XJN
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| N1 | C1 | sing | 1.39Å | 1.35Å | |
| C1 | N4 | doub | 1.32Å | 1.35Å | Aromatic |
| C1 | N2 | sing | 1.32Å | 1.34Å | Aromatic |
| N4 | C16 | sing | 1.33Å | 1.35Å | Aromatic |
| N2 | C2 | doub | 1.33Å | 1.34Å | Aromatic |
| C16 | C17 | sing | 1.51Å | 1.50Å | |
| C16 | C3 | doub | 1.38Å | 1.37Å | Aromatic |
| C2 | C3 | sing | 1.40Å | 1.44Å | Aromatic |
| C2 | N3 | sing | 1.39Å | 1.36Å | |
| C17 | C18 | sing | 1.53Å | 1.53Å | |
| C18 | C19 | sing | 1.53Å | 1.52Å | |
| C3 | O1 | sing | 1.36Å | 1.39Å | |
| C20 | C19 | sing | 1.53Å | 1.51Å | |
| C20 | C21 | sing | 1.53Å | 1.51Å | |
| O1 | C4 | sing | 1.43Å | 1.44Å | |
| C4 | C5 | sing | 1.53Å | 1.51Å | |
| O4 | C15 | doub | 1.21Å | 1.25Å | |
| C15 | O3 | sing | 1.34Å | 1.25Å | |
| C15 | C14 | sing | 1.51Å | 1.52Å | |
| C5 | C6 | sing | 1.53Å | 1.51Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C13 | C12 | sing | 1.51Å | 1.52Å | |
| O2 | C6 | sing | 1.43Å | 1.44Å | |
| O2 | C7 | sing | 1.36Å | 1.37Å | |
| C12 | C7 | doub | 1.39Å | 1.40Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.39Å | Aromatic |
| C7 | C8 | sing | 1.39Å | 1.38Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C8 | C9 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.37Å | Aromatic |
| O3 | H1 | sing | 0.97Å | 0.95Å | |
| C4 | H2 | sing | 1.09Å | 1.10Å | |
| C4 | H3 | sing | 1.09Å | 1.10Å | |
| N3 | H4 | sing | 0.97Å | 1.00Å | |
| N3 | H5 | sing | 0.97Å | 1.00Å | |
| N1 | H6 | sing | 0.97Å | 1.00Å | |
| N1 | H7 | sing | 0.97Å | 1.00Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C5 | H9 | sing | 1.09Å | 1.10Å | |
| C5 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.09Å | 1.10Å | |
| C6 | H12 | sing | 1.09Å | 1.10Å | |
| C10 | H13 | sing | 1.08Å | 1.08Å | |
| C11 | H14 | sing | 1.08Å | 1.08Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å | |
| C21 | H27 | sing | 1.09Å | 1.10Å | |
| C21 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.09Å | 1.10Å | |
| C9 | H30 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N1 | C1 | N4 | 117.3° | 119.2° |
| N1 | C1 | N2 | 116.7° | 119.1° |
| C1 | N1 | H6 | 109.5° | 120.0° |
| C1 | N1 | H7 | 109.5° | 120.0° |
| N4 | C1 | N2 | 126.0° | 121.7° |
| C1 | N4 | C16 | 118.0° | 121.0° |
| C1 | N2 | C2 | 116.7° | 120.7° |
