A1D85
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C21 | sing | 1.36Å | 1.46Å | |
| C20 | C21 | doub | 1.39Å | 1.41Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.41Å | Aromatic |
| C21 | C22 | sing | 1.39Å | 1.38Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.51Å | 1.53Å | |
| C22 | C17 | doub | 1.39Å | 1.41Å | Aromatic |
| C14 | C13 | sing | 1.51Å | 1.53Å | |
| C14 | N3 | sing | 1.48Å | 1.44Å | |
| C13 | C12 | sing | 1.54Å | 1.54Å | |
| C18 | C17 | sing | 1.39Å | 1.41Å | Aromatic |
| C18 | C24 | sing | 1.51Å | 1.55Å | |
| C17 | C6 | sing | 1.48Å | 1.52Å | |
| N3 | C15 | sing | 1.40Å | 1.44Å | |
| C12 | N2 | sing | 1.48Å | 1.44Å | |
| C15 | C16 | sing | 1.54Å | 1.53Å | |
| C6 | C5 | doub | 1.39Å | 1.41Å | Aromatic |
| C6 | C1 | sing | 1.40Å | 1.39Å | Aromatic |
| N4 | C1 | sing | 1.39Å | 1.43Å | |
| C5 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| N2 | C16 | sing | 1.45Å | 1.46Å | |
| N2 | C10 | sing | 1.39Å | 1.43Å | |
| C1 | C2 | doub | 1.40Å | 1.40Å | Aromatic |
| C11 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C11 | C7 | sing | 1.39Å | 1.44Å | Aromatic |
| C10 | N1 | sing | 1.33Å | 1.32Å | Aromatic |
| C4 | C7 | sing | 1.48Å | 1.53Å | |
| C4 | C3 | doub | 1.39Å | 1.41Å | Aromatic |
| C2 | C3 | sing | 1.40Å | 1.40Å | Aromatic |
| C2 | C25 | sing | 1.47Å | 1.55Å | |
| C7 | C8 | doub | 1.40Å | 1.41Å | Aromatic |
| N1 | C9 | doub | 1.32Å | 1.37Å | Aromatic |
| O2 | C25 | doub | 1.22Å | 1.22Å | |
| C25 | N5 | sing | 1.35Å | 1.40Å | |
| C8 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| N3 | H1 | sing | 1.01Å | 1.00Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| C8 | H4 | sing | 1.08Å | 1.08Å | |
| C13 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C15 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.08Å | 1.08Å | |
| C24 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C3 | H13 | sing | 1.08Å | 1.08Å | |
| C9 | H14 | sing | 1.08Å | 1.08Å | |
| C11 | H15 | sing | 1.08Å | 1.08Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C16 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.08Å | 1.08Å | |
| O1 | H23 | sing | 0.97Å | 0.95Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| N4 | H27 | sing | 0.97Å | 1.00Å | |
| N4 | H28 | sing | 0.97Å | 1.00Å | |
| N5 | H29 | sing | 0.97Å | 1.00Å | |
| N5 | H30 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C21 | C20 | 120.5° | 120.0° |
| O1 | C21 | C22 | 119.5° | 120.0° |
| C21 | O1 | H23 | 109.5° | 114.0° |
| C21 | C20 | C19 | 120.4° | 120.2° |
