QC0
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | N2 | sing | 1.47Å | 1.50Å | |
| N2 | C3 | sing | 1.47Å | 1.49Å | |
| N2 | C7 | sing | 1.47Å | 1.49Å | |
| C3 | C4 | sing | 1.53Å | 1.54Å | |
| C4 | N5 | sing | 1.47Å | 1.48Å | |
| N5 | C6 | sing | 1.47Å | 1.48Å | |
| N5 | C8 | sing | 1.40Å | 1.41Å | |
| C6 | C7 | sing | 1.53Å | 1.54Å | |
| C8 | C9 | sing | 1.39Å | 1.42Å | Aromatic |
| C8 | C31 | doub | 1.38Å | 1.40Å | Aromatic |
| C9 | C10 | doub | 1.37Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.40Å | 1.42Å | Aromatic |
| C11 | N12 | sing | 1.36Å | 1.37Å | |
| C11 | C32 | doub | 1.41Å | 1.43Å | Aromatic |
| N12 | C13 | doub | 1.30Å | 1.32Å | |
| C13 | N14 | sing | 1.36Å | 1.38Å | |
| N14 | C15 | sing | 1.40Å | 1.41Å | |
| N14 | C30 | sing | 1.35Å | 1.38Å | |
| C15 | C16 | sing | 1.39Å | 1.39Å | Aromatic |
| C15 | C28 | doub | 1.39Å | 1.40Å | Aromatic |
| C16 | C17 | doub | 1.39Å | 1.41Å | Aromatic |
| C17 | N18 | sing | 1.40Å | 1.40Å | |
| C17 | C26 | sing | 1.39Å | 1.40Å | Aromatic |
| N18 | C19 | sing | 1.35Å | 1.35Å | |
| C19 | O20 | doub | 1.22Å | 1.22Å | |
| C19 | C21 | sing | 1.47Å | 1.45Å | |
| C21 | C22 | sing | 1.47Å | 1.48Å | Aromatic |
| C21 | C25 | doub | 1.36Å | 1.37Å | Aromatic |
| C22 | C23 | doub | 1.34Å | 1.35Å | Aromatic |
| C23 | O24 | sing | 1.34Å | 1.37Å | Aromatic |
| O24 | C25 | sing | 1.34Å | 1.31Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
| C27 | C28 | sing | 1.38Å | 1.40Å | Aromatic |
| C28 | C29 | sing | 1.51Å | 1.53Å | |
| C30 | O31 | doub | 1.22Å | 1.22Å | |
| C30 | C32 | sing | 1.47Å | 1.49Å | |
| C31 | C32 | sing | 1.39Å | 1.38Å | Aromatic |
| C1 | H11C | sing | 1.09Å | 1.10Å | |
| C1 | H12C | sing | 1.09Å | 1.10Å | |
| C1 | H13C | sing | 1.09Å | 1.10Å | |
| C3 | H31C | sing | 1.09Å | 1.10Å | |
| C3 | H32C | sing | 1.09Å | 1.10Å | |
| C7 | H71C | sing | 1.09Å | 1.10Å | |
| C7 | H72C | sing | 1.09Å | 1.10Å | |
| C4 | H41C | sing | 1.09Å | 1.10Å | |
| C4 | H42C | sing | 1.09Å | 1.10Å | |
| C6 | H61C | sing | 1.09Å | 1.10Å | |
| C6 | H62C | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| C31 | H31 | sing | 1.08Å | 1.08Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| N18 | H18 | sing | 0.97Å | 1.00Å | |
| C26 | H26 | sing | 1.08Å | 1.08Å | |
| C22 | H22 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.08Å | 1.08Å | |
| C29 | H291 | sing | 1.09Å | 1.10Å | |
| C29 | H292 | sing | 1.09Å | 1.10Å | |
| C29 | H293 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | N2 | C3 | 110.1° | 111.0° |
