HRA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O | C | sing | 1.43Å | 1.36Å | |
| C | C3 | sing | 1.53Å | 1.56Å | |
| O1 | C4 | sing | 1.43Å | 1.41Å | |
| O1 | C3 | sing | 1.43Å | 1.48Å | |
| C17 | N1 | doub | 1.32Å | 1.36Å | Aromatic |
| C17 | N2 | sing | 1.32Å | 1.32Å | Aromatic |
| N1 | C14 | sing | 1.33Å | 1.35Å | Aromatic |
| C4 | C18 | sing | 1.53Å | 1.54Å | |
| C3 | C2 | sing | 1.53Å | 1.44Å | |
| N2 | C16 | doub | 1.33Å | 1.35Å | Aromatic |
| C2 | C1 | sing | 1.53Å | 1.51Å | |
| C18 | C1 | sing | 1.53Å | 1.55Å | |
| C18 | N3 | sing | 1.46Å | 1.44Å | |
| C14 | N3 | sing | 1.38Å | 1.35Å | |
| C14 | C15 | doub | 1.40Å | 1.39Å | Aromatic |
| C16 | C15 | sing | 1.40Å | 1.39Å | Aromatic |
| C16 | N | sing | 1.37Å | 1.36Å | Aromatic |
| C15 | C13 | sing | 1.47Å | 1.41Å | Aromatic |
| N | C12 | sing | 1.36Å | 1.35Å | Aromatic |
| C13 | C12 | doub | 1.37Å | 1.39Å | Aromatic |
| C13 | C11 | sing | 1.47Å | 1.45Å | |
| O3 | C11 | doub | 1.22Å | 1.25Å | |
| C11 | C10 | sing | 1.48Å | 1.44Å | |
| CL | C9 | sing | 1.74Å | 1.72Å | |
| C10 | C9 | doub | 1.40Å | 1.41Å | Aromatic |
| C10 | C5 | sing | 1.40Å | 1.39Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.37Å | Aromatic |
| C5 | C6 | doub | 1.38Å | 1.40Å | Aromatic |
| C8 | C7 | doub | 1.39Å | 1.38Å | Aromatic |
| C6 | C7 | sing | 1.39Å | 1.39Å | Aromatic |
| C7 | O2 | sing | 1.36Å | 1.36Å | |
| C20 | C21 | doub | 1.38Å | 1.43Å | Aromatic |
| C20 | C19 | sing | 1.39Å | 1.40Å | Aromatic |
| C21 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| O2 | C19 | sing | 1.36Å | 1.37Å | |
| C19 | C24 | doub | 1.39Å | 1.41Å | Aromatic |
| C22 | C23 | doub | 1.38Å | 1.43Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.41Å | Aromatic |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C4 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.08Å | 1.08Å | |
| C6 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C | H11 | sing | 1.09Å | 1.10Å | |
| C | H12 | sing | 1.09Å | 1.10Å | |
| O | H13 | sing | 0.97Å | 0.95Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| N3 | H15 | sing | 0.97Å | 1.00Å | |
| C17 | H16 | sing | 1.08Å | 1.08Å | |
| N | H17 | sing | 0.97Å | 1.00Å | |
| C8 | H18 | sing | 1.08Å | 1.08Å | |
| C24 | H19 | sing | 1.08Å | 1.08Å | |
| C23 | H20 | sing | 1.08Å | 1.08Å | |
| C22 | H21 | sing | 1.08Å | 1.08Å | |
| C21 | H22 | sing | 1.08Å | 1.08Å | |