| N4 | C16 | C17 | 116.4° | 120.4° |
| N4 | C16 | C3 | 120.3° | 119.2° |
| N2 | C2 | C3 | 120.7° | 118.9° |
| N2 | C2 | N3 | 118.4° | 120.6° |
| C17 | C16 | C3 | 123.3° | 120.4° |
| C16 | C17 | C18 | 110.8° | 109.5° |
| C16 | C17 | H19 | 109.2° | 109.5° |
| C16 | C17 | H20 | 109.1° | 109.5° |
| C16 | C3 | C2 | 118.3° | 118.4° |
| C16 | C3 | O1 | 120.5° | 120.8° |
| C3 | C2 | N3 | 120.9° | 120.5° |
| C2 | C3 | O1 | 121.1° | 120.8° |
| C2 | N3 | H4 | 109.5° | 120.1° |
| C2 | N3 | H5 | 109.5° | 120.0° |
| C17 | C18 | C19 | 117.3° | 109.5° |
| C18 | C17 | H19 | 109.1° | 109.5° |
| C18 | C17 | H20 | 109.2° | 109.5° |
| C17 | C18 | H21 | 107.5° | 109.5° |
| C17 | C18 | H22 | 107.5° | 109.5° |
| C18 | C19 | C20 | 114.7° | 109.5° |
| C19 | C18 | H21 | 107.5° | 109.5° |
| C19 | C18 | H22 | 107.5° | 109.5° |
| C18 | C19 | H23 | 108.1° | 109.5° |
| C18 | C19 | H24 | 108.1° | 109.5° |
| C3 | O1 | C4 | 118.0° | 117.0° |
| C19 | C20 | C21 | 111.5° | 109.5° |
| C20 | C19 | H23 | 108.1° | 109.4° |
| C20 | C19 | H24 | 108.1° | 109.4° |
| C19 | C20 | H25 | 109.0° | 109.5° |
| C19 | C20 | H26 | 109.0° | 109.5° |
| C21 | C20 | H25 | 109.0° | 109.5° |
| C21 | C20 | H26 | 109.0° | 109.5° |
| C20 | C21 | H27 | 109.5° | 109.5° |
| C20 | C21 | H28 | 109.5° | 109.5° |
| C20 | C21 | H29 | 109.5° | 109.5° |
| O1 | C4 | C5 | 109.0° | 109.5° |
| O1 | C4 | H2 | 109.6° | 109.5° |
| O1 | C4 | H3 | 109.6° | 109.4° |
| C4 | C5 | C6 | 114.9° | 109.5° |
| C5 | C4 | H2 | 109.6° | 109.5° |
| C5 | C4 | H3 | 109.6° | 109.4° |
| C4 | C5 | H9 | 108.1° | 109.5° |
| C4 | C5 | H10 | 108.1° | 109.5° |
| O4 | C15 | O3 | 123.5° | 120.0° |
| O4 | C15 | C14 | 118.9° | 120.1° |
| O3 | C15 | C14 | 117.6° | 120.0° |
| C15 | O3 | H1 | 109.5° | 117.0° |
| C15 | C14 | C13 | 113.3° | 109.5° |
| C15 | C14 | H17 | 108.5° | 109.5° |
| C15 | C14 | H18 | 108.5° | 109.5° |
| C5 | C6 | O2 | 107.4° | 109.5° |
| C6 | C5 | H9 | 108.1° | 109.4° |
| C6 | C5 | H10 | 108.1° | 109.5° |
| C5 | C6 | H11 | 110.0° | 109.5° |
| C5 | C6 | H12 | 110.0° | 109.4° |
| C14 | C13 | C12 | 113.8° | 109.5° |
| C14 | C13 | H15 | 108.4° | 109.5° |
| C14 | C13 | H16 | 108.4° | 109.5° |
| C13 | C14 | H17 | 108.5° | 109.5° |
| C13 | C14 | H18 | 108.5° | 109.5° |
| C13 | C12 | C7 | 121.3° | 120.0° |
| C13 | C12 | C11 | 121.6° | 120.0° |
| C12 | C13 | H15 | 108.4° | 109.5° |