| C20 | C21 | C22 | 120.0° | 120.0° |
| C21 | C20 | H9 | 119.8° | 119.9° |
| C20 | C19 | C18 | 120.3° | 120.1° |
| C19 | C20 | H9 | 119.8° | 119.9° |
| C20 | C19 | H22 | 119.8° | 119.9° |
| C21 | C22 | C23 | 119.0° | 120.1° |
| C21 | C22 | C17 | 119.2° | 119.8° |
| C19 | C18 | C17 | 118.5° | 120.0° |
| C19 | C18 | C24 | 120.6° | 120.0° |
| C18 | C19 | H22 | 119.8° | 120.0° |
| C23 | C22 | C17 | 121.8° | 120.1° |
| C22 | C23 | H24 | 109.5° | 109.5° |
| C22 | C23 | H25 | 109.4° | 109.4° |
| C22 | C23 | H26 | 109.5° | 109.4° |
| C22 | C17 | C18 | 121.5° | 119.8° |
| C22 | C17 | C6 | 117.9° | 120.1° |
| C13 | C14 | N3 | 113.9° | 108.5° |
| C14 | C13 | C12 | 111.3° | 112.2° |
| C14 | C13 | H5 | 109.0° | 108.9° |
| C14 | C13 | H6 | 109.0° | 108.9° |
| C13 | C14 | H18 | 108.4° | 109.6° |
| C13 | C14 | H19 | 108.3° | 109.6° |
| C14 | N3 | C15 | 112.9° | 114.1° |
| C14 | N3 | H1 | 108.6° | 111.0° |
| N3 | C14 | H18 | 108.4° | 109.6° |
| N3 | C14 | H19 | 108.4° | 109.6° |
| C13 | C12 | N2 | 112.6° | 112.4° |
| C12 | C13 | H5 | 109.0° | 109.0° |
| C12 | C13 | H6 | 109.0° | 108.9° |
| C13 | C12 | H16 | 108.7° | 108.9° |
| C13 | C12 | H17 | 108.7° | 108.9° |
| C17 | C18 | C24 | 120.9° | 120.0° |
| C18 | C17 | C6 | 120.4° | 120.1° |
| C18 | C24 | H10 | 109.5° | 109.5° |
| C18 | C24 | H11 | 109.5° | 109.5° |
| C18 | C24 | H12 | 109.4° | 109.5° |
| C17 | C6 | C5 | 113.9° | 120.1° |
| C17 | C6 | C1 | 125.5° | 120.0° |
| N3 | C15 | C16 | 110.7° | 112.1° |
| C15 | N3 | H1 | 108.6° | 111.0° |
| N3 | C15 | H7 | 109.2° | 109.0° |
| N3 | C15 | H8 | 109.2° | 109.0° |
| C12 | N2 | C16 | 127.2° | 113.9° |
| C12 | N2 | C10 | 118.5° | 111.0° |
| N2 | C12 | H16 | 108.7° | 108.9° |
| N2 | C12 | H17 | 108.7° | 108.9° |
| C15 | C16 | N2 | 111.3° | 108.8° |
| C16 | C15 | H7 | 109.2° | 108.9° |
| C16 | C15 | H8 | 109.2° | 109.0° |
| C15 | C16 | H20 | 109.0° | 109.6° |
| C15 | C16 | H21 | 109.0° | 109.6° |
| C5 | C6 | C1 | 120.6° | 119.9° |
| C6 | C5 | C4 | 120.0° | 120.2° |
| C6 | C5 | H3 | 120.0° | 119.9° |
| C6 | C1 | N4 | 120.6° | 120.1° |
| C6 | C1 | C2 | 118.6° | 119.8° |
| N4 | C1 | C2 | 120.8° | 120.1° |
| C1 | N4 | H27 | 109.5° | 120.0° |
| C1 | N4 | H28 | 109.4° | 120.0° |
| C5 | C4 | C7 | 119.5° | 119.9° |
| C5 | C4 | C3 | 120.5° | 120.3° |
| C4 | C5 | H3 | 120.0° | 119.9° |
| C16 | N2 | C10 | 114.3° | 111.0° |
| N2 | C16 | H20 | 109.0° | 109.6° |
| N2 | C16 | H21 | 109.0° | 109.6° |
| N2 | C10 | C11 | 121.3° | 119.7° |
| N2 | C10 | N1 | 117.7° | 119.7° |
