A1D5X
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O1 | C1 | doub | 1.22Å | 1.23Å | |
| C1 | N1 | sing | 1.35Å | 1.34Å | |
| C1 | C9 | sing | 1.47Å | 1.50Å | |
| N1 | C2 | sing | 1.47Å | 1.46Å | |
| C2 | C3 | sing | 1.51Å | 1.51Å | |
| C3 | C4 | doub | 1.38Å | 1.39Å | Aromatic |
| C3 | C8 | sing | 1.39Å | 1.38Å | Aromatic |
| C4 | N2 | sing | 1.32Å | 1.34Å | Aromatic |
| N2 | C5 | doub | 1.33Å | 1.34Å | Aromatic |
| C5 | C6 | sing | 1.43Å | 1.45Å | |
| C5 | C7 | sing | 1.39Å | 1.38Å | Aromatic |
| C6 | N3 | trip | 1.14Å | 1.14Å | |
| C7 | C8 | doub | 1.38Å | 1.38Å | Aromatic |
| C9 | C10 | doub | 1.39Å | 1.40Å | Aromatic |
| C9 | N7 | sing | 1.34Å | 1.35Å | Aromatic |
| C10 | O2 | sing | 1.35Å | 1.35Å | |
| C10 | C11 | sing | 1.41Å | 1.43Å | Aromatic |
| C11 | C12 | doub | 1.41Å | 1.41Å | Aromatic |
| C11 | C24 | sing | 1.42Å | 1.41Å | Aromatic |
| C12 | C13 | sing | 1.36Å | 1.36Å | Aromatic |
| C13 | C14 | doub | 1.40Å | 1.42Å | Aromatic |
| C14 | N4 | sing | 1.39Å | 1.36Å | |
| C14 | N6 | sing | 1.32Å | 1.35Å | Aromatic |
| N4 | C15 | sing | 1.47Å | 1.46Å | |
| N4 | C23 | sing | 1.47Å | 1.46Å | |
| C15 | C16 | sing | 1.53Å | 1.52Å | |
| C16 | N5 | sing | 1.47Å | 1.46Å | |
| N5 | C17 | sing | 1.35Å | 1.35Å | |
| N5 | C22 | sing | 1.47Å | 1.46Å | |
| C17 | O3 | sing | 1.35Å | 1.35Å | |
| C17 | O4 | doub | 1.21Å | 1.21Å | |
| O3 | C18 | sing | 1.45Å | 1.48Å | |
| C18 | C19 | sing | 1.53Å | 1.51Å | |
| C18 | C20 | sing | 1.53Å | 1.51Å | |
| C18 | C21 | sing | 1.53Å | 1.51Å | |
| C22 | C23 | sing | 1.53Å | 1.51Å | |
| N6 | C24 | doub | 1.33Å | 1.37Å | Aromatic |
| C24 | C25 | sing | 1.41Å | 1.42Å | Aromatic |
| C25 | N7 | doub | 1.31Å | 1.32Å | Aromatic |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C4 | H4 | sing | 1.08Å | 1.08Å | |
| C7 | H5 | sing | 1.08Å | 1.08Å | |
| C8 | H6 | sing | 1.08Å | 1.08Å | |
| N1 | H1 | sing | 0.97Å | 1.00Å | |
| C12 | H8 | sing | 1.08Å | 1.08Å | |
| C13 | H9 | sing | 1.08Å | 1.08Å | |
| C15 | H11 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C16 | H13 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C20 | H17 | sing | 1.09Å | 1.10Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| O2 | H7 | sing | 0.97Å | 0.95Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H27 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O1 | C1 | N1 | 126.2° | 120.0° |