| C1 | N2 | C7 | 108.4° | 111.0° |
| N2 | C1 | H11C | 109.5° | 109.5° |
| N2 | C1 | H12C | 109.5° | 109.5° |
| N2 | C1 | H13C | 109.5° | 109.5° |
| C3 | N2 | C7 | 109.4° | 110.8° |
| N2 | C3 | C4 | 111.2° | 109.4° |
| N2 | C3 | H31C | 109.1° | 109.5° |
| N2 | C3 | H32C | 109.1° | 109.5° |
| N2 | C7 | C6 | 109.2° | 109.4° |
| N2 | C7 | H71C | 109.6° | 109.5° |
| N2 | C7 | H72C | 109.6° | 109.4° |
| C3 | C4 | N5 | 109.6° | 109.3° |
| C4 | C3 | H31C | 109.0° | 109.5° |
| C4 | C3 | H32C | 109.0° | 109.5° |
| C3 | C4 | H41C | 109.5° | 109.4° |
| C3 | C4 | H42C | 109.4° | 109.4° |
| C4 | N5 | C6 | 112.0° | 110.9° |
| C4 | N5 | C8 | 111.0° | 111.0° |
| N5 | C4 | H41C | 109.4° | 109.5° |
| N5 | C4 | H42C | 109.4° | 109.5° |
| C6 | N5 | C8 | 115.8° | 111.0° |
| N5 | C6 | C7 | 108.9° | 109.4° |
| N5 | C6 | H61C | 109.6° | 109.4° |
| N5 | C6 | H62C | 109.6° | 109.5° |
| N5 | C8 | C9 | 118.3° | 119.8° |
| N5 | C8 | C31 | 121.5° | 119.8° |
| C6 | C7 | H71C | 109.5° | 109.6° |
| C6 | C7 | H72C | 109.6° | 109.5° |
| C7 | C6 | H61C | 109.6° | 109.6° |
| C7 | C6 | H62C | 109.6° | 109.5° |
| C9 | C8 | C31 | 120.2° | 120.4° |
| C8 | C9 | C10 | 121.5° | 120.9° |
| C8 | C9 | H9 | 119.2° | 119.6° |
| C8 | C31 | C32 | 119.1° | 119.3° |
| C8 | C31 | H31 | 120.4° | 120.3° |
| C9 | C10 | C11 | 118.4° | 119.9° |
| C10 | C9 | H9 | 119.2° | 119.5° |
| C9 | C10 | H10 | 120.8° | 120.0° |
| C10 | C11 | N12 | 121.6° | 121.6° |
| C10 | C11 | C32 | 120.2° | 119.4° |
| C11 | C10 | H10 | 120.8° | 120.0° |
| N12 | C11 | C32 | 118.2° | 119.0° |
| C11 | N12 | C13 | 124.5° | 121.7° |
| C11 | C32 | C30 | 117.1° | 118.0° |
| C11 | C32 | C31 | 120.5° | 120.0° |
| N12 | C13 | N14 | 120.8° | 123.3° |
| N12 | C13 | H13 | 119.6° | 118.3° |
| C13 | N14 | C15 | 122.2° | 119.7° |
| C13 | N14 | C30 | 120.9° | 120.6° |
| N14 | C13 | H13 | 119.6° | 118.4° |
| C15 | N14 | C30 | 116.8° | 119.7° |
| N14 | C15 | C16 | 126.3° | 120.0° |
| N14 | C15 | C28 | 113.5° | 120.0° |
| N14 | C30 | O31 | 119.8° | 121.3° |
| N14 | C30 | C32 | 118.4° | 117.4° |
| C16 | C15 | C28 | 120.1° | 120.0° |
| C15 | C16 | C17 | 117.7° | 119.8° |
| C15 | C16 | H16 | 121.1° | 120.1° |
| C15 | C28 | C27 | 121.4° | 120.1° |
| C15 | C28 | C29 | 123.6° | 120.0° |
| C16 | C17 | N18 | 121.6° | 120.0° |
| C16 | C17 | C26 | 122.4° | 119.9° |
| C17 | C16 | H16 | 121.2° | 120.1° |
| N18 | C17 | C26 | 115.9° | 120.0° |
| C17 | N18 | C19 | 122.9° | 119.9° |
| C17 | N18 | H18 | 118.5° | 120.0° |
| C17 | C26 | C27 | 118.8° | 120.0° |
