A1H41
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | sing | 1.43Å | 1.42Å | |
| O | C1 | sing | 1.36Å | 1.37Å | |
| C1 | C2 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | C5 | doub | 1.39Å | 1.40Å | Aromatic |
| C1 | C6 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C7 | sing | 1.48Å | 1.48Å | |
| C7 | C8 | doub | 1.39Å | 1.40Å | Aromatic |
| C8 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C9 | C10 | doub | 1.38Å | 1.38Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.39Å | Aromatic |
| C11 | N | sing | 1.40Å | 1.41Å | |
| N | C12 | sing | 1.35Å | 1.36Å | |
| C12 | O1 | doub | 1.22Å | 1.22Å | |
| N1 | C12 | sing | 1.35Å | 1.36Å | |
| N1 | C13 | sing | 1.47Å | 1.46Å | |
| C13 | C14 | sing | 1.53Å | 1.52Å | |
| C14 | C15 | sing | 1.50Å | 1.50Å | |
| C15 | C16 | doub | 1.31Å | 1.33Å | |
| C16 | C17 | sing | 1.50Å | 1.49Å | |
| C17 | N1 | sing | 1.47Å | 1.47Å | |
| C18 | C15 | sing | 1.48Å | 1.48Å | |
| C18 | N2 | doub | 1.33Å | 1.34Å | Aromatic |
| N2 | C19 | sing | 1.32Å | 1.33Å | Aromatic |
| C19 | N3 | doub | 1.32Å | 1.33Å | Aromatic |
| N3 | C20 | sing | 1.33Å | 1.34Å | Aromatic |
| C20 | N4 | sing | 1.37Å | 1.36Å | Aromatic |
| N4 | C21 | sing | 1.37Å | 1.37Å | Aromatic |
| C21 | C22 | doub | 1.34Å | 1.36Å | Aromatic |
| C23 | C22 | sing | 1.51Å | 1.51Å | |
| C23 | C24 | sing | 1.53Å | 1.50Å | |
| C24 | C25 | sing | 1.53Å | 1.48Å | |
| C25 | C23 | sing | 1.53Å | 1.50Å | |
| C22 | C26 | sing | 1.46Å | 1.44Å | Aromatic |
| C26 | C18 | sing | 1.41Å | 1.42Å | Aromatic |
| C20 | C26 | doub | 1.41Å | 1.40Å | Aromatic |
| C27 | C11 | doub | 1.39Å | 1.39Å | Aromatic |
| C7 | C27 | sing | 1.39Å | 1.39Å | Aromatic |
| N | H11 | sing | 0.97Å | 1.00Å | |
| C2 | H4 | sing | 1.08Å | 1.08Å | |
| C3 | H5 | sing | 1.08Å | 1.08Å | |
| C4 | H6 | sing | 1.08Å | 1.08Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C | H1 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.08Å | 1.08Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H18 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C21 | H20 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H22 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H26 | sing | 1.08Å | 1.08Å | |
| C6 | H7 | sing | 1.08Å | 1.08Å | |
| C8 | H8 | sing | 1.08Å | 1.08Å | |
| C9 | H9 | sing | 1.08Å | 1.08Å | |
| N4 | H | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | O | C1 | 118.0° | 117.0° |
| O | C | H3 | 109.5° | 109.5° |
| O | C | H1 | 109.5° | 109.5° |
| O | C | H2 | 109.5° | 109.5° |
| O | C1 | C2 | 123.0° | 119.9° |
| O | C1 | C6 | 116.1° | 120.0° |
