CVL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C8 | C7 | sing | 1.53Å | 1.52Å | |
| N4 | N5 | doub | 1.29Å | 1.29Å | Aromatic |
| N4 | N3 | sing | 1.41Å | 1.36Å | Aromatic |
| N5 | N6 | sing | 1.29Å | 1.34Å | Aromatic |
| C7 | C9 | sing | 1.53Å | 1.52Å | |
| C7 | N2 | sing | 1.46Å | 1.50Å | |
| N3 | C24 | sing | 1.36Å | 1.33Å | Aromatic |
| N6 | C24 | doub | 1.32Å | 1.34Å | Aromatic |
| O2 | C10 | doub | 1.21Å | 1.21Å | |
| C24 | C23 | sing | 1.48Å | 1.46Å | |
| C25 | C23 | doub | 1.40Å | 1.39Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| C23 | C22 | sing | 1.40Å | 1.39Å | Aromatic |
| N2 | C10 | sing | 1.35Å | 1.36Å | |
| N2 | N1 | sing | 1.39Å | 1.37Å | |
| C10 | C11 | sing | 1.52Å | 1.52Å | |
| C26 | C20 | doub | 1.39Å | 1.39Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.38Å | Aromatic |
| C20 | O4 | sing | 1.36Å | 1.37Å | |
| C19 | O4 | sing | 1.43Å | 1.44Å | |
| C19 | C18 | sing | 1.53Å | 1.51Å | |
| N1 | C6 | doub | 1.29Å | 1.29Å | |
| C18 | C17 | sing | 1.53Å | 1.52Å | |
| C13 | C11 | sing | 1.53Å | 1.53Å | |
| C11 | C6 | sing | 1.51Å | 1.51Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C6 | C5 | sing | 1.47Å | 1.47Å | |
| C17 | C16 | sing | 1.53Å | 1.51Å | |
| C16 | O3 | sing | 1.43Å | 1.44Å | |
| C14 | C5 | doub | 1.40Å | 1.40Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.40Å | 1.39Å | Aromatic |
| O3 | C15 | sing | 1.36Å | 1.37Å | |
| C15 | C2 | doub | 1.39Å | 1.41Å | Aromatic |
| C4 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.39Å | 1.38Å | Aromatic |
| C2 | O1 | sing | 1.36Å | 1.37Å | |
| O1 | C1 | sing | 1.43Å | 1.43Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.08Å | 1.08Å | |
| C4 | H5 | sing | 1.08Å | 1.08Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H9 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.09Å | 1.10Å | |
| C8 | H11 | sing | 1.09Å | 1.10Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| C9 | H13 | sing | 1.09Å | 1.10Å | |
| C9 | H14 | sing | 1.09Å | 1.10Å | |
| C12 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C13 | H18 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.08Å | 1.08Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C16 | H23 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H25 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C19 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.08Å | 1.08Å | |