| C20 | H23 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O | C | C3 | 104.6° | 109.5° |
| O | C | H11 | 110.7° | 109.4° |
| O | C | H12 | 110.7° | 109.4° |
| C | O | H13 | 109.5° | 114.0° |
| C | C3 | O1 | 111.8° | 109.5° |
| C | C3 | C2 | 102.7° | 109.5° |
| C | C3 | H5 | 108.7° | 109.5° |
| C3 | C | H11 | 110.7° | 109.5° |
| C3 | C | H12 | 110.7° | 109.5° |
| C4 | O1 | C3 | 116.0° | 114.1° |
| O1 | C4 | C18 | 110.2° | 109.5° |
| O1 | C4 | H6 | 109.3° | 109.3° |
| O1 | C4 | H7 | 109.3° | 109.6° |
| O1 | C3 | C2 | 113.4° | 109.4° |
| O1 | C3 | H5 | 109.7° | 109.5° |
| N1 | C17 | N2 | 126.8° | 122.7° |
| C17 | N1 | C14 | 116.8° | 121.0° |
| N1 | C17 | H16 | 116.6° | 118.7° |
| C17 | N2 | C16 | 114.2° | 120.7° |
| N2 | C17 | H16 | 116.6° | 118.7° |
| N1 | C14 | N3 | 115.6° | 120.8° |
| N1 | C14 | C15 | 121.5° | 118.3° |
| C4 | C18 | C1 | 111.4° | 109.2° |
| C4 | C18 | N3 | 109.8° | 109.5° |
| C18 | C4 | H6 | 109.3° | 109.5° |
| C18 | C4 | H7 | 109.3° | 109.5° |
| C4 | C18 | H14 | 108.5° | 109.5° |
| C3 | C2 | C1 | 111.8° | 109.2° |
| C3 | C2 | H3 | 108.9° | 109.5° |
| C3 | C2 | H4 | 108.9° | 109.6° |
| C2 | C3 | H5 | 110.3° | 109.5° |
| N2 | C16 | C15 | 125.3° | 118.5° |
| N2 | C16 | N | 125.9° | 134.0° |
| C2 | C1 | C18 | 109.0° | 109.1° |
| C2 | C1 | H1 | 109.6° | 109.5° |
| C2 | C1 | H2 | 109.6° | 109.5° |
| C1 | C2 | H3 | 108.9° | 109.6° |
| C1 | C2 | H4 | 108.9° | 109.5° |
| C1 | C18 | N3 | 108.6° | 109.6° |
| C18 | C1 | H1 | 109.6° | 109.6° |
| C18 | C1 | H2 | 109.6° | 109.6° |
| C1 | C18 | H14 | 108.4° | 109.4° |
| C18 | N3 | C14 | 126.6° | 120.0° |
| N3 | C18 | H14 | 110.0° | 109.6° |
| C18 | N3 | H15 | 105.1° | 120.0° |
| N3 | C14 | C15 | 122.9° | 120.9° |
| C14 | N3 | H15 | 105.0° | 120.0° |
| C14 | C15 | C16 | 115.3° | 118.8° |
| C14 | C15 | C13 | 138.3° | 135.1° |
| C15 | C16 | N | 108.7° | 107.5° |
| C16 | C15 | C13 | 106.4° | 106.1° |
| C16 | N | C12 | 109.1° | 110.6° |
| C16 | N | H17 | 125.5° | 124.8° |
| C15 | C13 | C12 | 106.6° | 106.3° |
| C15 | C13 | C11 | 132.2° | 126.9° |
| N | C12 | C13 | 109.1° | 109.6° |
| N | C12 | H10 | 125.5° | 125.2° |
| C12 | N | H17 | 125.5° | 124.6° |
| C12 | C13 | C11 | 121.2° | 126.8° |
| C13 | C12 | H10 | 125.5° | 125.2° |
| C13 | C11 | O3 | 118.7° | 120.0° |
| C13 | C11 | C10 | 121.8° | 120.0° |
| O3 | C11 | C10 | 119.3° | 120.1° |
| C11 | C10 | C9 | 124.7° | 120.1° |
| C11 | C10 | C5 | 118.4° | 120.1° |