| C12 | C13 | H16 | 108.4° | 109.4° |
| C6 | O2 | C7 | 119.0° | 117.0° |
| O2 | C6 | H11 | 110.0° | 109.4° |
| O2 | C6 | H12 | 110.0° | 109.5° |
| O2 | C7 | C12 | 116.0° | 120.1° |
| O2 | C7 | C8 | 122.6° | 120.1° |
| C7 | C12 | C11 | 117.0° | 119.9° |
| C12 | C7 | C8 | 121.3° | 119.9° |
| C12 | C11 | C10 | 121.9° | 120.1° |
| C12 | C11 | H14 | 119.1° | 119.9° |
| C7 | C8 | C9 | 119.8° | 120.0° |
| C7 | C8 | H8 | 120.1° | 120.0° |
| C11 | C10 | C9 | 119.7° | 120.1° |
| C11 | C10 | H13 | 120.1° | 119.9° |
| C10 | C11 | H14 | 119.1° | 120.0° |
| C8 | C9 | C10 | 120.3° | 120.0° |
| C9 | C8 | H8 | 120.1° | 120.0° |
| C8 | C9 | H30 | 119.8° | 120.0° |
| C9 | C10 | H13 | 120.2° | 120.0° |
| C10 | C9 | H30 | 119.9° | 120.0° |
| H2 | C4 | H3 | 109.5° | 109.5° |
| H4 | N3 | H5 | 109.5° | 119.9° |
| H6 | N1 | H7 | 109.4° | 120.1° |
| H9 | C5 | H10 | 109.4° | 109.4° |
| H11 | C6 | H12 | 109.5° | 109.5° |
| H15 | C13 | H16 | 109.4° | 109.5° |
| H17 | C14 | H18 | 109.5° | 109.4° |
| H19 | C17 | H20 | 109.5° | 109.5° |
| H21 | C18 | H22 | 109.5° | 109.5° |
| H23 | C19 | H24 | 109.5° | 109.5° |
| H25 | C20 | H26 | 109.5° | 109.5° |
| H27 | C21 | H28 | 109.4° | 109.5° |
| H27 | C21 | H29 | 109.5° | 109.4° |
| H28 | C21 | H29 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N1 | C1 | N4 | N2 | 179.7° | 179.7° |
| N1 | C1 | N4 | C16 | 179.4° | 179.7° |
| N1 | C1 | N2 | C2 | 179.2° | 179.7° |
| C1 | N1 | H6 | H7 | 120.0° | 179.9° |
| N4 | C1 | N2 | C2 | 0.6° | 0.0° |
| C1 | N4 | C16 | C17 | 179.0° | 180.0° |
| C1 | N4 | C16 | C3 | 0.3° | 0.0° |
| N4 | C1 | N1 | H6 | 0.0° | 0.1° |
| N4 | C1 | N1 | H7 | 120.0° | 180.0° |
| N2 | C1 | N4 | C16 | 0.3° | 0.0° |
| C1 | N2 | C2 | C3 | 0.8° | 0.0° |
| C1 | N2 | C2 | N3 | 178.5° | 180.0° |
| N2 | C1 | N1 | H6 | 179.8° | 179.8° |
| N2 | C1 | N1 | H7 | 60.3° | 0.3° |
| N4 | C16 | C17 | C3 | 179.3° | 180.0° |
| N4 | C16 | C3 | C2 | 0.5° | 0.0° |
| N4 | C16 | C17 | C18 | 72.4° | 90.0° |
| N4 | C16 | C3 | O1 | 178.4° | 180.0° |
| N4 | C16 | C17 | H19 | 167.5° | 150.0° |
| N4 | C16 | C17 | H20 | 47.9° | 30.0° |
| N2 | C2 | C3 | C16 | 0.8° | 0.0° |
| N2 | C2 | C3 | N3 | 177.7° | 180.0° |
| N2 | C2 | C3 | O1 | 178.7° | 180.0° |
| N2 | C2 | N3 | H4 | 0.0° | 180.0° |
| N2 | C2 | N3 | H5 | 120.0° | 0.0° |
| C17 | C16 | C3 | C2 | 178.7° | 180.0° |
| C16 | C17 | C18 | H19 | 120.2° | 120.0° |
