | C1 | C2 | C3 | 176.5° | 179.8° |
| N1 | C1 | N6 | C21 | 177.4° | 180.0° |
| C1 | N1 | H2 | H1 | 120.0° | 180.0° |
| C10 | C2 | C1 | C3 | 179.1° | 179.8° |
| C10 | C2 | C1 | N6 | 179.8° | 180.0° |
| C2 | C10 | N4 | N2 | 3.9° | 0.4° |
| C10 | C2 | C3 | N2 | 0.3° | 0.2° |
| C10 | C2 | C3 | N5 | 178.4° | 179.7° |
| N4 | C10 | C2 | C1 | 178.2° | 179.9° |
| N4 | C10 | C2 | C3 | 2.6° | 0.3° |
| C10 | N4 | N2 | C3 | 3.8° | 0.3° |
| C10 | N4 | N2 | C4 | 175.7° | 179.8° |
| C2 | C1 | N6 | C21 | 1.4° | 0.0° |
| C1 | C2 | C3 | N2 | 179.6° | 180.0° |
| C1 | C2 | C3 | N5 | 1.0° | 0.4° |
| C2 | C1 | N1 | H2 | 175.9° | 17.8° |
| C2 | C1 | N1 | H1 | 64.1° | 162.2° |
| N6 | C1 | C2 | C3 | 0.7° | 0.3° |
| C1 | N6 | C21 | N5 | 0.7° | 0.0° |
| C1 | N6 | C21 | H28 | 179.3° | 179.8° |
| N6 | C1 | N1 | H2 | 0.0° | 162.2° |
| N6 | C1 | N1 | H1 | 120.0° | 17.8° |
| C2 | C3 | N2 | N4 | 2.1° | 0.1° |
| C2 | C3 | N2 | N5 | 178.6° | 179.5° |
| C2 | C3 | N2 | C4 | 172.9° | 180.0° |
| C2 | C3 | N5 | C21 | 1.7° | 0.4° |
| N4 | N2 | C3 | C4 | 170.8° | 179.9° |
| N4 | N2 | C3 | N5 | 179.3° | 179.4° |
| N4 | N2 | C4 | C5 | 58.3° | 59.7° |
| N4 | N2 | C4 | C9 | 66.8° | 60.0° |
| N4 | N2 | C4 | H3 | 177.4° | 179.9° |
| N6 | C21 | N5 | C3 | 0.8° | 0.2° |
| N6 | C21 | N5 | H28 | 180.0° | 179.8° |
| C3 | N2 | C4 | C5 | 131.8° | 120.4° |
| N2 | C3 | N5 | C21 | 179.9° | 179.8° |
| C3 | N2 | C4 | C9 | 103.0° | 119.9° |
| C3 | N2 | C4 | H3 | 12.7° | 0.1° |
| N5 | C3 | N2 | C4 | 8.5° | 0.5° |
| C3 | N5 | C21 | H28 | 179.2° | 180.0° |
| C4 | C5 | C6 | H4 | 120.1° | 120.0° |
| C4 | C5 | C6 | H5 | 120.1° | 119.9° |
| C5 | C4 | N2 | C9 | 125.1° | 119.7° |
| C5 | C4 | N2 | H3 | 119.1° | 120.2° |
| C5 | C4 | C9 | H3 | 117.6° | 119.9° |
| C4 | C5 | C6 | N3 | 59.4° | 59.1° |
| C5 | C4 | C9 | C8 | 46.0° | 57.6° |
| C4 | C5 | H4 | H5 | 119.9° | 120.1° |
| C4 | C5 | C6 | H6 | 179.6° | 179.3° |
| C4 | C5 | C6 | H7 | 60.8° | 60.8° |
| C5 | C4 | C9 | H14 | 166.6° | 177.6° |
| C5 | C4 | C9 | H13 | 74.6° | 62.3° |
| C6 | C5 | C4 | N2 | 174.4° | 177.5° |
| C6 | C5 | C4 | C9 | 51.3° | 57.6° |
| C5 | C6 | N3 | H6 | 120.2° | 120.1° |
| C5 | C6 | N3 | H7 | 120.2° | 119.9° |
| C5 | C6 | N3 | C7 | 174.0° | 174.1° |
| C5 | C6 | N3 | C8 | 62.2° | 61.7° |
| C6 | C5 | C4 | H3 | 66.2° | 62.2° |
| C6 | C5 | H4 | H5 | 119.9° | 120.1° |
| C5 | C6 | H6 | H7 | 119.4° | 119.9° |
| N2 | C4 | C9 | H3 | 116.3° | 120.2° |
| N2 | C4 | C9 | C8 | 172.1° | 177.5° |