| C17 | C26 | H26 | 120.6° | 120.0° |
| N18 | C19 | O20 | 126.1° | 120.1° |
| N18 | C19 | C21 | 113.2° | 120.0° |
| C19 | N18 | H18 | 118.5° | 120.0° |
| O20 | C19 | C21 | 120.7° | 119.9° |
| C19 | C21 | C22 | 126.2° | 127.2° |
| C19 | C21 | C25 | 124.0° | 127.1° |
| C22 | C21 | C25 | 109.8° | 105.6° |
| C21 | C22 | C23 | 101.3° | 106.0° |
| C21 | C22 | H22 | 129.4° | 127.0° |
| C21 | C25 | O24 | 106.7° | 108.4° |
| C21 | C25 | H25 | 126.7° | 125.8° |
| C22 | C23 | O24 | 111.2° | 109.1° |
| C23 | C22 | H22 | 129.3° | 127.0° |
| C22 | C23 | H23 | 124.4° | 125.4° |
| C23 | O24 | C25 | 111.0° | 110.9° |
| O24 | C23 | H23 | 124.4° | 125.5° |
| O24 | C25 | H25 | 126.7° | 125.8° |
| C26 | C27 | C28 | 119.5° | 120.2° |
| C27 | C26 | H26 | 120.6° | 120.0° |
| C26 | C27 | H27 | 120.3° | 119.9° |
| C27 | C28 | C29 | 115.0° | 120.0° |
| C28 | C27 | H27 | 120.2° | 119.9° |
| C28 | C29 | H291 | 109.5° | 109.4° |
| C28 | C29 | H292 | 109.5° | 109.5° |
| C28 | C29 | H293 | 109.4° | 109.5° |
| O31 | C30 | C32 | 121.7° | 121.3° |
| C30 | C32 | C31 | 122.4° | 121.9° |
| C32 | C31 | H31 | 120.4° | 120.3° |
| H11C | C1 | H12C | 109.4° | 109.5° |
| H11C | C1 | H13C | 109.5° | 109.5° |
| H12C | C1 | H13C | 109.5° | 109.5° |
| H31C | C3 | H32C | 109.4° | 109.5° |
| H71C | C7 | H72C | 109.5° | 109.5° |
| H41C | C4 | H42C | 109.5° | 109.6° |
| H61C | C6 | H62C | 109.5° | 109.5° |
| H291 | C29 | H292 | 109.5° | 109.5° |
| H291 | C29 | H293 | 109.5° | 109.5° |
| H292 | C29 | H293 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | N2 | C3 | C7 | 119.1° | 123.9° |
| C1 | N2 | C3 | C4 | 177.6° | 176.8° |
| C1 | N2 | C7 | C6 | 179.0° | 176.8° |
| N2 | C1 | H11C | H12C | 120.0° | 120.0° |
| N2 | C1 | H11C | H13C | 120.0° | 120.0° |
| N2 | C1 | H12C | H13C | 120.0° | 120.0° |
| C1 | N2 | C3 | H31C | 62.2° | 56.9° |
| C1 | N2 | C3 | H32C | 57.3° | 63.2° |
| C1 | N2 | C7 | H71C | 61.0° | 63.2° |
| C1 | N2 | C7 | H72C | 59.1° | 56.9° |
| N2 | C3 | C4 | H31C | 120.3° | 120.0° |
| N2 | C3 | C4 | H32C | 120.3° | 120.0° |
| N2 | C3 | C4 | N5 | 55.3° | 58.4° |
| C3 | N2 | C7 | C6 | 60.9° | 59.3° |
| C3 | N2 | C1 | H11C | 180.0° | 60.0° |
| C3 | N2 | C1 | H12C | 60.0° | 180.0° |
| C3 | N2 | C1 | H13C | 60.0° | 60.0° |
| N2 | C3 | H31C | H32C | 119.2° | 120.1° |
| C3 | N2 | C7 | H71C | 59.1° | 60.7° |
| C3 | N2 | C7 | H72C | 179.2° | 179.3° |
| N2 | C3 | C4 | H41C | 64.8° | 61.6° |
| N2 | C3 | C4 | H42C | 175.3° | 178.4° |
| C7 | N2 | C3 | C4 | 58.5° | 59.3° |