| C16 | C17 | C18 | H20 | 120.2° | 120.0° |
| C16 | C17 | C18 | C19 | 165.7° | 180.0° |
| C17 | C16 | C3 | O1 | 0.8° | 0.0° |
| C16 | C17 | H19 | H20 | 119.4° | 120.0° |
| C16 | C17 | C18 | H21 | 73.2° | 60.0° |
| C16 | C17 | C18 | H22 | 44.6° | 60.0° |
| C16 | C3 | C2 | O1 | 177.9° | 180.0° |
| C16 | C3 | C2 | N3 | 178.5° | 180.0° |
| C3 | C16 | C17 | C18 | 106.9° | 90.0° |
| C16 | C3 | O1 | C4 | 109.2° | 89.9° |
| C3 | C16 | C17 | H19 | 13.3° | 30.0° |
| C3 | C16 | C17 | H20 | 132.9° | 150.0° |
| C2 | C3 | O1 | C4 | 68.7° | 90.0° |
| C3 | C2 | N3 | H4 | 177.7° | 0.0° |
| C3 | C2 | N3 | H5 | 57.7° | 180.0° |
| N3 | C2 | C3 | O1 | 3.6° | 0.1° |
| C2 | N3 | H4 | H5 | 120.0° | 180.0° |
| C17 | C18 | C19 | H21 | 121.1° | 120.0° |
| C17 | C18 | C19 | H22 | 121.1° | 120.0° |
| C17 | C18 | C19 | C20 | 55.8° | 180.0° |
| C18 | C17 | H19 | H20 | 119.4° | 120.0° |
| C17 | C18 | H21 | H22 | 116.5° | 120.0° |
| C17 | C18 | C19 | H23 | 176.6° | 60.0° |
| C17 | C18 | C19 | H24 | 64.9° | 60.0° |
| C18 | C19 | C20 | H23 | 120.8° | 120.0° |
| C18 | C19 | C20 | H24 | 120.8° | 120.0° |
| C18 | C19 | C20 | C21 | 176.9° | 180.0° |
| C19 | C18 | C17 | H19 | 45.5° | 60.0° |
| C19 | C18 | C17 | H20 | 74.1° | 60.0° |
| C19 | C18 | H21 | H22 | 116.4° | 120.0° |
| C18 | C19 | H23 | H24 | 117.6° | 120.0° |
| C18 | C19 | C20 | H25 | 62.8° | 60.0° |
| C18 | C19 | C20 | H26 | 56.6° | 60.0° |
| C3 | O1 | C4 | C5 | 172.5° | 180.0° |
| C3 | O1 | C4 | H2 | 52.5° | 60.0° |
| C3 | O1 | C4 | H3 | 67.6° | 60.1° |
| C19 | C20 | C21 | H25 | 120.3° | 120.0° |
| C19 | C20 | C21 | H26 | 120.3° | 120.0° |
| C20 | C19 | C18 | H21 | 65.3° | 60.0° |
| C20 | C19 | C18 | H22 | 177.0° | 60.0° |
| C20 | C19 | H23 | H24 | 117.6° | 120.0° |
| C19 | C20 | H25 | H26 | 119.1° | 120.0° |
| C19 | C20 | C21 | H27 | 180.0° | 180.0° |
| C19 | C20 | C21 | H28 | 60.0° | 60.0° |
| C19 | C20 | C21 | H29 | 60.0° | 60.0° |
| C21 | C20 | C19 | H23 | 56.1° | 60.0° |
| C21 | C20 | C19 | H24 | 62.3° | 60.0° |
| C21 | C20 | H25 | H26 | 119.1° | 120.0° |
| C20 | C21 | H27 | H28 | 120.0° | 120.1° |
| C20 | C21 | H27 | H29 | 120.0° | 120.0° |
| C20 | C21 | H28 | H29 | 120.0° | 120.0° |
| O1 | C4 | C5 | H2 | 119.9° | 120.1° |
| O1 | C4 | C5 | H3 | 119.9° | 119.9° |
| O1 | C4 | C5 | C6 | 62.7° | 180.0° |
| O1 | C4 | H2 | H3 | 120.2° | 120.0° |