| O1 | C1 | C9 | 118.5° | 120.0° |
| N1 | C1 | C9 | 115.4° | 120.0° |
| C1 | N1 | C2 | 124.2° | 120.0° |
| C1 | N1 | H1 | 117.9° | 120.1° |
| C1 | C9 | C10 | 121.4° | 119.5° |
| C1 | C9 | N7 | 115.0° | 119.4° |
| N1 | C2 | C3 | 114.2° | 109.5° |
| N1 | C2 | H2 | 108.3° | 109.5° |
| N1 | C2 | H3 | 108.3° | 109.5° |
| C2 | N1 | H1 | 117.9° | 119.9° |
| C2 | C3 | C4 | 120.6° | 120.3° |
| C2 | C3 | C8 | 122.2° | 120.3° |
| C3 | C2 | H2 | 108.3° | 109.5° |
| C3 | C2 | H3 | 108.3° | 109.5° |
| C4 | C3 | C8 | 117.2° | 119.4° |
| C3 | C4 | N2 | 123.7° | 120.9° |
| C3 | C4 | H4 | 118.1° | 119.6° |
| C3 | C8 | C7 | 120.6° | 118.5° |
| C3 | C8 | H6 | 119.7° | 120.7° |
| C4 | N2 | C5 | 117.3° | 121.6° |
| N2 | C4 | H4 | 118.1° | 119.5° |
| N2 | C5 | C6 | 115.8° | 119.7° |
| N2 | C5 | C7 | 123.6° | 120.5° |
| C6 | C5 | C7 | 120.6° | 119.8° |
| C5 | C6 | N3 | 177.8° | 179.9° |
| C5 | C7 | C8 | 117.6° | 119.1° |
| C5 | C7 | H5 | 121.2° | 120.5° |
| C8 | C7 | H5 | 121.2° | 120.5° |
| C7 | C8 | H6 | 119.7° | 120.8° |
| C10 | C9 | N7 | 123.7° | 121.1° |
| C9 | C10 | O2 | 122.6° | 120.8° |
| C9 | C10 | C11 | 118.9° | 118.4° |
| C9 | N7 | C25 | 117.7° | 122.8° |
| O2 | C10 | C11 | 118.5° | 120.8° |
| C10 | O2 | H7 | 109.5° | 113.9° |
| C10 | C11 | C12 | 124.4° | 122.1° |
| C10 | C11 | C24 | 116.8° | 118.5° |
| C12 | C11 | C24 | 118.9° | 119.4° |
| C11 | C12 | C13 | 120.1° | 118.2° |
| C11 | C12 | H8 | 120.0° | 120.9° |
| C11 | C24 | N6 | 121.0° | 119.9° |
| C11 | C24 | C25 | 118.6° | 118.7° |
| C12 | C13 | C14 | 118.9° | 119.8° |
| C13 | C12 | H8 | 119.9° | 120.9° |
| C12 | C13 | H9 | 120.5° | 120.1° |
| C13 | C14 | N4 | 122.3° | 119.2° |
| C13 | C14 | N6 | 122.0° | 121.6° |
| C14 | C13 | H9 | 120.6° | 120.1° |
| N4 | C14 | N6 | 115.8° | 119.2° |
| C14 | N4 | C15 | 126.1° | 111.0° |
| C14 | N4 | C23 | 122.4° | 111.0° |
| C14 | N6 | C24 | 119.2° | 121.1° |
| C15 | N4 | C23 | 111.5° | 111.3° |
| N4 | C15 | C16 | 110.2° | 109.3° |
| N4 | C15 | H11 | 109.3° | 109.5° |
| N4 | C15 | H10 | 109.3° | 109.5° |
| N4 | C23 | C22 | 109.9° | 109.4° |