| C1 | C2 | C3 | 119.1° | 120.1° |
| C2 | C1 | C6 | 120.9° | 120.1° |
| C1 | C2 | H4 | 120.5° | 120.0° |
| C2 | C3 | C4 | 120.5° | 120.2° |
| C3 | C2 | H4 | 120.4° | 119.9° |
| C2 | C3 | H5 | 119.8° | 119.9° |
| C3 | C4 | C5 | 120.8° | 120.0° |
| C4 | C3 | H5 | 119.7° | 119.9° |
| C3 | C4 | H6 | 119.6° | 120.0° |
| C4 | C5 | C6 | 118.7° | 119.9° |
| C4 | C5 | C7 | 121.0° | 120.1° |
| C5 | C4 | H6 | 119.7° | 120.0° |
| C5 | C6 | C1 | 120.1° | 119.8° |
| C6 | C5 | C7 | 120.2° | 120.1° |
| C5 | C6 | H7 | 120.0° | 120.1° |
| C1 | C6 | H7 | 119.9° | 120.1° |
| C5 | C7 | C8 | 120.9° | 120.1° |
| C5 | C7 | C27 | 120.7° | 120.1° |
| C7 | C8 | C9 | 120.7° | 120.0° |
| C8 | C7 | C27 | 118.4° | 119.8° |
| C7 | C8 | H8 | 119.6° | 120.0° |
| C8 | C9 | C10 | 120.4° | 120.2° |
| C9 | C8 | H8 | 119.7° | 120.0° |
| C8 | C9 | H9 | 119.8° | 119.9° |
| C9 | C10 | C11 | 119.8° | 120.2° |
| C9 | C10 | H10 | 120.1° | 119.9° |
| C10 | C9 | H9 | 119.8° | 119.9° |
| C10 | C11 | N | 121.0° | 120.0° |
| C10 | C11 | C27 | 119.7° | 120.0° |
| C11 | C10 | H10 | 120.1° | 119.9° |
| C11 | N | C12 | 127.9° | 120.0° |
| N | C11 | C27 | 119.2° | 120.0° |
| C11 | N | H11 | 116.0° | 120.0° |
| N | C12 | O1 | 123.6° | 120.0° |
| N | C12 | N1 | 115.4° | 120.0° |
| C12 | N | H11 | 116.0° | 120.0° |
| O1 | C12 | N1 | 120.9° | 120.0° |
| C12 | N1 | C13 | 123.5° | 121.4° |
| C12 | N1 | C17 | 117.1° | 121.3° |
| N1 | C13 | C14 | 110.6° | 107.9° |
| C13 | N1 | C17 | 116.5° | 117.3° |
| N1 | C13 | H13 | 109.2° | 109.8° |
| N1 | C13 | H12 | 109.2° | 109.8° |
| C13 | C14 | C15 | 109.6° | 110.4° |
| C14 | C13 | H13 | 109.2° | 109.8° |
| C14 | C13 | H12 | 109.2° | 109.8° |
| C13 | C14 | H15 | 109.5° | 109.3° |
| C13 | C14 | H14 | 109.5° | 109.3° |
| C14 | C15 | C16 | 120.5° | 124.4° |
| C14 | C15 | C18 | 119.1° | 117.8° |
| C15 | C14 | H15 | 109.4° | 109.3° |
| C15 | C14 | H14 | 109.4° | 109.4° |
| C15 | C16 | C17 | 124.8° | 123.4° |
| C16 | C15 | C18 | 120.3° | 117.8° |
| C15 | C16 | H16 | 117.6° | 118.3° |
| C16 | C17 | N1 | 112.3° | 109.1° |
| C17 | C16 | H16 | 117.6° | 118.3° |
| C16 | C17 | H18 | 108.7° | 109.5° |
| C16 | C17 | H17 | 108.7° | 109.5° |
| N1 | C17 | H18 | 108.8° | 109.5° |
| N1 | C17 | H17 | 108.7° | 109.5° |
| C15 | C18 | N2 | 111.9° | 120.9° |
| C15 | C18 | C26 | 124.9° | 120.9° |
| C18 | N2 | C19 | 116.4° | 121.0° |
| N2 | C18 | C26 | 122.7° | 118.2° |
| N2 | C19 | N3 | 128.4° | 122.8° |
| N2 | C19 | H19 | 115.8° | 118.6° |
| C19 | N3 | C20 | 113.1° | 120.8° |
| N3 | C19 | H19 | 115.8° | 118.5° |
| N3 | C20 | N4 | 125.1° | 134.4° |