| CL | C9 | C10 | 121.5° | 120.0° |
| CL | C9 | C8 | 117.5° | 120.1° |
| C9 | C10 | C5 | 116.8° | 119.8° |
| C10 | C9 | C8 | 120.9° | 119.9° |
| C10 | C5 | C6 | 123.2° | 119.9° |
| C10 | C5 | H8 | 118.4° | 120.0° |
| C9 | C8 | C7 | 120.8° | 120.1° |
| C9 | C8 | H18 | 119.6° | 119.9° |
| C5 | C6 | C7 | 117.3° | 120.1° |
| C6 | C5 | H8 | 118.4° | 120.0° |
| C5 | C6 | H9 | 121.3° | 120.0° |
| C8 | C7 | C6 | 120.9° | 120.2° |
| C8 | C7 | O2 | 119.3° | 119.9° |
| C7 | C8 | H18 | 119.6° | 120.0° |
| C6 | C7 | O2 | 119.8° | 119.9° |
| C7 | C6 | H9 | 121.4° | 119.9° |
| C7 | O2 | C19 | 119.6° | 118.0° |
| C21 | C20 | C19 | 119.2° | 120.0° |
| C20 | C21 | C22 | 120.1° | 120.0° |
| C20 | C21 | H22 | 119.9° | 120.0° |
| C21 | C20 | H23 | 120.4° | 120.0° |
| C20 | C19 | O2 | 122.8° | 120.1° |
| C20 | C19 | C24 | 120.9° | 119.9° |
| C19 | C20 | H23 | 120.4° | 120.0° |
| C21 | C22 | C23 | 120.8° | 120.1° |
| C21 | C22 | H21 | 119.6° | 119.9° |
| C22 | C21 | H22 | 120.0° | 120.0° |
| O2 | C19 | C24 | 116.3° | 120.1° |
| C19 | C24 | C23 | 120.4° | 119.9° |
| C19 | C24 | H19 | 119.8° | 120.0° |
| C22 | C23 | C24 | 118.6° | 120.1° |
| C22 | C23 | H20 | 120.7° | 120.0° |
| C23 | C22 | H21 | 119.6° | 119.9° |
| C23 | C24 | H19 | 119.8° | 120.0° |
| C24 | C23 | H20 | 120.7° | 119.9° |
| H1 | C1 | H2 | 109.5° | 109.5° |
| H3 | C2 | H4 | 109.5° | 109.5° |
| H6 | C4 | H7 | 109.5° | 109.5° |
| H11 | C | H12 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O | C | C3 | H11 | 119.2° | 120.0° |
| O | C | C3 | H12 | 119.2° | 120.0° |
| O | C | C3 | O1 | 52.9° | 65.0° |
| O | C | C3 | C2 | 174.8° | 175.0° |
| O | C | C3 | H5 | 68.3° | 55.0° |
| O | C | H11 | H12 | 122.2° | 119.9° |
| C | C3 | O1 | C4 | 168.8° | 178.9° |
| C | C3 | O1 | C2 | 115.5° | 120.0° |
| C | C3 | O1 | H5 | 120.7° | 120.0° |
| C | C3 | C2 | H5 | 115.7° | 120.0° |
| C | C3 | C2 | C1 | 174.1° | 177.6° |
| C | C3 | C2 | H3 | 53.7° | 62.5° |
| C | C3 | C2 | H4 | 65.6° | 57.7° |
| C3 | C | H11 | H12 | 122.3° | 120.1° |
| C3 | C | O | H13 | 180.0° | 180.0° |
| O1 | C4 | C18 | H6 | 120.1° | 119.8° |
| O1 | C4 | C18 | H7 | 120.1° | 120.2° |
| C4 | O1 | C3 | C2 | 53.3° | 61.1° |
| O1 | C4 | C18 | C1 | 52.9° | 57.5° |
| O1 | C4 | C18 | N3 | 173.3° | 177.5° |
| C4 | O1 | C3 | H5 | 70.6° | 58.8° |
| O1 | C4 | H6 | H7 | 119.7° | 120.1° |
| O1 | C4 | C18 | H14 | 66.4° | 62.3° |
| C3 | O1 | C4 | C18 | 51.5° | 61.1° |