| N4 | C23 | H26 | 109.4° | 109.5° |
| N4 | C23 | H25 | 109.4° | 109.5° |
| C15 | C16 | N5 | 110.3° | 108.5° |
| C16 | C15 | H11 | 109.3° | 109.5° |
| C16 | C15 | H10 | 109.3° | 109.5° |
| C15 | C16 | H12 | 109.3° | 109.6° |
| C15 | C16 | H13 | 109.3° | 109.6° |
| C16 | N5 | C17 | 123.2° | 120.8° |
| C16 | N5 | C22 | 113.3° | 118.2° |
| N5 | C16 | H12 | 109.2° | 109.6° |
| N5 | C16 | H13 | 109.2° | 109.7° |
| C17 | N5 | C22 | 123.4° | 120.9° |
| N5 | C17 | O3 | 110.9° | 120.0° |
| N5 | C17 | O4 | 123.8° | 120.0° |
| N5 | C22 | C23 | 110.1° | 108.5° |
| N5 | C22 | H24 | 109.3° | 109.7° |
| N5 | C22 | H23 | 109.3° | 109.7° |
| O3 | C17 | O4 | 125.3° | 120.0° |
| C17 | O3 | C18 | 122.6° | 117.0° |
| O3 | C18 | C19 | 109.9° | 109.4° |
| O3 | C18 | C20 | 105.3° | 109.5° |
| O3 | C18 | C21 | 107.5° | 109.5° |
| C19 | C18 | C20 | 110.7° | 109.4° |
| C19 | C18 | C21 | 112.0° | 109.5° |
| C18 | C19 | H15 | 109.5° | 109.5° |
| C18 | C19 | H14 | 109.5° | 109.5° |
| C18 | C19 | H16 | 109.5° | 109.5° |
| C20 | C18 | C21 | 111.1° | 109.5° |
| C18 | C20 | H19 | 109.5° | 109.5° |
| C18 | C20 | H17 | 109.5° | 109.5° |
| C18 | C20 | H18 | 109.5° | 109.5° |
| C18 | C21 | H22 | 109.5° | 109.5° |
| C18 | C21 | H21 | 109.5° | 109.4° |
| C18 | C21 | H20 | 109.4° | 109.5° |
| C23 | C22 | H24 | 109.3° | 109.6° |
| C23 | C22 | H23 | 109.3° | 109.6° |
| C22 | C23 | H26 | 109.3° | 109.5° |
| C22 | C23 | H25 | 109.3° | 109.5° |
| N6 | C24 | C25 | 120.4° | 121.5° |
| C24 | C25 | N7 | 124.3° | 120.5° |
| C24 | C25 | H27 | 117.8° | 119.8° |
| N7 | C25 | H27 | 117.8° | 119.7° |
| H2 | C2 | H3 | 109.5° | 109.4° |
| H11 | C15 | H10 | 109.5° | 109.5° |
| H12 | C16 | H13 | 109.5° | 109.8° |
| H15 | C19 | H14 | 109.5° | 109.5° |
| H15 | C19 | H16 | 109.5° | 109.4° |
| H14 | C19 | H16 | 109.4° | 109.5° |
| H19 | C20 | H17 | 109.5° | 109.4° |
| H19 | C20 | H18 | 109.5° | 109.5° |
| H17 | C20 | H18 | 109.4° | 109.4° |
| H22 | C21 | H21 | 109.4° | 109.5° |
| H22 | C21 | H20 | 109.5° | 109.5° |
| H21 | C21 | H20 | 109.5° | 109.5° |
| H24 | C22 | H23 | 109.4° | 109.7° |
| H26 | C23 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O1 | C1 | N1 | C9 | 178.6° | 179.7° |
| O1 | C1 | N1 | C2 | 6.5° | 0.3° |