| C22 | H31 | sing | 1.08Å | 1.08Å | |
| N3 | H32 | sing | 0.97Å | 1.00Å | |
| C25 | H33 | sing | 1.08Å | 1.08Å | |
| C26 | H34 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C8 | C7 | C9 | 112.5° | 109.5° |
| C8 | C7 | N2 | 112.4° | 109.5° |
| C8 | C7 | H8 | 107.6° | 109.5° |
| C7 | C8 | H9 | 109.5° | 109.5° |
| C7 | C8 | H10 | 109.5° | 109.5° |
| C7 | C8 | H11 | 109.5° | 109.5° |
| N5 | N4 | N3 | 110.2° | 106.9° |
| N4 | N5 | N6 | 106.8° | 110.4° |
| N4 | N3 | C24 | 106.3° | 105.2° |
| N4 | N3 | H32 | 126.9° | 127.4° |
| N5 | N6 | C24 | 108.8° | 110.5° |
| C9 | C7 | N2 | 108.5° | 109.5° |
| C9 | C7 | H8 | 107.6° | 109.5° |
| C7 | C9 | H12 | 109.5° | 109.5° |
| C7 | C9 | H13 | 109.5° | 109.5° |
| C7 | C9 | H14 | 109.5° | 109.5° |
| C7 | N2 | C10 | 129.8° | 124.4° |
| C7 | N2 | N1 | 117.3° | 124.4° |
| N2 | C7 | H8 | 107.9° | 109.5° |
| N3 | C24 | N6 | 107.7° | 107.1° |
| N3 | C24 | C23 | 126.2° | 126.5° |
| C24 | N3 | H32 | 126.8° | 127.4° |
| N6 | C24 | C23 | 126.0° | 126.5° |
| O2 | C10 | N2 | 129.5° | 127.3° |
| O2 | C10 | C11 | 123.9° | 127.3° |
| C24 | C23 | C25 | 120.4° | 120.1° |
| C24 | C23 | C22 | 120.9° | 120.1° |
| C23 | C25 | C26 | 120.6° | 119.9° |
| C25 | C23 | C22 | 118.7° | 119.9° |
| C23 | C25 | H33 | 119.7° | 120.1° |
| C25 | C26 | C20 | 120.2° | 120.1° |
| C26 | C25 | H33 | 119.7° | 120.0° |
| C25 | C26 | H34 | 119.9° | 119.9° |
| C23 | C22 | C21 | 120.9° | 119.9° |
| C23 | C22 | H31 | 119.5° | 120.0° |
| C10 | N2 | N1 | 112.9° | 111.2° |
| N2 | C10 | C11 | 106.6° | 105.4° |
| N2 | N1 | C6 | 107.0° | 112.8° |
| C10 | C11 | C13 | 110.7° | 110.6° |
| C10 | C11 | C6 | 98.3° | 103.7° |
| C10 | C11 | C12 | 110.2° | 110.6° |
| C26 | C20 | C21 | 119.8° | 120.2° |
| C26 | C20 | O4 | 117.7° | 120.0° |
| C20 | C26 | H34 | 119.9° | 119.9° |
| C22 | C21 | C20 | 119.8° | 120.1° |
| C22 | C21 | H30 | 120.1° | 120.0° |
| C21 | C22 | H31 | 119.6° | 120.0° |
| C21 | C20 | O4 | 122.5° | 119.9° |
| C20 | C21 | H30 | 120.1° | 120.0° |
| C20 | O4 | C19 | 119.6° | 117.0° |
| O4 | C19 | C18 | 107.2° | 109.5° |
| O4 | C19 | H28 | 110.0° | 109.5° |
| O4 | C19 | H29 | 110.1° | 109.5° |
| C19 | C18 | C17 | 114.1° | 109.5° |
| C19 | C18 | H26 | 108.3° | 109.5° |
| C19 | C18 | H27 | 108.3° | 109.4° |
| C18 | C19 | H28 | 110.0° | 109.5° |
| C18 | C19 | H29 | 110.0° | 109.4° |
| N1 | C6 | C11 | 112.8° | 106.9° |
| N1 | C6 | C5 | 120.0° | 126.5° |