| O1 | C3 | C2 | H5 | 123.5° | 120.0° |
| O1 | C3 | C2 | C1 | 53.3° | 57.6° |
| O1 | C3 | C2 | H3 | 67.1° | 177.5° |
| O1 | C3 | C2 | H4 | 173.6° | 62.3° |
| C3 | O1 | C4 | H6 | 68.6° | 58.8° |
| C3 | O1 | C4 | H7 | 171.7° | 178.8° |
| O1 | C3 | C | H11 | 66.3° | 175.0° |
| O1 | C3 | C | H12 | 172.2° | 54.9° |
| N1 | C17 | N2 | H16 | 180.0° | 179.9° |
| N1 | C17 | N2 | C16 | 3.1° | 0.1° |
| C17 | N1 | C14 | N3 | 178.3° | 179.9° |
| C17 | N1 | C14 | C15 | 1.0° | 0.0° |
| N2 | C17 | N1 | C14 | 3.6° | 0.1° |
| C17 | N2 | C16 | C15 | 0.1° | 0.1° |
| C17 | N2 | C16 | N | 178.4° | 179.6° |
| N1 | C14 | N3 | C18 | 5.2° | 5.0° |
| N1 | C14 | N3 | C15 | 179.3° | 179.9° |
| N1 | C14 | C15 | C16 | 1.5° | 0.0° |
| N1 | C14 | C15 | C13 | 179.0° | 180.0° |
| N1 | C14 | N3 | H15 | 117.1° | 175.0° |
| C14 | N1 | C17 | H16 | 176.4° | 180.0° |
| C4 | C18 | C1 | C2 | 54.3° | 56.9° |
| C4 | C18 | C1 | N3 | 121.1° | 119.9° |
| C4 | C18 | C1 | H14 | 119.4° | 119.8° |
| C4 | C18 | N3 | H14 | 119.4° | 120.2° |
| C4 | C18 | N3 | C14 | 77.8° | 85.0° |
| C4 | C18 | C1 | H1 | 174.3° | 176.8° |
| C4 | C18 | C1 | H2 | 65.6° | 63.1° |
| C18 | C4 | H6 | H7 | 119.7° | 120.0° |
| C4 | C18 | N3 | H15 | 160.0° | 95.0° |
| C3 | C2 | C1 | H3 | 120.3° | 119.9° |
| C3 | C2 | C1 | H4 | 120.4° | 119.9° |
| C3 | C2 | C1 | C18 | 54.7° | 56.9° |
| C3 | C2 | C1 | H1 | 174.6° | 176.9° |
| C3 | C2 | C1 | H2 | 65.2° | 63.0° |
| C3 | C2 | H3 | H4 | 118.9° | 120.2° |
| C2 | C3 | C | H11 | 55.6° | 55.0° |
| C2 | C3 | C | H12 | 65.9° | 65.0° |
| N2 | C16 | C15 | C14 | 2.0° | 0.0° |
| N2 | C16 | C15 | N | 178.6° | 179.6° |
| N2 | C16 | C15 | C13 | 178.3° | 179.9° |
| N2 | C16 | N | C12 | 177.7° | 180.0° |
| C16 | N2 | C17 | H16 | 176.9° | 180.0° |
| N2 | C16 | N | H17 | 2.3° | 0.4° |
| C2 | C1 | C18 | H1 | 119.9° | 119.9° |
| C2 | C1 | C18 | H2 | 119.9° | 119.9° |
| C2 | C1 | C18 | N3 | 175.5° | 176.8° |
| C2 | C1 | H1 | H2 | 120.3° | 120.1° |
| C1 | C2 | H3 | H4 | 118.9° | 120.1° |
| C1 | C2 | C3 | H5 | 70.2° | 62.4° |
| C2 | C1 | C18 | H14 | 65.0° | 63.0° |
| C1 | C18 | N3 | H14 | 118.6° | 120.1° |
| C1 | C18 | N3 | C14 | 160.2° | 155.2° |
| C18 | C1 | H1 | H2 | 120.2° | 120.2° |
| C18 | C1 | C2 | H3 | 65.6° | 176.8° |
| C18 | C1 | C2 | H4 | 175.1° | 63.0° |
| C1 | C18 | C4 | H6 | 67.2° | 62.3° |
| C1 | C18 | C4 | H7 | 173.0° | 177.6° |
| C1 | C18 | N3 | H15 | 37.9° | 24.7° |
| C18 | N3 | C14 | H15 | 122.3° | 179.9° |