| C1 | C2 | C3 | 121.6° | 119.8° |
| C1 | C2 | C25 | 120.7° | 120.1° |
| C10 | C11 | C7 | 118.0° | 119.0° |
| C11 | C10 | N1 | 120.9° | 120.7° |
| C10 | C11 | H15 | 121.0° | 120.5° |
| C11 | C7 | C4 | 117.7° | 120.9° |
| C11 | C7 | C8 | 119.4° | 118.3° |
| C7 | C11 | H15 | 121.0° | 120.5° |
| C10 | N1 | C9 | 122.5° | 121.9° |
| C7 | C4 | C3 | 120.0° | 119.9° |
| C4 | C7 | C8 | 122.7° | 120.8° |
| C4 | C3 | C2 | 118.7° | 120.0° |
| C4 | C3 | H13 | 120.6° | 120.0° |
| C3 | C2 | C25 | 117.7° | 120.1° |
| C2 | C3 | H13 | 120.7° | 120.0° |
| C2 | C25 | O2 | 120.8° | 120.0° |
| C2 | C25 | N5 | 117.5° | 120.0° |
| C7 | C8 | C9 | 118.0° | 119.2° |
| C7 | C8 | H4 | 121.0° | 120.4° |
| N1 | C9 | C8 | 121.0° | 121.0° |
| N1 | C9 | H14 | 119.5° | 119.5° |
| O2 | C25 | N5 | 121.7° | 120.0° |
| C25 | N5 | H29 | 120.0° | 120.0° |
| C25 | N5 | H30 | 120.0° | 120.0° |
| C9 | C8 | H4 | 121.0° | 120.4° |
| C8 | C9 | H14 | 119.5° | 119.5° |
| H5 | C13 | H6 | 109.4° | 108.9° |
| H7 | C15 | H8 | 109.5° | 108.8° |
| H10 | C24 | H11 | 109.5° | 109.5° |
| H10 | C24 | H12 | 109.5° | 109.4° |
| H11 | C24 | H12 | 109.5° | 109.5° |
| H16 | C12 | H17 | 109.5° | 108.8° |
| H18 | C14 | H19 | 109.5° | 109.9° |
| H20 | C16 | H21 | 109.5° | 109.7° |
| H24 | C23 | H25 | 109.5° | 109.5° |
| H24 | C23 | H26 | 109.4° | 109.5° |
| H25 | C23 | H26 | 109.5° | 109.5° |
| H27 | N4 | H28 | 109.5° | 120.0° |
| H29 | N5 | H30 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C21 | C20 | C22 | 179.7° | 179.8° |
| O1 | C21 | C20 | C19 | 179.4° | 180.0° |
| O1 | C21 | C22 | C23 | 0.1° | 0.2° |
| O1 | C21 | C22 | C17 | 179.7° | 179.8° |
| O1 | C21 | C20 | H9 | 0.6° | 0.2° |
| C21 | C20 | C19 | H9 | 180.0° | 179.7° |
| C21 | C20 | C19 | C18 | 1.2° | 0.3° |
| C20 | C21 | C22 | C23 | 179.6° | 180.0° |
| C20 | C21 | C22 | C17 | 0.0° | 0.0° |
| C21 | C20 | C19 | H22 | 178.8° | 180.0° |
| C20 | C21 | O1 | H23 | 180.0° | 90.0° |
| C19 | C20 | C21 | C22 | 0.9° | 0.3° |
| C20 | C19 | C18 | H22 | 180.0° | 179.7° |
| C20 | C19 | C18 | C17 | 0.6° | 0.0° |
| C20 | C19 | C18 | C24 | 178.9° | 180.0° |
| C21 | C22 | C23 | C17 | 179.6° | 180.0° |
| C21 | C22 | C17 | C18 | 0.6° | 0.2° |
| C21 | C22 | C17 | C6 | 177.1° | 180.0° |
| C22 | C21 | C20 | H9 | 179.1° | 180.0° |
| C22 | C21 | O1 | H23 | 0.4° | 89.8° |
| C21 | C22 | C23 | H24 | 90.2° | 90.0° |
| C21 | C22 | C23 | H25 | 149.8° | 150.0° |
| C21 | C22 | C23 | H26 | 29.8° | 30.0° |
| C19 | C18 | C17 | C22 | 0.3° | 0.2° |
| C19 | C18 | C17 | C24 | 179.6° | 180.0° |