| C18 | C17 | C16 | 116.8° | 109.4° |
| C18 | C17 | H24 | 107.6° | 109.5° |
| C18 | C17 | H25 | 107.6° | 109.4° |
| C17 | C18 | H26 | 108.3° | 109.5° |
| C17 | C18 | H27 | 108.3° | 109.5° |
| C13 | C11 | C6 | 113.8° | 110.8° |
| C13 | C11 | C12 | 110.8° | 110.6° |
| C11 | C13 | H18 | 109.5° | 109.4° |
| C11 | C13 | H19 | 109.4° | 109.5° |
| C11 | C13 | H20 | 109.5° | 109.5° |
| C6 | C11 | C12 | 112.3° | 110.3° |
| C11 | C6 | C5 | 127.1° | 126.6° |
| C11 | C12 | H15 | 109.5° | 109.5° |
| C11 | C12 | H16 | 109.4° | 109.5° |
| C11 | C12 | H17 | 109.4° | 109.5° |
| C6 | C5 | C14 | 119.5° | 120.1° |
| C6 | C5 | C4 | 121.3° | 120.1° |
| C17 | C16 | O3 | 107.5° | 109.4° |
| C17 | C16 | H22 | 109.9° | 109.5° |
| C17 | C16 | H23 | 109.9° | 109.5° |
| C16 | C17 | H24 | 107.6° | 109.5° |
| C16 | C17 | H25 | 107.6° | 109.5° |
| C16 | O3 | C15 | 118.0° | 117.0° |
| O3 | C16 | H22 | 109.9° | 109.5° |
| O3 | C16 | H23 | 110.0° | 109.5° |
| C5 | C14 | C15 | 120.4° | 119.8° |
| C14 | C5 | C4 | 119.2° | 119.8° |
| C5 | C14 | H21 | 119.8° | 120.0° |
| C14 | C15 | O3 | 122.1° | 120.0° |
| C14 | C15 | C2 | 120.0° | 120.0° |
| C15 | C14 | H21 | 119.8° | 120.1° |
| C5 | C4 | C3 | 120.6° | 120.0° |
| C5 | C4 | H5 | 119.7° | 120.0° |
| O3 | C15 | C2 | 117.9° | 120.0° |
| C15 | C2 | C3 | 119.4° | 120.2° |
| C15 | C2 | O1 | 115.0° | 119.9° |
| C4 | C3 | C2 | 120.4° | 120.2° |
| C4 | C3 | H4 | 119.8° | 119.9° |
| C3 | C4 | H5 | 119.7° | 120.0° |
| C3 | C2 | O1 | 125.6° | 119.9° |
| C2 | C3 | H4 | 119.8° | 119.9° |
| C2 | O1 | C1 | 118.9° | 117.0° |
| O1 | C1 | H1 | 109.5° | 109.5° |
| O1 | C1 | H2 | 109.5° | 109.5° |
| O1 | C1 | H3 | 109.5° | 109.5° |
| H1 | C1 | H2 | 109.5° | 109.4° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.4° | 109.4° |
| H9 | C8 | H10 | 109.5° | 109.5° |
| H9 | C8 | H11 | 109.4° | 109.5° |
| H10 | C8 | H11 | 109.5° | 109.4° |
| H12 | C9 | H13 | 109.5° | 109.4° |
| H12 | C9 | H14 | 109.5° | 109.5° |
| H13 | C9 | H14 | 109.5° | 109.5° |
| H15 | C12 | H16 | 109.5° | 109.5° |
| H15 | C12 | H17 | 109.5° | 109.5° |
| H16 | C12 | H17 | 109.5° | 109.4° |
| H18 | C13 | H19 | 109.4° | 109.5° |
| H18 | C13 | H20 | 109.5° | 109.5° |
| H19 | C13 | H20 | 109.5° | 109.5° |
| H22 | C16 | H23 | 109.5° | 109.5° |
| H24 | C17 | H25 | 109.5° | 109.5° |
| H26 | C18 | H27 | 109.5° | 109.5° |
| H28 | C19 | H29 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C8 | C7 | C9 | N2 | 125.0° | 120.0° |