| N2 | C7 | C6 | N5 | 61.0° | 58.4° |
| N2 | C7 | C6 | H71C | 120.0° | 120.0° |
| N2 | C7 | C6 | H72C | 120.0° | 119.9° |
| C7 | N2 | C1 | H11C | 60.3° | 176.2° |
| C7 | N2 | C1 | H12C | 59.7° | 56.2° |
| C7 | N2 | C1 | H13C | 179.7° | 63.8° |
| C7 | N2 | C3 | H31C | 178.8° | 179.3° |
| C7 | N2 | C3 | H32C | 61.8° | 60.7° |
| N2 | C7 | H71C | H72C | 120.2° | 120.0° |
| N2 | C7 | C6 | H61C | 58.9° | 61.5° |
| N2 | C7 | C6 | H62C | 179.1° | 178.4° |
| C3 | C4 | N5 | H41C | 120.1° | 119.9° |
| C3 | C4 | N5 | H42C | 120.0° | 119.9° |
| C3 | C4 | N5 | C6 | 56.2° | 59.3° |
| C3 | C4 | N5 | C8 | 172.8° | 176.8° |
| C4 | C3 | H31C | H32C | 119.2° | 120.0° |
| C3 | C4 | H41C | H42C | 119.9° | 120.0° |
| C4 | N5 | C6 | C8 | 128.5° | 123.9° |
| C4 | N5 | C6 | C7 | 59.3° | 59.3° |
| C4 | N5 | C8 | C9 | 34.2° | 0.0° |
| C4 | N5 | C8 | C31 | 148.7° | 179.7° |
| N5 | C4 | C3 | H31C | 175.6° | 178.4° |
| N5 | C4 | C3 | H32C | 65.0° | 61.6° |
| N5 | C4 | H41C | H42C | 119.9° | 120.1° |
| C4 | N5 | C6 | H61C | 60.6° | 60.7° |
| C4 | N5 | C6 | H62C | 179.2° | 179.3° |
| N5 | C6 | C7 | H61C | 119.9° | 119.9° |
| N5 | C6 | C7 | H62C | 119.9° | 119.9° |
| C6 | N5 | C8 | C9 | 163.2° | 123.8° |
| C6 | N5 | C8 | C31 | 19.7° | 56.5° |
| N5 | C6 | C7 | H71C | 59.0° | 61.6° |
| N5 | C6 | C7 | H72C | 179.0° | 178.3° |
| C6 | N5 | C4 | H41C | 63.9° | 60.6° |
| C6 | N5 | C4 | H42C | 176.2° | 179.2° |
| N5 | C6 | H61C | H62C | 120.3° | 120.0° |
| C8 | N5 | C6 | C7 | 172.2° | 176.8° |
| N5 | C8 | C9 | C31 | 177.1° | 179.7° |
| N5 | C8 | C9 | C10 | 178.1° | 180.0° |
| N5 | C8 | C31 | C32 | 178.0° | 179.7° |
| C8 | N5 | C4 | H41C | 67.2° | 63.3° |
| C8 | N5 | C4 | H42C | 52.7° | 56.9° |
| C8 | N5 | C6 | H61C | 67.9° | 63.2° |
| C8 | N5 | C6 | H62C | 52.3° | 56.8° |
| N5 | C8 | C9 | H9 | 1.9° | 0.0° |
| N5 | C8 | C31 | H31 | 2.0° | 0.1° |
| C6 | C7 | H71C | H72C | 120.1° | 120.0° |
| C7 | C6 | H61C | H62C | 120.3° | 120.1° |
| C8 | C9 | C10 | H9 | 180.0° | 180.0° |
| C8 | C9 | C10 | C11 | 0.2° | 0.0° |
| C9 | C8 | C31 | C32 | 1.0° | 0.6° |
| C9 | C8 | C31 | H31 | 179.0° | 179.7° |
| C8 | C9 | C10 | H10 | 179.8° | 180.0° |
| C31 | C8 | C9 | C10 | 1.0° | 0.3° |
| C8 | C31 | C32 | C11 | 0.2° | 0.6° |
| C8 | C31 | C32 | C30 | 179.2° | 179.7° |
| C8 | C31 | C32 | H31 | 180.0° | 179.7° |
| C31 | C8 | C9 | H9 | 179.0° | 179.7° |
| C9 | C10 | C11 | H10 | 180.0° | 180.0° |
| C9 | C10 | C11 | N12 | 177.7° | 180.0° |
| C9 | C10 | C11 | C32 | 1.4° | 0.0° |
| C10 | C11 | N12 | C32 | 179.0° | 180.0° |