| C19 | C18 | C17 | C6 | 176.7° | 180.0° |
| C18 | C19 | C20 | H9 | 178.8° | 180.0° |
| C19 | C18 | C24 | H10 | 89.8° | 90.0° |
| C19 | C18 | C24 | H11 | 150.2° | 30.0° |
| C19 | C18 | C24 | H12 | 30.2° | 150.0° |
| C23 | C22 | C17 | C18 | 179.8° | 179.8° |
| C23 | C22 | C17 | C6 | 3.3° | 0.0° |
| C22 | C23 | H24 | H25 | 120.0° | 120.0° |
| C22 | C23 | H24 | H26 | 120.0° | 119.9° |
| C22 | C23 | H25 | H26 | 120.0° | 119.9° |
| C22 | C17 | C18 | C6 | 176.5° | 179.8° |
| C22 | C17 | C18 | C24 | 179.8° | 179.8° |
| C22 | C17 | C6 | C5 | 76.6° | 90.0° |
| C22 | C17 | C6 | C1 | 103.5° | 90.1° |
| C17 | C22 | C23 | H24 | 90.2° | 90.0° |
| C17 | C22 | C23 | H25 | 29.8° | 30.0° |
| C17 | C22 | C23 | H26 | 149.8° | 150.0° |
| C13 | C14 | N3 | H18 | 120.7° | 119.6° |
| C13 | C14 | N3 | H19 | 120.7° | 119.7° |
| C14 | C13 | C12 | H5 | 120.3° | 120.7° |
| C14 | C13 | C12 | H6 | 120.3° | 120.6° |
| C13 | C14 | N3 | C15 | 78.4° | 79.9° |
| C14 | C13 | C12 | N2 | 71.7° | 41.5° |
| C13 | C14 | N3 | H1 | 42.1° | 46.3° |
| C14 | C13 | H5 | H6 | 119.1° | 118.7° |
| C14 | C13 | C12 | H16 | 48.8° | 79.3° |
| C14 | C13 | C12 | H17 | 167.9° | 162.2° |
| C13 | C14 | H18 | H19 | 118.0° | 120.5° |
| N3 | C14 | C13 | C12 | 61.0° | 92.6° |
| C14 | N3 | C15 | H1 | 120.5° | 126.3° |
| C14 | N3 | C15 | C16 | 96.0° | 61.8° |
| N3 | C14 | C13 | H5 | 178.7° | 28.1° |
| N3 | C14 | C13 | H6 | 59.3° | 146.8° |
| C14 | N3 | C15 | H7 | 143.8° | 177.5° |
| C14 | N3 | C15 | H8 | 24.1° | 58.9° |
| N3 | C14 | H18 | H19 | 118.0° | 120.5° |
| C13 | C12 | N2 | H16 | 120.5° | 120.8° |
| C13 | C12 | N2 | H17 | 120.5° | 120.7° |
| C13 | C12 | N2 | C16 | 74.6° | 41.7° |
| C13 | C12 | N2 | C10 | 102.5° | 167.8° |
| C12 | C13 | H5 | H6 | 119.1° | 118.7° |
| C13 | C12 | H16 | H17 | 118.6° | 118.6° |
| C12 | C13 | C14 | H18 | 178.4° | 27.1° |
| C12 | C13 | C14 | H19 | 59.7° | 147.7° |
| C18 | C17 | C6 | C5 | 100.0° | 90.2° |
| C18 | C17 | C6 | C1 | 79.9° | 89.7° |
| C17 | C18 | C24 | H10 | 89.8° | 90.0° |
| C17 | C18 | C24 | H11 | 30.2° | 150.0° |
| C17 | C18 | C24 | H12 | 150.2° | 29.9° |
| C17 | C18 | C19 | H22 | 179.4° | 179.7° |
| C24 | C18 | C17 | C6 | 3.7° | 0.0° |
| C18 | C24 | H10 | H11 | 120.0° | 120.0° |
| C18 | C24 | H10 | H12 | 120.0° | 120.0° |
| C18 | C24 | H11 | H12 | 120.0° | 120.0° |
| C24 | C18 | C19 | H22 | 1.1° | 0.3° |
| C17 | C6 | C5 | C1 | 179.9° | 180.0° |
| C17 | C6 | C1 | N4 | 0.7° | 0.0° |
| C17 | C6 | C5 | C4 | 179.7° | 180.0° |
| C17 | C6 | C1 | C2 | 179.7° | 180.0° |