| C8 | C7 | C9 | H8 | 118.4° | 120.0° |
| C8 | C7 | N2 | H8 | 118.6° | 120.0° |
| C8 | C7 | N2 | C10 | 1.4° | 120.0° |
| C8 | C7 | N2 | N1 | 177.3° | 59.7° |
| C7 | C8 | H9 | H10 | 120.0° | 120.0° |
| C7 | C8 | H9 | H11 | 120.0° | 120.1° |
| C7 | C8 | H10 | H11 | 120.0° | 120.0° |
| C8 | C7 | C9 | H12 | 180.0° | 180.0° |
| C8 | C7 | C9 | H13 | 60.0° | 60.0° |
| C8 | C7 | C9 | H14 | 60.0° | 60.0° |
| N5 | N4 | N3 | C24 | 0.0° | 0.1° |
| N4 | N5 | N6 | C24 | 0.1° | 0.3° |
| N5 | N4 | N3 | H32 | 180.0° | 179.9° |
| N3 | N4 | N5 | N6 | 0.1° | 0.1° |
| N4 | N3 | C24 | H32 | 180.0° | 179.8° |
| N4 | N3 | C24 | N6 | 0.1° | 0.3° |
| N4 | N3 | C24 | C23 | 179.2° | 180.0° |
| N5 | N6 | C24 | N3 | 0.1° | 0.4° |
| N5 | N6 | C24 | C23 | 179.2° | 179.9° |
| C9 | C7 | N2 | H8 | 116.4° | 120.0° |
| C9 | C7 | N2 | C10 | 126.5° | 120.1° |
| C9 | C7 | N2 | N1 | 52.3° | 60.2° |
| C9 | C7 | C8 | H9 | 180.0° | 180.0° |
| C9 | C7 | C8 | H10 | 60.0° | 60.0° |
| C9 | C7 | C8 | H11 | 60.0° | 60.0° |
| C7 | C9 | H12 | H13 | 120.0° | 120.0° |
| C7 | C9 | H12 | H14 | 120.0° | 120.0° |
| C7 | C9 | H13 | H14 | 120.0° | 120.1° |
| C7 | N2 | C10 | O2 | 2.6° | 0.3° |
| C7 | N2 | C10 | N1 | 178.8° | 179.7° |
| C7 | N2 | C10 | C11 | 178.5° | 180.0° |
| C7 | N2 | N1 | C6 | 169.1° | 179.8° |
| N2 | C7 | C8 | H9 | 57.1° | 60.0° |
| N2 | C7 | C8 | H10 | 62.9° | 60.0° |
| N2 | C7 | C8 | H11 | 177.1° | 179.9° |
| N2 | C7 | C9 | H12 | 55.0° | 60.1° |
| N2 | C7 | C9 | H13 | 174.9° | 180.0° |
| N2 | C7 | C9 | H14 | 65.1° | 60.0° |
| N3 | C24 | N6 | C23 | 179.3° | 179.7° |
| N3 | C24 | C23 | C25 | 163.2° | 0.1° |
| N3 | C24 | C23 | C22 | 17.1° | 180.0° |
| N6 | C24 | C23 | C25 | 17.6° | 179.7° |
| N6 | C24 | C23 | C22 | 162.1° | 0.3° |
| N6 | C24 | N3 | H32 | 180.0° | 179.9° |
| O2 | C10 | N2 | C11 | 178.9° | 179.7° |
| O2 | C10 | N2 | N1 | 176.2° | 180.0° |
| O2 | C10 | C11 | C13 | 55.5° | 61.2° |
| O2 | C10 | C11 | C6 | 175.0° | 179.9° |
| O2 | C10 | C11 | C12 | 67.5° | 61.7° |
| C24 | C23 | C25 | C22 | 179.7° | 180.0° |
| C24 | C23 | C25 | C26 | 179.9° | 179.8° |
| C24 | C23 | C22 | C21 | 179.9° | 180.0° |
| C24 | C23 | C22 | H31 | 0.1° | 0.1° |
| C23 | C24 | N3 | H32 | 0.7° | 0.2° |
| C24 | C23 | C25 | H33 | 0.1° | 0.1° |
| C23 | C25 | C26 | H33 | 180.0° | 179.9° |
| C23 | C25 | C26 | C20 | 0.6° | 0.4° |
| C25 | C23 | C22 | C21 | 0.2° | 0.0° |