| O1 | C4 | C5 | H9 | 176.5° | 60.0° |
| O1 | C4 | C5 | H10 | 58.1° | 59.9° |
| C4 | C5 | C6 | H9 | 120.8° | 120.0° |
| C4 | C5 | C6 | H10 | 120.8° | 120.1° |
| C4 | C5 | C6 | O2 | 68.5° | 180.0° |
| C5 | C4 | H2 | H3 | 120.2° | 120.0° |
| C4 | C5 | H9 | H10 | 117.5° | 120.0° |
| C4 | C5 | C6 | H11 | 171.8° | 60.0° |
| C4 | C5 | C6 | H12 | 51.2° | 60.1° |
| O4 | C15 | O3 | C14 | 179.5° | 180.0° |
| O4 | C15 | C14 | C13 | 7.7° | 0.0° |
| O4 | C15 | O3 | H1 | 0.0° | 0.0° |
| O4 | C15 | C14 | H17 | 112.9° | 120.0° |
| O4 | C15 | C14 | H18 | 128.2° | 120.1° |
| O3 | C15 | C14 | C13 | 172.8° | 180.0° |
| O3 | C15 | C14 | H17 | 66.7° | 59.9° |
| O3 | C15 | C14 | H18 | 52.2° | 60.0° |
| C15 | C14 | C13 | H17 | 120.6° | 120.0° |
| C15 | C14 | C13 | H18 | 120.6° | 120.0° |
| C15 | C14 | C13 | C12 | 179.9° | 180.0° |
| C14 | C15 | O3 | H1 | 179.5° | 180.0° |
| C15 | C14 | C13 | H15 | 59.4° | 60.0° |
| C15 | C14 | C13 | H16 | 59.3° | 60.0° |
| C15 | C14 | H17 | H18 | 118.2° | 120.0° |
| C5 | C6 | O2 | H11 | 119.7° | 120.0° |
| C5 | C6 | O2 | H12 | 119.7° | 120.0° |
| C5 | C6 | O2 | C7 | 173.8° | 180.0° |
| C6 | C5 | C4 | H2 | 57.3° | 60.0° |
| C6 | C5 | C4 | H3 | 177.4° | 60.1° |
| C6 | C5 | H9 | H10 | 117.5° | 120.0° |
| C5 | C6 | H11 | H12 | 120.9° | 120.0° |
| C14 | C13 | C12 | H15 | 120.7° | 120.0° |
| C14 | C13 | C12 | H16 | 120.7° | 120.0° |
| C14 | C13 | C12 | C7 | 158.8° | 85.0° |
| C14 | C13 | C12 | C11 | 22.2° | 95.6° |
| C14 | C13 | H15 | H16 | 118.1° | 120.0° |
| C13 | C14 | H17 | H18 | 118.2° | 120.0° |
| C13 | C12 | C7 | O2 | 0.3° | 0.0° |
| C13 | C12 | C7 | C11 | 179.1° | 179.5° |
| C13 | C12 | C7 | C8 | 179.1° | 180.0° |
| C13 | C12 | C11 | C10 | 179.5° | 179.7° |
| C13 | C12 | C11 | H14 | 0.5° | 0.2° |
| C12 | C13 | H15 | H16 | 118.0° | 120.0° |
| C12 | C13 | C14 | H17 | 59.4° | 60.0° |
| C12 | C13 | C14 | H18 | 59.5° | 60.0° |
| C6 | O2 | C7 | C12 | 178.5° | 180.0° |
| C6 | O2 | C7 | C8 | 0.9° | 0.0° |
| O2 | C6 | C5 | H9 | 52.4° | 60.0° |
| O2 | C6 | C5 | H10 | 170.7° | 59.9° |
| O2 | C6 | H11 | H12 | 120.9° | 120.0° |
| O2 | C7 | C12 | C8 | 179.4° | 180.0° |
| O2 | C7 | C12 | C11 | 179.3° | 179.4° |
| O2 | C7 | C8 | C9 | 179.7° | 180.0° |
| O2 | C7 | C8 | H8 | 0.4° | 0.3° |
| C7 | O2 | C6 | H11 | 54.1° | 60.0° |
| C7 | O2 | C6 | H12 | 66.6° | 60.0° |