| N3 | C20 | C26 | 126.5° | 118.5° |
| C20 | N4 | C21 | 108.5° | 110.0° |
| N4 | C20 | C26 | 108.4° | 107.1° |
| C20 | N4 | H | 125.8° | 125.0° |
| N4 | C21 | C22 | 110.5° | 109.9° |
| N4 | C21 | H20 | 124.8° | 125.1° |
| C21 | N4 | H | 125.8° | 125.0° |
| C21 | C22 | C23 | 127.1° | 126.6° |
| C21 | C22 | C26 | 106.2° | 106.8° |
| C22 | C21 | H20 | 124.8° | 125.1° |
| C22 | C23 | C24 | 120.1° | 117.5° |
| C22 | C23 | C25 | 120.1° | 117.5° |
| C23 | C22 | C26 | 126.7° | 126.6° |
| C22 | C23 | H21 | 115.3° | 115.5° |
| C23 | C24 | C25 | 60.6° | 60.0° |
| C24 | C23 | C25 | 58.8° | 60.0° |
| C24 | C23 | H21 | 115.4° | 117.6° |
| C23 | C24 | H23 | 119.9° | 117.5° |
| C23 | C24 | H22 | 119.9° | 117.5° |
| C24 | C25 | C23 | 60.6° | 60.0° |
| C25 | C24 | H23 | 119.9° | 117.5° |
| C25 | C24 | H22 | 119.9° | 117.5° |
| C24 | C25 | H25 | 119.9° | 117.5° |
| C24 | C25 | H24 | 119.9° | 117.5° |
| C25 | C23 | H21 | 115.4° | 117.5° |
| C23 | C25 | H25 | 119.9° | 117.5° |
| C23 | C25 | H24 | 119.9° | 117.5° |
| C22 | C26 | C18 | 140.6° | 135.2° |
| C22 | C26 | C20 | 106.5° | 106.2° |
| C18 | C26 | C20 | 112.9° | 118.6° |
| C11 | C27 | C7 | 121.1° | 119.8° |
| C11 | C27 | H26 | 119.5° | 120.1° |
| C7 | C27 | H26 | 119.5° | 120.1° |
| H3 | C | H1 | 109.5° | 109.5° |
| H3 | C | H2 | 109.5° | 109.5° |
| H1 | C | H2 | 109.4° | 109.4° |
| H13 | C13 | H12 | 109.5° | 109.7° |
| H15 | C14 | H14 | 109.5° | 109.1° |
| H18 | C17 | H17 | 109.5° | 109.6° |
| H23 | C24 | H22 | 109.5° | 115.6° |
| H25 | C25 | H24 | 109.5° | 115.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | O | C1 | C2 | 10.3° | 0.0° |
| C | O | C1 | C6 | 170.9° | 179.7° |
| O | C | H3 | H1 | 120.0° | 120.0° |
| O | C | H3 | H2 | 120.0° | 120.0° |
| O | C | H1 | H2 | 120.0° | 120.0° |
| O | C1 | C2 | C6 | 178.7° | 179.8° |
| O | C1 | C2 | C3 | 178.6° | 179.7° |
| O | C1 | C6 | C5 | 177.9° | 179.7° |
| O | C1 | C2 | H4 | 1.4° | 0.2° |
| C1 | O | C | H3 | 180.0° | 60.0° |
| C1 | O | C | H1 | 60.0° | 180.0° |
| C1 | O | C | H2 | 60.0° | 60.1° |
| O | C1 | C6 | H7 | 2.0° | 0.2° |
| C1 | C2 | C3 | H4 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 0.4° | 0.0° |
| C2 | C1 | C6 | C5 | 0.8° | 0.1° |
| C1 | C2 | C3 | H5 | 179.6° | 180.0° |
| C2 | C1 | C6 | H7 | 179.2° | 180.0° |
| C2 | C3 | C4 | H5 | 180.0° | 179.9° |
| C2 | C3 | C4 | C5 | 0.1° | 0.0° |
| C3 | C2 | C1 | C6 | 0.1° | 0.0° |
| C2 | C3 | C4 | H6 | 179.9° | 179.9° |
| C3 | C4 | C5 | H6 | 180.0° | 180.0° |
| C3 | C4 | C5 | C6 | 0.7° | 0.0° |
| C3 | C4 | C5 | C7 | 176.6° | 180.0° |
| C4 | C3 | C2 | H4 | 179.6° | 180.0° |