| C25 | C23 | C22 | H31 | 179.8° | 180.0° |
| C23 | C25 | C26 | H34 | 179.4° | 180.0° |
| C26 | C25 | C23 | C22 | 0.3° | 0.2° |
| C25 | C26 | C20 | H34 | 180.0° | 179.6° |
| C25 | C26 | C20 | C21 | 0.6° | 0.5° |
| C25 | C26 | C20 | O4 | 179.3° | 179.8° |
| C23 | C22 | C21 | H31 | 180.0° | 180.0° |
| C23 | C22 | C21 | C20 | 0.2° | 0.0° |
| C23 | C22 | C21 | H30 | 179.7° | 180.0° |
| C22 | C23 | C25 | H33 | 179.7° | 179.9° |
| C10 | N2 | N1 | C6 | 12.0° | 0.1° |
| N2 | C10 | C11 | C13 | 125.5° | 118.5° |
| N2 | C10 | C11 | C6 | 6.1° | 0.4° |
| N2 | C10 | C11 | C12 | 111.5° | 118.6° |
| C10 | N2 | C7 | H8 | 117.1° | 0.0° |
| N1 | N2 | C10 | C11 | 2.7° | 0.3° |
| N2 | N1 | C6 | C11 | 16.4° | 0.2° |
| N2 | N1 | C6 | C5 | 165.1° | 180.0° |
| N1 | N2 | C7 | H8 | 64.1° | 179.7° |
| C10 | C11 | C6 | N1 | 14.1° | 0.3° |
| C10 | C11 | C13 | C6 | 109.7° | 114.4° |
| C10 | C11 | C13 | C12 | 122.6° | 122.9° |
| C10 | C11 | C6 | C12 | 115.9° | 118.4° |
| C10 | C11 | C6 | C5 | 167.5° | 179.9° |
| C10 | C11 | C12 | H15 | 180.0° | 61.5° |
| C10 | C11 | C12 | H16 | 60.0° | 178.5° |
| C10 | C11 | C12 | H17 | 60.0° | 58.5° |
| C10 | C11 | C13 | H18 | 180.0° | 58.5° |
| C10 | C11 | C13 | H19 | 60.0° | 178.5° |
| C10 | C11 | C13 | H20 | 60.0° | 61.5° |
| C26 | C20 | C21 | C22 | 0.5° | 0.3° |
| C26 | C20 | C21 | O4 | 180.0° | 179.8° |
| C26 | C20 | O4 | C19 | 136.8° | 0.3° |
| C26 | C20 | C21 | H30 | 179.5° | 179.8° |
| C20 | C26 | C25 | H33 | 179.4° | 179.7° |
| C22 | C21 | C20 | H30 | 180.0° | 179.9° |
| C22 | C21 | C20 | O4 | 179.5° | 180.0° |
| C21 | C20 | O4 | C19 | 43.2° | 180.0° |
| C20 | C21 | C22 | H31 | 179.8° | 179.9° |
| C21 | C20 | C26 | H34 | 179.4° | 179.9° |
| C20 | O4 | C19 | C18 | 165.2° | 180.0° |
| C20 | O4 | C19 | H28 | 45.6° | 60.0° |
| C20 | O4 | C19 | H29 | 75.1° | 60.0° |
| O4 | C20 | C21 | H30 | 0.5° | 0.0° |
| O4 | C20 | C26 | H34 | 0.6° | 0.2° |
| O4 | C19 | C18 | H28 | 119.6° | 120.1° |
| O4 | C19 | C18 | H29 | 119.7° | 120.0° |
| O4 | C19 | C18 | C17 | 63.1° | 180.0° |
| O4 | C19 | C18 | H26 | 57.6° | 60.0° |
| O4 | C19 | C18 | H27 | 176.3° | 60.0° |
| O4 | C19 | H28 | H29 | 121.1° | 120.0° |
| C19 | C18 | C17 | H26 | 120.7° | 120.0° |
| C19 | C18 | C17 | H27 | 120.7° | 120.0° |
| C19 | C18 | C17 | C16 | 126.6° | 180.0° |
| C19 | C18 | C17 | H24 | 112.3° | 60.0° |
| C19 | C18 | C17 | H25 | 5.6° | 60.1° |
| C19 | C18 | H26 | H27 | 117.9° | 120.0° |