| C18 | N3 | C14 | C15 | 175.5° | 175.0° |
| N3 | C18 | C1 | H1 | 64.6° | 63.3° |
| N3 | C18 | C1 | H2 | 55.5° | 56.9° |
| N3 | C18 | C4 | H6 | 53.2° | 57.7° |
| N3 | C18 | C4 | H7 | 66.6° | 62.4° |
| N3 | C14 | C15 | C16 | 179.3° | 179.9° |
| N3 | C14 | C15 | C13 | 0.3° | 0.1° |
| C14 | N3 | C18 | H14 | 41.6° | 35.1° |
| C14 | C15 | C16 | C13 | 179.7° | 180.0° |
| C14 | C15 | C16 | N | 176.5° | 179.7° |
| C14 | C15 | C13 | C12 | 178.1° | 180.0° |
| C14 | C15 | C13 | C11 | 2.2° | 0.0° |
| C15 | C14 | N3 | H15 | 62.2° | 4.9° |
| C15 | C16 | N | C12 | 3.7° | 0.5° |
| C16 | C15 | C13 | C12 | 1.5° | 0.0° |
| C16 | C15 | C13 | C11 | 178.2° | 180.0° |
| C15 | C16 | N | H17 | 176.3° | 180.0° |
| N | C16 | C15 | C13 | 3.2° | 0.3° |
| C16 | N | C12 | H17 | 180.0° | 179.5° |
| C16 | N | C12 | C13 | 2.8° | 0.5° |
| C16 | N | C12 | H10 | 177.2° | 179.8° |
| C15 | C13 | C12 | N | 0.7° | 0.3° |
| C15 | C13 | C12 | C11 | 179.7° | 180.0° |
| C15 | C13 | C11 | O3 | 8.9° | 104.5° |
| C15 | C13 | C11 | C10 | 176.1° | 75.4° |
| C15 | C13 | C12 | H10 | 179.2° | 180.0° |
| N | C12 | C13 | H10 | 180.0° | 179.7° |
| N | C12 | C13 | C11 | 179.6° | 179.7° |
| C12 | C13 | C11 | O3 | 171.5° | 75.5° |
| C12 | C13 | C11 | C10 | 3.5° | 104.6° |
| C13 | C12 | N | H17 | 177.2° | 180.0° |
| C13 | C11 | O3 | C10 | 175.1° | 179.9° |
| C13 | C11 | C10 | C9 | 61.2° | 174.2° |
| C13 | C11 | C10 | C5 | 118.0° | 6.4° |
| C11 | C13 | C12 | H10 | 0.5° | 0.1° |
| O3 | C11 | C10 | C9 | 123.8° | 5.8° |
| O3 | C11 | C10 | C5 | 57.0° | 173.7° |
| C11 | C10 | C9 | CL | 3.2° | 0.9° |
| C11 | C10 | C9 | C5 | 179.2° | 179.4° |
| C11 | C10 | C9 | C8 | 179.3° | 180.0° |
| C11 | C10 | C5 | C6 | 178.1° | 179.4° |
| C11 | C10 | C5 | H8 | 1.9° | 0.3° |
| CL | C9 | C10 | C8 | 177.5° | 179.1° |
| CL | C9 | C10 | C5 | 177.6° | 179.7° |
| CL | C9 | C8 | C7 | 180.0° | 179.9° |
| CL | C9 | C8 | H18 | 0.0° | 0.8° |
| C9 | C10 | C5 | C6 | 1.1° | 0.0° |
| C10 | C9 | C8 | C7 | 2.4° | 0.8° |
| C9 | C10 | C5 | H8 | 178.8° | 179.7° |
| C10 | C9 | C8 | H18 | 177.6° | 180.0° |
| C5 | C10 | C9 | C8 | 0.0° | 0.5° |
| C10 | C5 | C6 | H8 | 180.0° | 179.7° |
| C10 | C5 | C6 | C7 | 0.0° | 0.3° |
| C10 | C5 | C6 | H9 | 180.0° | 179.7° |
| C9 | C8 | C7 | H18 | 180.0° | 179.2° |
| C9 | C8 | C7 | C6 | 3.6° | 0.5° |
| C9 | C8 | C7 | O2 | 178.6° | 179.4° |
| C5 | C6 | C7 | C8 | 2.4° | 0.0° |