| N2 | C4 | C5 | H4 | 54.3° | 57.6° |
| N2 | C4 | C5 | H5 | 65.6° | 62.5° |
| N2 | C4 | C9 | H14 | 67.3° | 62.5° |
| N2 | C4 | C9 | H13 | 51.5° | 57.6° |
| C4 | C9 | C8 | N3 | 47.1° | 59.2° |
| C4 | C9 | C8 | H14 | 120.6° | 120.0° |
| C4 | C9 | C8 | H13 | 120.6° | 119.9° |
| C9 | C4 | C5 | H4 | 68.8° | 62.3° |
| C9 | C4 | C5 | H5 | 171.3° | 177.6° |
| C4 | C9 | C8 | H11 | 167.5° | 179.1° |
| C4 | C9 | C8 | H12 | 73.3° | 60.9° |
| C4 | C9 | H14 | H13 | 118.2° | 120.0° |
| C6 | N3 | C7 | C8 | 124.8° | 124.3° |
| C6 | N3 | C8 | C9 | 55.4° | 61.7° |
| N3 | C6 | C5 | H4 | 60.6° | 60.8° |
| N3 | C6 | C5 | H5 | 179.5° | 179.1° |
| N3 | C6 | H6 | H7 | 119.4° | 120.0° |
| C6 | N3 | C7 | H10 | 180.0° | 60.0° |
| C6 | N3 | C7 | H8 | 60.0° | 179.9° |
| C6 | N3 | C7 | H9 | 60.0° | 60.0° |
| C6 | N3 | C8 | H11 | 175.8° | 178.3° |
| C6 | N3 | C8 | H12 | 65.0° | 58.3° |
| C7 | N3 | C8 | C9 | 179.3° | 174.1° |
| C7 | N3 | C6 | H6 | 53.8° | 54.0° |
| C7 | N3 | C6 | H7 | 65.8° | 65.9° |
| N3 | C7 | H10 | H8 | 120.0° | 120.0° |
| N3 | C7 | H10 | H9 | 120.0° | 120.0° |
| N3 | C7 | H8 | H9 | 120.0° | 120.0° |
| C7 | N3 | C8 | H11 | 60.3° | 54.2° |
| C7 | N3 | C8 | H12 | 58.9° | 65.8° |
| N3 | C8 | C9 | H11 | 120.4° | 120.0° |
| N3 | C8 | C9 | H12 | 120.4° | 120.1° |
| C8 | N3 | C6 | H6 | 177.6° | 178.2° |
| C8 | N3 | C6 | H7 | 58.0° | 58.2° |
| C8 | N3 | C7 | H10 | 55.2° | 64.2° |
| C8 | N3 | C7 | H8 | 175.2° | 55.8° |
| C8 | N3 | C7 | H9 | 64.9° | 175.8° |
| N3 | C8 | H11 | H12 | 118.8° | 120.0° |
| N3 | C8 | C9 | H14 | 167.7° | 179.2° |
| N3 | C8 | C9 | H13 | 73.5° | 60.7° |
| C8 | C9 | C4 | H3 | 71.6° | 62.3° |
| C9 | C8 | H11 | H12 | 118.8° | 119.9° |
| C8 | C9 | H14 | H13 | 118.2° | 120.1° |
| H18 | C16 | H19 | H17 | 120.0° | 120.0° |
| H21 | C17 | H22 | H20 | 119.9° | 119.9° |
| H24 | C18 | H25 | H23 | 120.0° | 120.0° |
| H26 | C19 | C20 | H27 | 4.0° | 0.1° |
| H3 | C4 | C5 | H4 | 173.8° | 177.9° |
| H3 | C4 | C5 | H5 | 53.9° | 57.7° |
| H3 | C4 | C9 | H14 | 48.9° | 57.7° |
| H3 | C4 | C9 | H13 | 167.8° | 177.8° |
| H4 | C5 | C6 | H6 | 59.6° | 59.3° |
| H4 | C5 | C6 | H7 | 179.2° | 179.2° |
| H5 | C5 | C6 | H6 | 60.3° | 60.8° |
| H5 | C5 | C6 | H7 | 59.3° | 59.1° |
| H10 | C7 | H8 | H9 | 120.0° | 120.0° |
| H11 | C8 | C9 | H14 | 71.9° | 60.8° |
| H11 | C8 | C9 | H13 | 46.9° | 59.3° |
| H12 | C8 | C9 | H14 | 47.3° | 59.1° |
| H12 | C8 | C9 | H13 | 166.1° | 179.2° |
| H15 | C12 | C13 | H16 | 2.0° | 0.0° |