| C18 | C19 | H28 | H29 | 121.0° | 119.9° |
| N1 | C6 | C11 | C13 | 131.2° | 118.4° |
| N1 | C6 | C11 | C5 | 178.4° | 179.8° |
| N1 | C6 | C11 | C12 | 101.9° | 118.8° |
| N1 | C6 | C5 | C14 | 30.1° | 0.0° |
| N1 | C6 | C5 | C4 | 147.5° | 180.0° |
| C18 | C17 | C16 | H24 | 121.0° | 120.0° |
| C18 | C17 | C16 | H25 | 121.1° | 119.9° |
| C18 | C17 | C16 | O3 | 132.8° | 180.0° |
| C18 | C17 | C16 | H22 | 13.1° | 60.0° |
| C18 | C17 | C16 | H23 | 107.5° | 60.0° |
| C18 | C17 | H24 | H25 | 116.7° | 120.0° |
| C17 | C18 | H26 | H27 | 117.9° | 120.0° |
| C17 | C18 | C19 | H28 | 177.3° | 59.9° |
| C17 | C18 | C19 | H29 | 56.6° | 60.0° |
| C13 | C11 | C6 | C12 | 126.9° | 122.9° |
| C13 | C11 | C6 | C5 | 50.4° | 61.4° |
| C13 | C11 | C12 | H15 | 57.0° | 61.4° |
| C13 | C11 | C12 | H16 | 177.1° | 58.6° |
| C13 | C11 | C12 | H17 | 62.9° | 178.5° |
| C11 | C13 | H18 | H19 | 120.0° | 120.0° |
| C11 | C13 | H18 | H20 | 120.0° | 120.0° |
| C11 | C13 | H19 | H20 | 120.0° | 120.0° |
| C11 | C6 | C5 | C14 | 151.6° | 179.8° |
| C11 | C6 | C5 | C4 | 30.8° | 0.2° |
| C6 | C11 | C12 | H15 | 71.5° | 175.6° |
| C6 | C11 | C12 | H16 | 48.6° | 64.4° |
| C6 | C11 | C12 | H17 | 168.5° | 55.6° |
| C6 | C11 | C13 | H18 | 70.3° | 55.9° |
| C6 | C11 | C13 | H19 | 169.7° | 64.1° |
| C6 | C11 | C13 | H20 | 49.7° | 175.9° |
| C12 | C11 | C6 | C5 | 76.5° | 61.4° |
| C11 | C12 | H15 | H16 | 120.0° | 120.0° |
| C11 | C12 | H15 | H17 | 120.0° | 120.0° |
| C11 | C12 | H16 | H17 | 120.0° | 120.0° |
| C12 | C11 | C13 | H18 | 57.3° | 178.5° |
| C12 | C11 | C13 | H19 | 62.6° | 58.5° |
| C12 | C11 | C13 | H20 | 177.4° | 61.4° |
| C6 | C5 | C14 | C4 | 177.6° | 180.0° |
| C6 | C5 | C14 | C15 | 179.4° | 179.8° |
| C6 | C5 | C4 | C3 | 178.9° | 180.0° |
| C6 | C5 | C4 | H5 | 1.1° | 0.0° |
| C6 | C5 | C14 | H21 | 0.6° | 0.0° |
| C17 | C16 | O3 | H22 | 119.7° | 120.0° |
| C17 | C16 | O3 | H23 | 119.7° | 120.0° |
| C17 | C16 | O3 | C15 | 151.6° | 180.0° |
| C17 | C16 | H22 | H23 | 120.9° | 120.0° |
| C16 | C17 | H24 | H25 | 116.7° | 120.0° |
| C16 | C17 | C18 | H26 | 5.9° | 60.0° |
| C16 | C17 | C18 | H27 | 112.7° | 60.0° |
| C16 | O3 | C15 | C14 | 58.6° | 0.0° |
| C16 | O3 | C15 | C2 | 121.5° | 179.4° |
| O3 | C16 | H22 | H23 | 120.9° | 120.0° |
| O3 | C16 | C17 | H24 | 106.2° | 60.0° |
| O3 | C16 | C17 | H25 | 11.7° | 60.1° |
| C5 | C14 | C15 | H21 | 180.0° | 179.8° |
