SQB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C17 | C16 | sing | 1.51Å | 1.49Å | |
| C15 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C14 | sing | 1.39Å | 1.38Å | Aromatic |
| C16 | N3 | sing | 1.32Å | 1.34Å | Aromatic |
| C14 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| N3 | C11 | doub | 1.33Å | 1.34Å | Aromatic |
| C12 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
| C12 | O | sing | 1.36Å | 1.37Å | |
| C11 | C10 | sing | 1.48Å | 1.49Å | |
| C13 | O | sing | 1.43Å | 1.42Å | |
| C10 | C9 | doub | 1.39Å | 1.39Å | Aromatic |
| C10 | C18 | sing | 1.40Å | 1.39Å | Aromatic |
| C9 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.38Å | Aromatic |
| C8 | CL | sing | 1.74Å | 1.73Å | |
| C8 | C7 | doub | 1.40Å | 1.39Å | Aromatic |
| C19 | C7 | sing | 1.40Å | 1.39Å | Aromatic |
| C7 | C6 | sing | 1.48Å | 1.48Å | |
| O1 | C20 | doub | 1.22Å | 1.23Å | |
| C6 | C20 | sing | 1.46Å | 1.46Å | |
| C6 | C5 | doub | 1.37Å | 1.35Å | |
| C20 | N4 | sing | 1.35Å | 1.38Å | |
| C25 | O3 | sing | 1.43Å | 1.43Å | |
| C25 | C24 | sing | 1.53Å | 1.52Å | |
| N5 | C24 | sing | 1.47Å | 1.47Å | |
| O3 | C22 | sing | 1.43Å | 1.41Å | |
| C5 | C4 | sing | 1.41Å | 1.43Å | |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C22 | O2 | sing | 1.43Å | 1.41Å | |
| N4 | C21 | sing | 1.46Å | 1.47Å | |
| N4 | C3 | sing | 1.37Å | 1.39Å | |
| C24 | C23 | sing | 1.53Å | 1.52Å | |
| C23 | O2 | sing | 1.43Å | 1.43Å | |
| C4 | C3 | doub | 1.41Å | 1.41Å | Aromatic |
| C4 | C2 | sing | 1.40Å | 1.40Å | Aromatic |
| C3 | N2 | sing | 1.33Å | 1.34Å | Aromatic |
| C2 | N1 | doub | 1.32Å | 1.34Å | Aromatic |
| N2 | C1 | doub | 1.32Å | 1.34Å | Aromatic |
| C1 | N1 | sing | 1.33Å | 1.34Å | Aromatic |
| C1 | N | sing | 1.38Å | 1.34Å | |
| N | C | sing | 1.47Å | 1.45Å | |
| C9 | H1 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C5 | H3 | sing | 1.08Å | 1.08Å | |
| N | H4 | sing | 0.97Å | 1.00Å | |
| C | H5 | sing | 1.09Å | 1.10Å | |
| C | H6 | sing | 1.09Å | 1.10Å | |
| C | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C13 | H9 | sing | 1.09Å | 1.10Å | |
| C13 | H10 | sing | 1.09Å | 1.10Å | |
| C14 | H11 | sing | 1.08Å | 1.08Å | |
| C15 | H12 | sing | 1.08Å | 1.08Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H16 | sing | 1.08Å | 1.08Å | |
| C19 | H17 | sing | 1.08Å | 1.08Å | |
| C21 | H18 | sing | 1.09Å | 1.10Å | |
| C21 | H19 | sing | 1.09Å | 1.10Å | |