| C4 | C5 | C6 | C7 | 177.3° | 180.0° |
| C4 | C5 | C6 | C1 | 1.1° | 0.0° |
| C4 | C5 | C7 | C8 | 155.8° | NaN° |
| C4 | C5 | C7 | C27 | 23.3° | 0.0° |
| C5 | C4 | C3 | H5 | 179.9° | 180.0° |
| C4 | C5 | C6 | H7 | 178.9° | 180.0° |
| C5 | C6 | C1 | H7 | 180.0° | 180.0° |
| C6 | C5 | C7 | C8 | 21.4° | 0.0° |
| C6 | C5 | C7 | C27 | 159.5° | 180.0° |
| C6 | C5 | C4 | H6 | 179.4° | 179.9° |
| C1 | C6 | C5 | C7 | 176.2° | 180.0° |
| C6 | C1 | C2 | H4 | 179.9° | 180.0° |
| C5 | C7 | C8 | C27 | 179.1° | 180.0° |
| C5 | C7 | C8 | C9 | 178.7° | 179.7° |
| C5 | C7 | C27 | C11 | 179.2° | 179.9° |
| C7 | C5 | C4 | H6 | 3.3° | 0.1° |
| C5 | C7 | C27 | H26 | 0.8° | 0.1° |
| C7 | C5 | C6 | H7 | 3.8° | 0.0° |
| C5 | C7 | C8 | H8 | 1.3° | 0.1° |
| C7 | C8 | C9 | H8 | 180.0° | 179.8° |
| C7 | C8 | C9 | C10 | 0.4° | 0.5° |
| C8 | C7 | C27 | C11 | 0.1° | 0.0° |
| C8 | C7 | C27 | H26 | 179.9° | 180.0° |
| C7 | C8 | C9 | H9 | 179.6° | 180.0° |
| C8 | C9 | C10 | H9 | 180.0° | 179.5° |
| C8 | C9 | C10 | C11 | 0.2° | 0.5° |
| C9 | C8 | C7 | C27 | 0.4° | 0.2° |
| C8 | C9 | C10 | H10 | 179.8° | 179.7° |
| C9 | C10 | C11 | H10 | 180.0° | 179.8° |
| C9 | C10 | C11 | N | 175.2° | 179.8° |
| C9 | C10 | C11 | C27 | 0.8° | 0.3° |
| C10 | C9 | C8 | H8 | 179.6° | 179.8° |
| C10 | C11 | N | C27 | 176.0° | 179.9° |
| C10 | C11 | N | C12 | 29.3° | 29.3° |
| C10 | C11 | C27 | C7 | 0.7° | 0.0° |
| C10 | C11 | N | H11 | 150.7° | 150.7° |
| C10 | C11 | C27 | H26 | 179.3° | 180.0° |
| C11 | C10 | C9 | H9 | 179.8° | 180.0° |
| C11 | N | C12 | H11 | 180.0° | 180.0° |
| C11 | N | C12 | O1 | 2.0° | 9.8° |
| C11 | N | C12 | N1 | 178.1° | 170.2° |
| N | C11 | C27 | C7 | 175.3° | 179.9° |
| N | C11 | C10 | H10 | 4.8° | 0.0° |
| N | C11 | C27 | H26 | 4.7° | 0.1° |
| N | C12 | O1 | N1 | 179.9° | 180.0° |
| N | C12 | N1 | C13 | 173.6° | 175.3° |
| N | C12 | N1 | C17 | 26.4° | 4.7° |
| C12 | N | C11 | C27 | 154.8° | 150.8° |
| O1 | C12 | N1 | C13 | 6.3° | 4.7° |
| O1 | C12 | N1 | C17 | 153.7° | 175.2° |
| O1 | C12 | N | H11 | 178.0° | 170.2° |
| C12 | N1 | C13 | C17 | 160.1° | 180.0° |
| C12 | N1 | C13 | C14 | 104.1° | 117.7° |
| C12 | N1 | C17 | C16 | 133.2° | 136.7° |
| N1 | C12 | N | H11 | 1.9° | 9.7° |
| C12 | N1 | C13 | H13 | 135.7° | 2.0° |
| C12 | N1 | C13 | H12 | 16.1° | 122.7° |
| C12 | N1 | C17 | H18 | 106.4° | 103.4° |
| C12 | N1 | C17 | H17 | 12.8° | 16.8° |
| N1 | C13 | C14 | H13 | 120.2° | 119.6° |
| N1 | C13 | C14 | H12 | 120.2° | 119.7° |
| N1 | C13 | C14 | C15 | 53.6° | 45.7° |
| C13 | N1 | C17 | C16 | 28.3° | 43.3° |
| N1 | C13 | H13 | H12 | 119.5° | 120.7° |