| C10 | C11 | N12 | C13 | 178.6° | 180.0° |
| C10 | C11 | C32 | C30 | 179.6° | 180.0° |
| C10 | C11 | C32 | C31 | 1.4° | 0.3° |
| C11 | C10 | C9 | H9 | 179.8° | 180.0° |
| C11 | N12 | C13 | N14 | 1.0° | 0.0° |
| N12 | C11 | C32 | C30 | 1.4° | 0.0° |
| N12 | C11 | C32 | C31 | 177.7° | 179.7° |
| N12 | C11 | C10 | H10 | 2.4° | 0.0° |
| C11 | N12 | C13 | H13 | 179.0° | 179.9° |
| C32 | C11 | N12 | C13 | 2.3° | 0.0° |
| C11 | C32 | C30 | N14 | 0.8° | 0.1° |
| C11 | C32 | C30 | O31 | 179.1° | 179.9° |
| C11 | C32 | C30 | C31 | 179.0° | 179.7° |
| C11 | C32 | C31 | H31 | 179.8° | 179.7° |
| C32 | C11 | C10 | H10 | 178.6° | 180.0° |
| N12 | C13 | N14 | H13 | 180.0° | 179.9° |
| N12 | C13 | N14 | C15 | 175.7° | 180.0° |
| N12 | C13 | N14 | C30 | 1.4° | 0.0° |
| C13 | N14 | C15 | C30 | 177.2° | 180.0° |
| C13 | N14 | C15 | C16 | 99.4° | 90.0° |
| C13 | N14 | C15 | C28 | 80.3° | 90.3° |
| C13 | N14 | C30 | O31 | 177.7° | 179.9° |
| C13 | N14 | C30 | C32 | 2.2° | 0.1° |
| N14 | C15 | C16 | C28 | 179.7° | 179.7° |
| N14 | C15 | C16 | C17 | 178.3° | 180.0° |
| N14 | C15 | C28 | C27 | 180.0° | 179.7° |
| N14 | C15 | C28 | C29 | 1.0° | 0.0° |
| C15 | N14 | C30 | O31 | 5.0° | 0.0° |
| C15 | N14 | C30 | C32 | 175.1° | 180.0° |
| C15 | N14 | C13 | H13 | 4.3° | 0.1° |
| N14 | C15 | C16 | H16 | 1.7° | 0.0° |
| C30 | N14 | C15 | C16 | 83.4° | 89.9° |
| C30 | N14 | C15 | C28 | 96.9° | 89.7° |
| N14 | C30 | O31 | C32 | 179.9° | 180.0° |
| N14 | C30 | C32 | C31 | 179.8° | 179.8° |
| C30 | N14 | C13 | H13 | 178.6° | 179.9° |
| C15 | C16 | C17 | H16 | 180.0° | 180.0° |
| C15 | C16 | C17 | N18 | 179.5° | 180.0° |
| C15 | C16 | C17 | C26 | 1.7° | 0.0° |
| C16 | C15 | C28 | C27 | 0.2° | 0.6° |
| C16 | C15 | C28 | C29 | 178.8° | 179.7° |
| C28 | C15 | C16 | C17 | 2.0° | 0.3° |
| C15 | C28 | C27 | C26 | 2.0° | 0.6° |
| C15 | C28 | C27 | C29 | 179.1° | 179.7° |
| C28 | C15 | C16 | H16 | 178.0° | 179.7° |
| C15 | C28 | C27 | H27 | 178.0° | 179.7° |
| C15 | C28 | C29 | H291 | 90.6° | 90.0° |
| C15 | C28 | C29 | H292 | 149.4° | 150.0° |
| C15 | C28 | C29 | H293 | 29.4° | 30.0° |
| C16 | C17 | N18 | C26 | 177.9° | 179.9° |
| C16 | C17 | N18 | C19 | 26.8° | 33.4° |
| C16 | C17 | C26 | C27 | 0.5° | 0.1° |
| C16 | C17 | N18 | H18 | 153.2° | 146.7° |
| C16 | C17 | C26 | H26 | 179.5° | 180.0° |
| C17 | N18 | C19 | H18 | 180.0° | 179.9° |
| C17 | N18 | C19 | O20 | 1.2° | 5.2° |
| C17 | N18 | C19 | C21 | 177.1° | 174.7° |
| N18 | C17 | C26 | C27 | 177.4° | 180.0° |
| N18 | C17 | C16 | H16 | 0.5° | 0.0° |