| C22 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| N5 | H26 | sing | 1.01Å | 1.00Å | |
| N5 | H27 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C16 | C15 | 121.7° | 119.5° |
| C17 | C16 | N3 | 116.6° | 119.5° |
| C16 | C17 | H13 | 109.5° | 109.5° |
| C16 | C17 | H14 | 109.5° | 109.5° |
| C16 | C17 | H15 | 109.5° | 109.5° |
| C16 | C15 | C14 | 119.7° | 119.4° |
| C15 | C16 | N3 | 121.7° | 121.1° |
| C16 | C15 | H12 | 120.1° | 120.3° |
| C15 | C14 | C12 | 118.6° | 118.4° |
| C15 | C14 | H11 | 120.7° | 120.8° |
| C14 | C15 | H12 | 120.2° | 120.2° |
| C16 | N3 | C11 | 119.0° | 121.6° |
| C14 | C12 | C11 | 118.8° | 118.9° |
| C14 | C12 | O | 124.1° | 120.5° |
| C12 | C14 | H11 | 120.7° | 120.7° |
| N3 | C11 | C12 | 122.2° | 120.5° |
| N3 | C11 | C10 | 114.2° | 119.8° |
| C11 | C12 | O | 117.1° | 120.6° |
| C12 | C11 | C10 | 123.6° | 119.7° |
| C12 | O | C13 | 117.6° | 117.1° |
| C11 | C10 | C9 | 120.9° | 120.0° |
| C11 | C10 | C18 | 120.6° | 120.0° |
| O | C13 | H8 | 109.5° | 109.5° |
| O | C13 | H9 | 109.5° | 109.4° |
| O | C13 | H10 | 109.4° | 109.4° |
| C9 | C10 | C18 | 118.5° | 120.1° |
| C10 | C9 | C8 | 120.2° | 120.0° |
| C10 | C9 | H1 | 119.9° | 120.0° |
| C10 | C18 | C19 | 121.1° | 120.0° |
| C10 | C18 | H16 | 119.5° | 120.0° |
| C9 | C8 | CL | 117.9° | 120.0° |
| C9 | C8 | C7 | 121.5° | 120.0° |
| C8 | C9 | H1 | 119.9° | 120.0° |
| C18 | C19 | C7 | 120.7° | 120.0° |
| C19 | C18 | H16 | 119.4° | 120.0° |
| C18 | C19 | H17 | 119.6° | 120.0° |
| CL | C8 | C7 | 120.6° | 120.0° |
| C8 | C7 | C19 | 117.9° | 120.0° |
| C8 | C7 | C6 | 122.8° | 120.0° |
| C19 | C7 | C6 | 119.2° | 120.0° |
| C7 | C19 | H17 | 119.6° | 120.0° |
| C7 | C6 | C20 | 118.2° | 120.3° |
| C7 | C6 | C5 | 122.3° | 120.3° |
| O1 | C20 | C6 | 123.7° | 119.8° |
| O1 | C20 | N4 | 119.4° | 119.8° |
| C20 | C6 | C5 | 119.4° | 119.3° |
| C6 | C20 | N4 | 116.9° | 120.4° |
| C6 | C5 | C4 | 122.1° | 119.0° |
| C6 | C5 | H3 | 119.0° | 120.5° |
| C20 | N4 | C21 | 117.2° | 119.7° |
| C20 | N4 | C3 | 122.9° | 120.6° |
| O3 | C25 | C24 | 111.1° | 108.9° |
| C25 | O3 | C22 | 111.5° | 113.8° |
| O3 | C25 | H24 | 109.1° | 109.6° |
| O3 | C25 | H25 | 109.0° | 109.5° |
| C25 | C24 | N5 | 111.8° | 109.7° |
| C25 | C24 | C23 | 109.7° | 108.8° |
| C25 | C24 | H23 | 107.7° | 109.6° |
| C24 | C25 | H24 | 109.0° | 109.6° |
| C24 | C25 | H25 | 109.1° | 109.5° |
| N5 | C24 | C23 | 111.6° | 109.6° |