| N1 | C13 | C14 | H15 | 173.6° | 166.0° |
| N1 | C13 | C14 | H14 | 66.4° | 74.6° |
| C13 | N1 | C17 | H18 | 92.2° | 76.6° |
| C13 | N1 | C17 | H17 | 148.7° | 163.2° |
| C13 | C14 | C15 | H15 | 120.0° | 120.2° |
| C13 | C14 | C15 | H14 | 120.0° | 120.3° |
| C13 | C14 | C15 | C16 | 28.5° | 19.0° |
| C14 | C13 | N1 | C17 | 56.0° | 62.4° |
| C13 | C14 | C15 | C18 | 152.2° | 161.0° |
| C14 | C13 | H13 | H12 | 119.5° | 120.8° |
| C13 | C14 | H15 | H14 | 120.0° | 119.5° |
| C14 | C15 | C16 | C18 | 179.3° | 180.0° |
| C14 | C15 | C16 | C17 | 1.9° | 0.8° |
| C14 | C15 | C18 | N2 | 126.2° | 68.0° |
| C14 | C15 | C18 | C26 | 45.8° | 111.7° |
| C15 | C14 | C13 | H13 | 66.6° | 165.4° |
| C15 | C14 | C13 | H12 | 173.7° | 73.9° |
| C15 | C14 | H15 | H14 | 119.9° | 119.5° |
| C14 | C15 | C16 | H16 | 178.1° | 179.2° |
| C15 | C16 | C17 | H16 | 180.0° | 180.0° |
| C15 | C16 | C17 | N1 | 0.5° | 11.1° |
| C16 | C15 | C18 | N2 | 53.1° | 112.1° |
| C16 | C15 | C18 | C26 | 134.9° | 68.3° |
| C16 | C15 | C14 | H15 | 148.5° | 139.3° |
| C16 | C15 | C14 | H14 | 91.5° | 101.3° |
| C15 | C16 | C17 | H18 | 120.0° | 108.8° |
| C15 | C16 | C17 | H17 | 120.9° | 130.9° |
| C16 | C17 | N1 | H18 | 120.4° | 119.9° |
| C16 | C17 | N1 | H17 | 120.4° | 119.9° |
| C17 | C16 | C15 | C18 | 178.8° | 179.2° |
| C16 | C17 | H18 | H17 | 118.7° | 120.2° |
| C17 | N1 | C13 | H13 | 64.1° | 178.0° |
| C17 | N1 | C13 | H12 | 176.2° | 57.3° |
| N1 | C17 | C16 | H16 | 179.5° | 169.0° |
| N1 | C17 | H18 | H17 | 118.7° | 120.2° |
| C15 | C18 | N2 | C26 | 172.2° | 179.7° |
| C15 | C18 | N2 | C19 | 168.3° | 179.9° |
| C15 | C18 | C26 | C22 | 13.5° | 0.1° |
| C15 | C18 | C26 | C20 | 166.9° | 180.0° |
| C18 | C15 | C14 | H15 | 32.2° | 40.7° |
| C18 | C15 | C14 | H14 | 87.7° | 78.7° |
| C18 | C15 | C16 | H16 | 1.2° | 0.8° |
| C18 | N2 | C19 | N3 | 0.5° | 0.1° |
| N2 | C18 | C26 | C22 | 175.3° | 179.8° |
| N2 | C18 | C26 | C20 | 4.2° | 0.3° |
| C18 | N2 | C19 | H19 | 179.5° | 179.7° |
| N2 | C19 | N3 | H19 | 180.0° | 179.6° |
| N2 | C19 | N3 | C20 | 2.0° | 0.4° |
| C19 | N2 | C18 | C26 | 3.9° | 0.2° |
| C19 | N3 | C20 | N4 | 177.5° | 179.7° |
| C19 | N3 | C20 | C26 | 1.4° | 0.3° |
| N3 | C20 | N4 | C26 | 179.1° | 179.9° |
| N3 | C20 | N4 | C21 | 178.5° | 179.9° |
| N3 | C20 | C26 | C22 | 178.2° | 179.9° |
| N3 | C20 | C26 | C18 | 1.5° | 0.0° |
| C20 | N3 | C19 | H19 | 178.0° | 180.0° |
| N3 | C20 | N4 | H | 1.6° | 0.1° |
| C20 | N4 | C21 | H | 180.0° | 180.0° |
| C20 | N4 | C21 | C22 | 0.1° | 0.0° |
| N4 | C20 | C26 | C22 | 0.8° | 0.0° |
| N4 | C20 | C26 | C18 | 179.5° | 180.0° |