| C7 | C12 | C11 | C10 | 0.5° | 0.8° |
| C12 | C7 | C8 | C9 | 0.3° | 0.1° |
| C12 | C7 | C8 | H8 | 179.7° | 179.7° |
| C7 | C12 | C11 | H14 | 179.5° | 179.7° |
| C7 | C12 | C13 | H15 | 38.2° | 155.0° |
| C7 | C12 | C13 | H16 | 80.5° | 35.0° |
| C11 | C12 | C7 | C8 | 0.1° | 0.5° |
| C12 | C11 | C10 | H14 | 180.0° | 179.4° |
| C12 | C11 | C10 | C9 | 0.5° | 0.6° |
| C12 | C11 | C10 | H13 | 179.5° | 179.5° |
| C11 | C12 | C13 | H15 | 142.8° | 24.4° |
| C11 | C12 | C13 | H16 | 98.5° | 144.4° |
| C7 | C8 | C9 | H8 | 180.0° | 179.7° |
| C7 | C8 | C9 | C10 | 0.3° | 0.3° |
| C7 | C8 | C9 | H30 | 179.7° | 179.8° |
| C11 | C10 | C9 | C8 | 0.1° | 0.0° |
| C11 | C10 | C9 | H13 | 180.0° | 179.9° |
| C11 | C10 | C9 | H30 | 179.9° | 179.9° |
| C8 | C9 | C10 | H30 | 180.0° | 179.9° |
| C8 | C9 | C10 | H13 | 179.9° | 180.0° |
| C10 | C9 | C8 | H8 | 179.7° | 180.0° |
| C9 | C10 | C11 | H14 | 179.5° | 180.0° |
| H2 | C4 | C5 | H9 | 63.5° | 60.0° |
| H2 | C4 | C5 | H10 | 178.1° | 180.0° |
| H3 | C4 | C5 | H9 | 56.6° | 180.0° |
| H3 | C4 | C5 | H10 | 61.8° | 60.0° |
| H8 | C8 | C9 | H30 | 0.3° | 0.1° |
| H9 | C5 | C6 | H11 | 67.3° | 60.0° |
| H9 | C5 | C6 | H12 | 172.0° | 179.9° |
| H10 | C5 | C6 | H11 | 51.0° | 179.9° |
| H10 | C5 | C6 | H12 | 69.6° | 60.0° |
| H13 | C10 | C11 | H14 | 0.5° | 0.0° |
| H13 | C10 | C9 | H30 | 0.1° | 0.0° |
| H15 | C13 | C14 | H17 | 180.0° | 180.0° |
| H15 | C13 | C14 | H18 | 61.2° | 60.0° |
| H16 | C13 | C14 | H17 | 61.3° | 60.0° |
| H16 | C13 | C14 | H18 | 179.9° | 180.0° |
| H19 | C17 | C18 | H21 | 166.6° | 180.0° |
| H19 | C17 | C18 | H22 | 75.6° | 60.0° |
| H20 | C17 | C18 | H21 | 47.0° | 60.0° |
| H20 | C17 | C18 | H22 | 164.8° | 180.0° |
| H21 | C18 | C19 | H23 | 55.5° | 180.0° |
| H21 | C18 | C19 | H24 | 174.0° | 60.0° |
| H22 | C18 | C19 | H23 | 62.2° | 59.9° |
| H22 | C18 | C19 | H24 | 56.2° | 180.0° |
| H23 | C19 | C20 | H25 | 176.4° | 180.0° |
| H23 | C19 | C20 | H26 | 64.2° | 60.0° |
| H24 | C19 | C20 | H25 | 58.0° | 60.0° |
| H24 | C19 | C20 | H26 | 177.4° | 180.0° |
| H25 | C20 | C21 | H27 | 59.7° | 60.0° |
| H25 | C20 | C21 | H28 | 179.7° | 180.0° |
| H25 | C20 | C21 | H29 | 60.3° | 60.0° |
| H26 | C20 | C21 | H27 | 59.7° | 60.0° |
| H26 | C20 | C21 | H28 | 60.3° | 60.0° |
| H26 | C20 | C21 | H29 | 179.7° | NaN° |
| H27 | C21 | H28 | H29 | 120.0° | 119.9° |