| O1 | C1 | C9 | C10 | 177.4° | 0.3° |
| O1 | C1 | C9 | N7 | 1.6° | 179.5° |
| O1 | C1 | N1 | H1 | 173.4° | 179.8° |
| C1 | N1 | C2 | H1 | 180.0° | 179.9° |
| C1 | N1 | C2 | C3 | 123.5° | 180.0° |
| N1 | C1 | C9 | C10 | 1.4° | 180.0° |
| N1 | C1 | C9 | N7 | 179.7° | 0.2° |
| C1 | N1 | C2 | H2 | 115.8° | 60.0° |
| C1 | N1 | C2 | H3 | 2.7° | 60.0° |
| C9 | C1 | N1 | C2 | 172.1° | 180.0° |
| C1 | C9 | C10 | N7 | 178.9° | 179.8° |
| C1 | C9 | C10 | O2 | 0.7° | 0.0° |
| C1 | C9 | C10 | C11 | 179.7° | 180.0° |
| C1 | C9 | N7 | C25 | 179.9° | 179.7° |
| C9 | C1 | N1 | H1 | 7.9° | 0.1° |
| N1 | C2 | C3 | H2 | 120.7° | 120.0° |
| N1 | C2 | C3 | H3 | 120.7° | 120.0° |
| N1 | C2 | C3 | C4 | 141.5° | 90.0° |
| N1 | C2 | C3 | C8 | 40.1° | 90.3° |
| N1 | C2 | H2 | H3 | 117.8° | 120.0° |
| C2 | C3 | C4 | C8 | 178.5° | 179.7° |
| C2 | C3 | C4 | N2 | 179.1° | 180.0° |
| C2 | C3 | C8 | C7 | 179.0° | 180.0° |
| C3 | C2 | H2 | H3 | 117.9° | 120.0° |
| C2 | C3 | C4 | H4 | 0.9° | 0.0° |
| C2 | C3 | C8 | H6 | 1.0° | 0.1° |
| C3 | C2 | N1 | H1 | 56.5° | 0.0° |
| C3 | C4 | N2 | H4 | 180.0° | 179.9° |
| C3 | C4 | N2 | C5 | 0.4° | 0.1° |
| C4 | C3 | C8 | C7 | 0.5° | 0.2° |
| C4 | C3 | C2 | H2 | 20.8° | 150.0° |
| C4 | C3 | C2 | H3 | 97.8° | 30.0° |
| C4 | C3 | C8 | H6 | 179.4° | 179.7° |
| C8 | C3 | C4 | N2 | 0.6° | 0.3° |
| C3 | C8 | C7 | C5 | 0.3° | 0.0° |
| C3 | C8 | C7 | H6 | 180.0° | 179.9° |
| C8 | C3 | C2 | H2 | 160.8° | 29.7° |
| C8 | C3 | C2 | H3 | 80.6° | 149.7° |
| C8 | C3 | C4 | H4 | 179.4° | 179.7° |
| C3 | C8 | C7 | H5 | 179.7° | 180.0° |
| C4 | N2 | C5 | C6 | 179.7° | 180.0° |
| C4 | N2 | C5 | C7 | 0.1° | 0.2° |
| N2 | C5 | C6 | C7 | 179.8° | 179.8° |
| N2 | C5 | C6 | N3 | 48.4° | 157.7° |
| N2 | C5 | C7 | C8 | 0.1° | 0.3° |
| C5 | N2 | C4 | H4 | 179.6° | 180.0° |
| N2 | C5 | C7 | H5 | 179.9° | 179.8° |
| C6 | C5 | C7 | C8 | 179.7° | 179.9° |
| C6 | C5 | C7 | H5 | 0.3° | 0.0° |
| C7 | C5 | C6 | N3 | 131.4° | 22.1° |
| C5 | C7 | C8 | H5 | 180.0° | 179.9° |
| C5 | C7 | C8 | H6 | 179.7° | 179.9° |
| C9 | C10 | O2 | C11 | 179.0° | 180.0° |
| C9 | C10 | C11 | C12 | 179.2° | 180.0° |
| C9 | C10 | C11 | C24 | 0.9° | 0.0° |
| C10 | C9 | N7 | C25 | 1.0° | 0.6° |
| C9 | C10 | O2 | H7 | 180.0° | 90.0° |