| C17 | C6 | C5 | H3 | 0.3° | 0.0° |
| N3 | C15 | C16 | H7 | 120.2° | 120.7° |
| N3 | C15 | C16 | H8 | 120.2° | 120.7° |
| N3 | C15 | C16 | N2 | 57.6° | 78.8° |
| N3 | C15 | H7 | H8 | 119.5° | 118.7° |
| C15 | N3 | C14 | H18 | 161.0° | 39.8° |
| C15 | N3 | C14 | H19 | 42.3° | 160.4° |
| N3 | C15 | C16 | H20 | 62.7° | 41.0° |
| N3 | C15 | C16 | H21 | 177.9° | 161.4° |
| C12 | N2 | C16 | C15 | 17.3° | 94.2° |
| C12 | N2 | C16 | C10 | 177.2° | 126.1° |
| C12 | N2 | C10 | C11 | 20.7° | 176.3° |
| C12 | N2 | C10 | N1 | 160.9° | 3.8° |
| N2 | C12 | C13 | H5 | 168.0° | 79.2° |
| N2 | C12 | C13 | H6 | 48.6° | 162.1° |
| N2 | C12 | H16 | H17 | 118.6° | 118.5° |
| C12 | N2 | C16 | H20 | 137.5° | 25.6° |
| C12 | N2 | C16 | H21 | 103.0° | 145.9° |
| C15 | C16 | N2 | H20 | 120.3° | 119.8° |
| C15 | C16 | N2 | H21 | 120.3° | 119.8° |
| C15 | C16 | N2 | C10 | 159.9° | 139.6° |
| C16 | C15 | N3 | H1 | 24.4° | 64.4° |
| C16 | C15 | H7 | H8 | 119.4° | 118.7° |
| C15 | C16 | H20 | H21 | 119.2° | 120.3° |
| C5 | C6 | C1 | N4 | 179.5° | 179.9° |
| C6 | C5 | C4 | H3 | 180.0° | 180.0° |
| C5 | C6 | C1 | C2 | 0.4° | 0.1° |
| C6 | C5 | C4 | C7 | 177.7° | 180.0° |
| C6 | C5 | C4 | C3 | 0.9° | 0.2° |
| C6 | C1 | N4 | C2 | 179.1° | 180.0° |
| C1 | C6 | C5 | C4 | 0.2° | 0.0° |
| C6 | C1 | C2 | C3 | 0.3° | 0.3° |
| C6 | C1 | C2 | C25 | 179.9° | 179.9° |
| C1 | C6 | C5 | H3 | 179.8° | 180.0° |
| C6 | C1 | N4 | H27 | 180.0° | 5.5° |
| C6 | C1 | N4 | H28 | 60.0° | 174.4° |
| N4 | C1 | C2 | C3 | 179.4° | 179.7° |
| N4 | C1 | C2 | C25 | 0.8° | 0.0° |
| C1 | N4 | H27 | H28 | 120.0° | 179.9° |
| C5 | C4 | C7 | C11 | 24.0° | 179.7° |
| C5 | C4 | C7 | C3 | 176.8° | 179.8° |
| C5 | C4 | C3 | C2 | 1.0° | 0.5° |
| C5 | C4 | C7 | C8 | 160.3° | 0.2° |
| C5 | C4 | C3 | H13 | 179.0° | 179.7° |
| C16 | N2 | C10 | C11 | 156.8° | 56.0° |
| C16 | N2 | C10 | N1 | 21.6° | 123.9° |
| N2 | C16 | C15 | H7 | 177.8° | 160.5° |
| N2 | C16 | C15 | H8 | 62.6° | 41.9° |
| C16 | N2 | C12 | H16 | 45.8° | 162.5° |
| C16 | N2 | C12 | H17 | 164.9° | 79.0° |
| N2 | C16 | H20 | H21 | 119.2° | 120.3° |
| N2 | C10 | C11 | N1 | 178.3° | 179.9° |
| N2 | C10 | C11 | C7 | 179.8° | 180.0° |
| N2 | C10 | N1 | C9 | 178.5° | 180.0° |
| N2 | C10 | C11 | H15 | 0.2° | 0.1° |
| C10 | N2 | C12 | H16 | 137.1° | 71.4° |
| C10 | N2 | C12 | H17 | 18.0° | 47.1° |
| C10 | N2 | C16 | H20 | 39.7° | 100.6° |
| C10 | N2 | C16 | H21 | 79.8° | 19.8° |
| C1 | C2 | C3 | C4 | 0.4° | 0.5° |
| C1 | C2 | C3 | C25 | 179.8° | 179.7° |