| N18 | C17 | C26 | H26 | 2.6° | 0.0° |
| C26 | C17 | N18 | C19 | 151.1° | 146.6° |
| C17 | C26 | C27 | H26 | 180.0° | 180.0° |
| C17 | C26 | C27 | C28 | 2.3° | 0.2° |
| C26 | C17 | C16 | H16 | 178.3° | 180.0° |
| C26 | C17 | N18 | H18 | 28.9° | 33.3° |
| C17 | C26 | C27 | H27 | 177.7° | 180.0° |
| N18 | C19 | O20 | C21 | 178.2° | 180.0° |
| N18 | C19 | C21 | C22 | 149.4° | 180.0° |
| N18 | C19 | C21 | C25 | 27.6° | 0.3° |
| O20 | C19 | C21 | C22 | 29.0° | 0.0° |
| O20 | C19 | C21 | C25 | 154.0° | 179.7° |
| O20 | C19 | N18 | H18 | 178.8° | 174.7° |
| C19 | C21 | C22 | C25 | 177.4° | 179.7° |
| C19 | C21 | C22 | C23 | 177.0° | 180.0° |
| C19 | C21 | C25 | O24 | 177.7° | 179.9° |
| C21 | C19 | N18 | H18 | 2.9° | 5.4° |
| C19 | C21 | C22 | H22 | 3.0° | 0.1° |
| C19 | C21 | C25 | H25 | 2.3° | 0.0° |
| C21 | C22 | C23 | H22 | 180.0° | 180.0° |
| C21 | C22 | C23 | O24 | 0.8° | 0.0° |
| C22 | C21 | C25 | O24 | 0.2° | 0.4° |
| C22 | C21 | C25 | H25 | 179.8° | 179.7° |
| C21 | C22 | C23 | H23 | 179.2° | 180.0° |
| C25 | C21 | C22 | C23 | 0.3° | 0.3° |
| C21 | C25 | O24 | C23 | 0.7° | 0.4° |
| C21 | C25 | O24 | H25 | 180.0° | 179.9° |
| C25 | C21 | C22 | H22 | 179.6° | 179.8° |
| C22 | C23 | O24 | H23 | 180.0° | 180.0° |
| C22 | C23 | O24 | C25 | 1.0° | 0.3° |
| O24 | C23 | C22 | H22 | 179.2° | 180.0° |
| C23 | O24 | C25 | H25 | 179.3° | 179.7° |
| C25 | O24 | C23 | H23 | 179.0° | 179.7° |
| C26 | C27 | C28 | H27 | 180.0° | 179.7° |
| C26 | C27 | C28 | C29 | 178.9° | 179.7° |
| C28 | C27 | C26 | H26 | 177.7° | 179.7° |
| C27 | C28 | C29 | H291 | 90.4° | 89.8° |
| C27 | C28 | C29 | H292 | 29.6° | 30.3° |
| C27 | C28 | C29 | H293 | 149.6° | 150.3° |
| C29 | C28 | C27 | H27 | 1.1° | 0.0° |
| C28 | C29 | H291 | H292 | 120.0° | 120.0° |
| C28 | C29 | H291 | H293 | 120.0° | 120.0° |
| C28 | C29 | H292 | H293 | 120.0° | 120.0° |
| O31 | C30 | C32 | C31 | 0.1° | 0.2° |
| C30 | C32 | C31 | H31 | 0.8° | 0.1° |
| H11C | C1 | H12C | H13C | 120.0° | 120.0° |
| H31C | C3 | C4 | H41C | 55.5° | 58.4° |
| H31C | C3 | C4 | H42C | 64.4° | 61.7° |
| H32C | C3 | C4 | H41C | 175.0° | 178.5° |
| H32C | C3 | C4 | H42C | 55.0° | 58.4° |
| H71C | C7 | C6 | H61C | 178.9° | 178.5° |
| H71C | C7 | C6 | H62C | 60.9° | 58.3° |
| H72C | C7 | C6 | H61C | 61.1° | 58.4° |
| H72C | C7 | C6 | H62C | 59.1° | 61.7° |
| H9 | C9 | C10 | H10 | 0.2° | 0.0° |
| H26 | C26 | C27 | H27 | 2.3° | 0.0° |
| H22 | C22 | C23 | H23 | 0.8° | 0.0° |
| H291 | C29 | H292 | H293 | 120.0° | 120.0° |