| C5 | C6 | C7 | H9 | 180.0° | 180.0° |
| C5 | C6 | C7 | O2 | 179.9° | 179.9° |
| C8 | C7 | C6 | O2 | 177.8° | 179.9° |
| C8 | C7 | O2 | C19 | 130.8° | 108.2° |
| C8 | C7 | C6 | H9 | 177.7° | 180.0° |
| C6 | C7 | O2 | C19 | 51.4° | 71.7° |
| C7 | C6 | C5 | H8 | 180.0° | 180.0° |
| C6 | C7 | C8 | H18 | 176.4° | 179.8° |
| C7 | O2 | C19 | C20 | 32.5° | 175.3° |
| C7 | O2 | C19 | C24 | 147.9° | 5.0° |
| O2 | C7 | C6 | H9 | 0.1° | 0.0° |
| O2 | C7 | C8 | H18 | 1.3° | 0.2° |
| C21 | C20 | C19 | H23 | 180.0° | 179.5° |
| C20 | C21 | C22 | H22 | 180.0° | 179.7° |
| C21 | C20 | C19 | O2 | 178.5° | 179.7° |
| C21 | C20 | C19 | C24 | 1.1° | 0.5° |
| C20 | C21 | C22 | C23 | 0.4° | 0.4° |
| C20 | C21 | C22 | H21 | 179.6° | 179.7° |
| C19 | C20 | C21 | C22 | 0.9° | 0.6° |
| C20 | C19 | O2 | C24 | 179.6° | 179.7° |
| C20 | C19 | C24 | C23 | 0.1° | 0.3° |
| C20 | C19 | C24 | H19 | 179.9° | 179.8° |
| C19 | C20 | C21 | H22 | 179.1° | 179.8° |
| C21 | C22 | C23 | H21 | 180.0° | 179.9° |
| C21 | C22 | C23 | C24 | 1.5° | 0.1° |
| C21 | C22 | C23 | H20 | 178.5° | 179.9° |
| C22 | C21 | C20 | H23 | 179.1° | 179.9° |
| O2 | C19 | C24 | C23 | 179.7° | 180.0° |
| O2 | C19 | C24 | H19 | 0.3° | 0.1° |
| O2 | C19 | C20 | H23 | 1.5° | 0.3° |
| C19 | C24 | C23 | C22 | 1.3° | 0.1° |
| C19 | C24 | C23 | H19 | 180.0° | 179.9° |
| C19 | C24 | C23 | H20 | 178.6° | 180.0° |
| C24 | C19 | C20 | H23 | 178.9° | 180.0° |
| C22 | C23 | C24 | H20 | 180.0° | 180.0° |
| C22 | C23 | C24 | H19 | 178.6° | 180.0° |
| C23 | C22 | C21 | H22 | 179.6° | 180.0° |
| C24 | C23 | C22 | H21 | 178.5° | 180.0° |
| H1 | C1 | C2 | H3 | 54.3° | 63.2° |
| H1 | C1 | C2 | H4 | 65.0° | 56.9° |
| H1 | C1 | C18 | H14 | 54.9° | 57.0° |
| H2 | C1 | C2 | H3 | 174.5° | 56.9° |
| H2 | C1 | C2 | H4 | 55.2° | 177.0° |
| H2 | C1 | C18 | H14 | 175.0° | 177.1° |
| H3 | C2 | C3 | H5 | 169.4° | 57.6° |
| H4 | C2 | C3 | H5 | 50.1° | 177.7° |
| H5 | C3 | C | H11 | 172.5° | 65.0° |
| H5 | C3 | C | H12 | 50.9° | 175.0° |
| H6 | C4 | C18 | H14 | 173.5° | 177.9° |
| H7 | C4 | C18 | H14 | 53.7° | 57.9° |
| H8 | C5 | C6 | H9 | 0.0° | 0.0° |
| H10 | C12 | N | H17 | 2.8° | 0.3° |
| H11 | C | O | H13 | 60.8° | 59.9° |
| H12 | C | O | H13 | 60.7° | 60.0° |
| H14 | C18 | N3 | H15 | 80.6° | 144.8° |
| H19 | C24 | C23 | H20 | 1.4° | 0.1° |
| H20 | C23 | C22 | H21 | 1.5° | 0.0° |
| H21 | C22 | C21 | H22 | 0.4° | 0.1° |
| H22 | C21 | C20 | H23 | 1.0° | 0.3° |