| N7 | C9 | C10 | O2 | 179.6° | 179.8° |
| N7 | C9 | C10 | C11 | 1.4° | 0.3° |
| C9 | N7 | C25 | C24 | 0.0° | 0.6° |
| C9 | N7 | C25 | H27 | 180.0° | 179.7° |
| O2 | C10 | C11 | C12 | 0.2° | 0.1° |
| O2 | C10 | C11 | C24 | 179.9° | 179.9° |
| C10 | C11 | C12 | C24 | 179.9° | 180.0° |
| C10 | C11 | C12 | C13 | 179.6° | 180.0° |
| C10 | C11 | C24 | N6 | 179.8° | 180.0° |
| C10 | C11 | C24 | C25 | 0.0° | 0.0° |
| C10 | C11 | C12 | H8 | 0.3° | 0.0° |
| C11 | C10 | O2 | H7 | 1.0° | 90.0° |
| C11 | C12 | C13 | H8 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.7° | 0.0° |
| C12 | C11 | C24 | N6 | 0.1° | 0.0° |
| C12 | C11 | C24 | C25 | 179.9° | 180.0° |
| C11 | C12 | C13 | H9 | 179.3° | 180.0° |
| C24 | C11 | C12 | C13 | 0.4° | 0.0° |
| C11 | C24 | N6 | C14 | 0.4° | 0.0° |
| C11 | C24 | N6 | C25 | 179.8° | 180.0° |
| C11 | C24 | C25 | N7 | 0.5° | 0.3° |
| C24 | C11 | C12 | H8 | 179.6° | 180.0° |
| C11 | C24 | C25 | H27 | 179.6° | 180.0° |
| C12 | C13 | C14 | H9 | 180.0° | 180.0° |
| C12 | C13 | C14 | N4 | 179.5° | 180.0° |
| C12 | C13 | C14 | N6 | 0.4° | 0.0° |
| C13 | C14 | N4 | N6 | 179.2° | 180.0° |
| C13 | C14 | N4 | C15 | 19.2° | 180.0° |
| C13 | C14 | N4 | C23 | 159.8° | 55.7° |
| C13 | C14 | N6 | C24 | 0.1° | 0.0° |
| C14 | C13 | C12 | H8 | 179.3° | 180.0° |
| C14 | N4 | C15 | C23 | 179.1° | 124.2° |
| C14 | N4 | C15 | C16 | 120.6° | 172.8° |
| C14 | N4 | C23 | C22 | 120.0° | 172.7° |
| N4 | C14 | N6 | C24 | 179.0° | 180.0° |
| N4 | C14 | C13 | H9 | 0.5° | 0.0° |
| C14 | N4 | C15 | H11 | 119.3° | 67.3° |
| C14 | N4 | C15 | H10 | 0.5° | 52.8° |
| C14 | N4 | C23 | H26 | 0.0° | 52.8° |
| C14 | N4 | C23 | H25 | 119.9° | 67.3° |
| N6 | C14 | N4 | C15 | 161.6° | 0.1° |
| N6 | C14 | N4 | C23 | 19.4° | 124.3° |
| C14 | N6 | C24 | C25 | 179.8° | 180.0° |
| N6 | C14 | C13 | H9 | 179.6° | 180.0° |
| N4 | C15 | C16 | H11 | 120.1° | 119.9° |
| N4 | C15 | C16 | H10 | 120.1° | 120.0° |
| N4 | C15 | C16 | N5 | 54.8° | 53.8° |
| C15 | N4 | C23 | C22 | 59.1° | 63.1° |
| N4 | C15 | H11 | H10 | 119.6° | 120.1° |
| N4 | C15 | C16 | H12 | 174.9° | 173.5° |
| N4 | C15 | C16 | H13 | 65.3° | 65.9° |
| C15 | N4 | C23 | H26 | 179.2° | 176.9° |
| C15 | N4 | C23 | H25 | 61.0° | 56.9° |