| C1 | C2 | C25 | O2 | 13.8° | 6.2° |
| C1 | C2 | C25 | N5 | 166.0° | 173.7° |
| C1 | C2 | C3 | H13 | 179.7° | 179.7° |
| C2 | C1 | N4 | H27 | 1.0° | 174.5° |
| C2 | C1 | N4 | H28 | 121.0° | 5.6° |
| C10 | C11 | C7 | H15 | 180.0° | 180.0° |
| C10 | C11 | C7 | C4 | 178.4° | 179.9° |
| C10 | C11 | C7 | C8 | 2.5° | 0.0° |
| C11 | C10 | N1 | C9 | 0.2° | 0.0° |
| C7 | C11 | C10 | N1 | 1.5° | 0.0° |
| C11 | C7 | C4 | C8 | 175.7° | 179.9° |
| C11 | C7 | C4 | C3 | 152.8° | 0.1° |
| C11 | C7 | C8 | C9 | 2.3° | 0.0° |
| C11 | C7 | C8 | H4 | 177.8° | 180.0° |
| C10 | N1 | C9 | C8 | 0.1° | 0.0° |
| C10 | N1 | C9 | H14 | 179.9° | 180.0° |
| N1 | C10 | C11 | H15 | 178.6° | 180.0° |
| C7 | C4 | C3 | C2 | 177.7° | 179.7° |
| C4 | C7 | C8 | C9 | 177.9° | 180.0° |
| C7 | C4 | C5 | H3 | 2.4° | 0.0° |
| C4 | C7 | C8 | H4 | 2.1° | 0.1° |
| C7 | C4 | C3 | H13 | 2.3° | 0.0° |
| C4 | C7 | C11 | H15 | 1.6° | 0.0° |
| C4 | C3 | C2 | H13 | 180.0° | 179.8° |
| C4 | C3 | C2 | C25 | 179.4° | 179.7° |
| C3 | C4 | C7 | C8 | 22.9° | 180.0° |
| C3 | C4 | C5 | H3 | 179.1° | 179.8° |
| C3 | C2 | C25 | O2 | 166.0° | 174.1° |
| C3 | C2 | C25 | N5 | 14.2° | 6.0° |
| C2 | C25 | O2 | N5 | 179.8° | 179.9° |
| C25 | C2 | C3 | H13 | 0.6° | 0.0° |
| C2 | C25 | N5 | H29 | 179.8° | 0.0° |
| C2 | C25 | N5 | H30 | 0.3° | 180.0° |
| C7 | C8 | C9 | N1 | 1.0° | 0.1° |
| C7 | C8 | C9 | H4 | 180.0° | 180.0° |
| C7 | C8 | C9 | H14 | 179.0° | 180.0° |
| C8 | C7 | C11 | H15 | 177.5° | 180.0° |
| N1 | C9 | C8 | H14 | 180.0° | 179.9° |
| N1 | C9 | C8 | H4 | 179.1° | 180.0° |
| O2 | C25 | N5 | H29 | 0.0° | 179.9° |
| O2 | C25 | N5 | H30 | 180.0° | 0.0° |
| C25 | N5 | H29 | H30 | 180.0° | 179.9° |
| H1 | N3 | C15 | H7 | 95.7° | 56.2° |
| H1 | N3 | C15 | H8 | 144.6° | 174.9° |
| H1 | N3 | C14 | H18 | 78.5° | 166.0° |
| H1 | N3 | C14 | H19 | 162.8° | 73.4° |
| H4 | C8 | C9 | H14 | 0.9° | 0.0° |
| H5 | C13 | C12 | H16 | 71.5° | 160.0° |
| H5 | C13 | C12 | H17 | 47.6° | 41.5° |
| H5 | C13 | C14 | H18 | 58.1° | 147.8° |
| H5 | C13 | C14 | H19 | 60.6° | 91.6° |
| H6 | C13 | C12 | H16 | 169.1° | 41.3° |
| H6 | C13 | C12 | H17 | 71.8° | 77.2° |
| H6 | C13 | C14 | H18 | 61.3° | 93.6° |
| H6 | C13 | C14 | H19 | 180.0° | 27.1° |
| H7 | C15 | C16 | H20 | 57.5° | 79.7° |
| H7 | C15 | C16 | H21 | 61.9° | 40.7° |
| H8 | C15 | C16 | H20 | 177.1° | 161.7° |
| H8 | C15 | C16 | H21 | 57.7° | 77.9° |
| H9 | C20 | C19 | H22 | 1.2° | 0.3° |
| H10 | C24 | H11 | H12 | 120.0° | 120.0° |
| H24 | C23 | H25 | H26 | 120.0° | 120.1° |