| C20 | N4 | C21 | H20 | 179.9° | 180.0° |
| N4 | C21 | C22 | H20 | 180.0° | 179.9° |
| N4 | C21 | C22 | C23 | 178.5° | 179.9° |
| N4 | C21 | C22 | C26 | 0.4° | 0.0° |
| C21 | N4 | C20 | C26 | 0.6° | 0.0° |
| C21 | C22 | C23 | C26 | 178.7° | 179.9° |
| C21 | C22 | C23 | C24 | 3.1° | 65.6° |
| C21 | C22 | C23 | C25 | 66.0° | 3.0° |
| C21 | C22 | C26 | C18 | 179.7° | 179.9° |
| C21 | C22 | C26 | C20 | 0.8° | 0.0° |
| C21 | C22 | C23 | H21 | 148.5° | 148.6° |
| C22 | C21 | N4 | H | 179.9° | 180.0° |
| C22 | C23 | C24 | C25 | 109.1° | 107.5° |
| C22 | C23 | C24 | H21 | 145.4° | 145.0° |
| C22 | C23 | C25 | H21 | 145.4° | 144.9° |
| C23 | C22 | C26 | C18 | 1.4° | 0.0° |
| C23 | C22 | C26 | C20 | 178.1° | 179.9° |
| C23 | C22 | C21 | H20 | 1.5° | 0.1° |
| C22 | C23 | C24 | H23 | 0.5° | 0.0° |
| C22 | C23 | C24 | H22 | 141.2° | 145.1° |
| C22 | C23 | C25 | H25 | 0.5° | 145.0° |
| C22 | C23 | C25 | H24 | 141.3° | 0.0° |
| C23 | C24 | C25 | H23 | 109.6° | 107.5° |
| C23 | C24 | C25 | H22 | 109.6° | 107.5° |
| C24 | C23 | C25 | H21 | 105.5° | 107.5° |
| C24 | C23 | C22 | C26 | 175.5° | 114.3° |
| C23 | C24 | H23 | H22 | 144.4° | 145.7° |
| C24 | C23 | C25 | H25 | 109.6° | 107.5° |
| C24 | C23 | C25 | H24 | 109.6° | 107.5° |
| C25 | C24 | H23 | H22 | 144.5° | 145.7° |
| C24 | C25 | H25 | H24 | 144.4° | 145.7° |
| C25 | C23 | C22 | C26 | 115.3° | 177.1° |
| C23 | C25 | H25 | H24 | 144.4° | 145.7° |
| C22 | C26 | C18 | C20 | 179.5° | 179.9° |
| C26 | C22 | C21 | H20 | 179.6° | 180.0° |
| C26 | C22 | C23 | H21 | 30.1° | 31.5° |
| C26 | C20 | N4 | H | 179.4° | 180.0° |
| C11 | C27 | C7 | H26 | 180.0° | 180.0° |
| C27 | C11 | N | H11 | 25.2° | 29.2° |
| C27 | C11 | C10 | H10 | 179.3° | 180.0° |
| C27 | C7 | C8 | H8 | 179.6° | 180.0° |
| H4 | C2 | C3 | H5 | 0.4° | 0.0° |
| H5 | C3 | C4 | H6 | 0.1° | 0.0° |
| H3 | C | H1 | H2 | 120.0° | 120.0° |
| H10 | C10 | C9 | H9 | 0.2° | 0.2° |
| H13 | C13 | C14 | H15 | 53.4° | 74.4° |
| H13 | C13 | C14 | H14 | 173.4° | 45.0° |
| H12 | C13 | C14 | H15 | 66.2° | 46.3° |
| H12 | C13 | C14 | H14 | 53.7° | 165.7° |
| H16 | C16 | C17 | H18 | 60.0° | 71.1° |
| H16 | C16 | C17 | H17 | 59.1° | 49.1° |
| H20 | C21 | N4 | H | 0.1° | 0.0° |
| H21 | C23 | C24 | H23 | 144.8° | 145.0° |
| H21 | C23 | C24 | H22 | 4.2° | 0.0° |
| H21 | C23 | C25 | H25 | 144.9° | 0.0° |
| H21 | C23 | C25 | H24 | 4.1° | 145.0° |
| H23 | C24 | C25 | H25 | 0.1° | 145.0° |
| H23 | C24 | C25 | H24 | 140.8° | 0.0° |
| H22 | C24 | C25 | H25 | 140.7° | 0.0° |
| H22 | C24 | C25 | H24 | 0.0° | 145.0° |
| H8 | C8 | C9 | H9 | 0.4° | 0.2° |