| C23 | N4 | C15 | C16 | 58.5° | 63.1° |
| N4 | C23 | C22 | N5 | 56.0° | 53.8° |
| N4 | C23 | C22 | H26 | 120.1° | 120.0° |
| N4 | C23 | C22 | H25 | 120.1° | 120.0° |
| C23 | N4 | C15 | H11 | 61.6° | 56.9° |
| C23 | N4 | C15 | H10 | 178.6° | 176.9° |
| N4 | C23 | C22 | H24 | 176.1° | 173.6° |
| N4 | C23 | C22 | H23 | 64.1° | 65.9° |
| N4 | C23 | H26 | H25 | 119.8° | 120.1° |
| C15 | C16 | N5 | H12 | 120.1° | 119.7° |
| C15 | C16 | N5 | H13 | 120.1° | 119.7° |
| C15 | C16 | N5 | C17 | 124.9° | 128.9° |
| C15 | C16 | N5 | C22 | 54.3° | 51.2° |
| C16 | C15 | H11 | H10 | 119.7° | 120.1° |
| C15 | C16 | H12 | H13 | 119.6° | 120.4° |
| C16 | N5 | C17 | C22 | 179.1° | 179.9° |
| C16 | N5 | C17 | O3 | 170.7° | 180.0° |
| C16 | N5 | C17 | O4 | 10.3° | 0.1° |
| C16 | N5 | C22 | C23 | 54.9° | 51.2° |
| N5 | C16 | C15 | H11 | 65.3° | 66.1° |
| N5 | C16 | C15 | H10 | 174.9° | 173.8° |
| N5 | C16 | H12 | H13 | 119.6° | 120.5° |
| C16 | N5 | C22 | H24 | 175.1° | 171.0° |
| C16 | N5 | C22 | H23 | 65.2° | 68.5° |
| N5 | C17 | O3 | O4 | 179.0° | 180.0° |
| N5 | C17 | O3 | C18 | 177.7° | 180.0° |
| C17 | N5 | C22 | C23 | 124.2° | 128.9° |
| C17 | N5 | C16 | H12 | 4.7° | 9.2° |
| C17 | N5 | C16 | H13 | 115.0° | 111.4° |
| C17 | N5 | C22 | H24 | 4.1° | 9.1° |
| C17 | N5 | C22 | H23 | 115.7° | 111.4° |
| C22 | N5 | C17 | O3 | 10.2° | 0.1° |
| C22 | N5 | C17 | O4 | 168.8° | 180.0° |
| N5 | C22 | C23 | H24 | 120.1° | 119.8° |
| N5 | C22 | C23 | H23 | 120.1° | 119.7° |
| C22 | N5 | C16 | H12 | 174.5° | 170.9° |
| C22 | N5 | C16 | H13 | 65.8° | 68.5° |
| N5 | C22 | H24 | H23 | 119.7° | 120.5° |
| N5 | C22 | C23 | H26 | 176.1° | 173.8° |
| N5 | C22 | C23 | H25 | 64.0° | 66.2° |
| C17 | O3 | C18 | C19 | 53.6° | 60.0° |
| C17 | O3 | C18 | C20 | 172.9° | 60.0° |
| C17 | O3 | C18 | C21 | 68.6° | 180.0° |
| O4 | C17 | O3 | C18 | 1.3° | 0.0° |
| O3 | C18 | C19 | C20 | 115.9° | 120.0° |
| O3 | C18 | C19 | C21 | 119.5° | 120.0° |
| O3 | C18 | C20 | C21 | 116.1° | 120.1° |
| O3 | C18 | C19 | H15 | 180.0° | 60.0° |
| O3 | C18 | C19 | H14 | 60.0° | 60.0° |
| O3 | C18 | C19 | H16 | 60.0° | 179.9° |
| O3 | C18 | C20 | H19 | 180.0° | 180.0° |
| O3 | C18 | C20 | H17 | 60.0° | 60.1° |