| C5 | C14 | C15 | O3 | 178.9° | 180.0° |
| C5 | C14 | C15 | C2 | 1.2° | 0.5° |
| C14 | C5 | C4 | C3 | 1.3° | 0.0° |
| C14 | C5 | C4 | H5 | 178.7° | 180.0° |
| C15 | C14 | C5 | C4 | 1.8° | 0.2° |
| C14 | C15 | O3 | C2 | 179.9° | 179.5° |
| C14 | C15 | C2 | C3 | 0.1° | 0.6° |
| C14 | C15 | C2 | O1 | 178.6° | 179.8° |
| C5 | C4 | C3 | H5 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.2° | 0.0° |
| C5 | C4 | C3 | H4 | 179.8° | 180.0° |
| C4 | C5 | C14 | H21 | 178.3° | 180.0° |
| O3 | C15 | C2 | C3 | 180.0° | 180.0° |
| O3 | C15 | C2 | O1 | 1.3° | 0.3° |
| O3 | C15 | C14 | H21 | 1.0° | 0.2° |
| C15 | O3 | C16 | H22 | 32.0° | 60.0° |
| C15 | O3 | C16 | H23 | 88.7° | 60.0° |
| C15 | C2 | C3 | C4 | 0.4° | 0.3° |
| C15 | C2 | C3 | O1 | 178.5° | 179.6° |
| C15 | C2 | O1 | C1 | 154.4° | 179.7° |
| C15 | C2 | C3 | H4 | 179.6° | 179.7° |
| C2 | C15 | C14 | H21 | 178.8° | 179.7° |
| C4 | C3 | C2 | H4 | 180.0° | 179.9° |
| C4 | C3 | C2 | O1 | 178.9° | 180.0° |
| C3 | C2 | O1 | C1 | 27.0° | 0.1° |
| C2 | C3 | C4 | H5 | 179.8° | 179.9° |
| C2 | O1 | C1 | H1 | 180.0° | 179.9° |
| C2 | O1 | C1 | H2 | 60.0° | 60.1° |
| C2 | O1 | C1 | H3 | 60.0° | 59.9° |
| O1 | C2 | C3 | H4 | 1.1° | 0.1° |
| O1 | C1 | H1 | H2 | 120.0° | 120.0° |
| O1 | C1 | H1 | H3 | 120.0° | 120.0° |
| O1 | C1 | H2 | H3 | 120.0° | 120.0° |
| H1 | C1 | H2 | H3 | 120.0° | 119.9° |
| H4 | C3 | C4 | H5 | 0.2° | 0.0° |
| H8 | C7 | C8 | H9 | 61.6° | 60.0° |
| H8 | C7 | C8 | H10 | 178.4° | 180.0° |
| H8 | C7 | C8 | H11 | 58.4° | 60.0° |
| H8 | C7 | C9 | H12 | 61.6° | 60.0° |
| H8 | C7 | C9 | H13 | 58.3° | 60.0° |
| H8 | C7 | C9 | H14 | 178.3° | 180.0° |
| H9 | C8 | H10 | H11 | 120.0° | 120.0° |
| H12 | C9 | H13 | H14 | 120.0° | 120.0° |
| H15 | C12 | H16 | H17 | 120.0° | 120.0° |
| H18 | C13 | H19 | H20 | 120.0° | 120.1° |
| H22 | C16 | C17 | H24 | 134.1° | 180.0° |
| H22 | C16 | C17 | H25 | 108.0° | 60.0° |
| H23 | C16 | C17 | H24 | 13.5° | 60.0° |
| H23 | C16 | C17 | H25 | 131.4° | 180.0° |
| H24 | C17 | C18 | H26 | 127.0° | 180.0° |
| H24 | C17 | C18 | H27 | 8.4° | 60.0° |
| H25 | C17 | C18 | H26 | 115.1° | 60.0° |
| H25 | C17 | C18 | H27 | 126.3° | 180.0° |
| H26 | C18 | C19 | H28 | 62.0° | 180.0° |
| H26 | C18 | C19 | H29 | 177.3° | 60.0° |
| H27 | C18 | C19 | H28 | 56.6° | 60.1° |
| H27 | C18 | C19 | H29 | 64.1° | 180.0° |
| H30 | C21 | C22 | H31 | 0.3° | 0.0° |
| H33 | C25 | C26 | H34 | 0.6° | 0.1° |