| O3 | C18 | C20 | H18 | 60.0° | 59.9° |
| O3 | C18 | C21 | H22 | 180.0° | 60.0° |
| O3 | C18 | C21 | H21 | 60.0° | 60.0° |
| O3 | C18 | C21 | H20 | 60.0° | 180.0° |
| C19 | C18 | C20 | C21 | 125.2° | 120.0° |
| C18 | C19 | H15 | H14 | 120.0° | 120.0° |
| C18 | C19 | H15 | H16 | 120.0° | 120.0° |
| C18 | C19 | H14 | H16 | 120.0° | 120.0° |
| C19 | C18 | C20 | H19 | 61.2° | 60.0° |
| C19 | C18 | C20 | H17 | 178.7° | 180.0° |
| C19 | C18 | C20 | H18 | 58.8° | 60.1° |
| C19 | C18 | C21 | H22 | 59.1° | 60.0° |
| C19 | C18 | C21 | H21 | 60.9° | 180.0° |
| C19 | C18 | C21 | H20 | 179.1° | 60.0° |
| C20 | C18 | C19 | H15 | 64.1° | 60.0° |
| C20 | C18 | C19 | H14 | 56.0° | 180.0° |
| C20 | C18 | C19 | H16 | 175.9° | 59.9° |
| C18 | C20 | H19 | H17 | 120.0° | 120.0° |
| C18 | C20 | H19 | H18 | 120.0° | 120.1° |
| C18 | C20 | H17 | H18 | 120.0° | 120.0° |
| C20 | C18 | C21 | H22 | 65.3° | 179.9° |
| C20 | C18 | C21 | H21 | 174.7° | 60.0° |
| C20 | C18 | C21 | H20 | 54.7° | 59.9° |
| C21 | C18 | C19 | H15 | 60.5° | 180.0° |
| C21 | C18 | C19 | H14 | 179.4° | 60.0° |
| C21 | C18 | C19 | H16 | 59.5° | 60.0° |
| C21 | C18 | C20 | H19 | 63.9° | 59.9° |
| C21 | C18 | C20 | H17 | 56.1° | 60.0° |
| C21 | C18 | C20 | H18 | 176.1° | 180.0° |
| C18 | C21 | H22 | H21 | 120.0° | 120.0° |
| C18 | C21 | H22 | H20 | 120.0° | 120.0° |
| C18 | C21 | H21 | H20 | 120.0° | 120.0° |
| C23 | C22 | H24 | H23 | 119.7° | 120.4° |
| C22 | C23 | H26 | H25 | 119.8° | 120.0° |
| N6 | C24 | C25 | N7 | 179.7° | 179.7° |
| N6 | C24 | C25 | H27 | 0.3° | 0.1° |
| C24 | C25 | N7 | H27 | 180.0° | 179.7° |
| H2 | C2 | N1 | H1 | 64.2° | 120.0° |
| H3 | C2 | N1 | H1 | 177.2° | 120.1° |
| H5 | C7 | C8 | H6 | 0.3° | 0.2° |
| H8 | C12 | C13 | H9 | 0.7° | 0.0° |
| H11 | C15 | C16 | H12 | 54.8° | 53.6° |
| H11 | C15 | C16 | H13 | 174.6° | 174.1° |
| H10 | C15 | C16 | H12 | 65.0° | 66.5° |
| H10 | C15 | C16 | H13 | 54.8° | 54.1° |
| H15 | C19 | H14 | H16 | 120.0° | 120.0° |
| H19 | C20 | H17 | H18 | 120.0° | 120.0° |
| H22 | C21 | H21 | H20 | 120.0° | 120.1° |
| H24 | C22 | C23 | H26 | 63.8° | 66.4° |
| H24 | C22 | C23 | H25 | 56.0° | 53.6° |
| H23 | C22 | C23 | H26 | 56.0° | 54.1° |
| H23 | C22 | C23 | H25 | 175.8° | 174.1° |