| N5 | C24 | H23 | 108.3° | 109.6° |
| C24 | N5 | H26 | 109.5° | 111.0° |
| C24 | N5 | H27 | 109.5° | 111.0° |
| O3 | C22 | C21 | 110.5° | 109.4° |
| O3 | C22 | O2 | 108.0° | 109.4° |
| O3 | C22 | H20 | 110.2° | 109.5° |
| C5 | C4 | C3 | 118.0° | 120.3° |
| C5 | C4 | C2 | 126.7° | 121.2° |
| C4 | C5 | H3 | 118.9° | 120.5° |
| C21 | C22 | O2 | 109.3° | 109.5° |
| C22 | C21 | N4 | 112.0° | 109.5° |
| C22 | C21 | H18 | 108.8° | 109.5° |
| C22 | C21 | H19 | 108.8° | 109.5° |
| C21 | C22 | H20 | 108.6° | 109.5° |
| C22 | O2 | C23 | 111.5° | 113.8° |
| O2 | C22 | H20 | 110.1° | 109.5° |
| C21 | N4 | C3 | 119.8° | 119.7° |
| N4 | C21 | H18 | 108.8° | 109.5° |
| N4 | C21 | H19 | 108.8° | 109.5° |
| N4 | C3 | C4 | 119.5° | 120.4° |
| N4 | C3 | N2 | 117.3° | 120.9° |
| C24 | C23 | O2 | 111.1° | 108.9° |
| C24 | C23 | H21 | 109.1° | 109.5° |
| C24 | C23 | H22 | 109.0° | 109.7° |
| C23 | C24 | H23 | 107.7° | 109.6° |
| O2 | C23 | H21 | 109.1° | 109.6° |
| O2 | C23 | H22 | 109.0° | 109.6° |
| C3 | C4 | C2 | 115.3° | 118.5° |
| C4 | C3 | N2 | 123.2° | 118.7° |
| C4 | C2 | N1 | 122.9° | 118.6° |
| C4 | C2 | H2 | 118.5° | 120.7° |
| C3 | N2 | C1 | 115.7° | 120.5° |
| C2 | N1 | C1 | 116.1° | 121.2° |
| N1 | C2 | H2 | 118.6° | 120.7° |
| N2 | C1 | N1 | 126.8° | 122.4° |
| N2 | C1 | N | 116.6° | 118.8° |
| N1 | C1 | N | 116.6° | 118.8° |
| C1 | N | C | 123.6° | 120.0° |
| C1 | N | H4 | 105.9° | 120.0° |
| C | N | H4 | 105.8° | 120.0° |
| N | C | H5 | 109.5° | 109.4° |
| N | C | H6 | 109.5° | 109.5° |
| N | C | H7 | 109.5° | 109.4° |
| H5 | C | H6 | 109.4° | 109.5° |
| H5 | C | H7 | 109.4° | 109.5° |
| H6 | C | H7 | 109.5° | 109.5° |
| H8 | C13 | H9 | 109.4° | 109.5° |
| H8 | C13 | H10 | 109.5° | 109.5° |
| H9 | C13 | H10 | 109.5° | 109.5° |
| H13 | C17 | H14 | 109.4° | 109.5° |
| H13 | C17 | H15 | 109.5° | 109.5° |
| H14 | C17 | H15 | 109.5° | 109.5° |
| H18 | C21 | H19 | 109.5° | 109.4° |
| H21 | C23 | H22 | 109.5° | 109.5° |
| H24 | C25 | H25 | 109.5° | 109.7° |
| H26 | N5 | H27 | 109.4° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C16 | C15 | N3 | 179.9° | 179.8° |
| C17 | C16 | C15 | C14 | 179.8° | 180.0° |
| C17 | C16 | N3 | C11 | 179.9° | 179.7° |
| C17 | C16 | C15 | H12 | 0.2° | 0.2° |
| C16 | C17 | H13 | H14 | 120.0° | 120.0° |
| C16 | C17 | H13 | H15 | 120.0° | 120.0° |
| C16 | C17 | H14 | H15 | 120.0° | 120.0° |
| C16 | C15 | C14 | H12 | 180.0° | 179.8° |
| C16 | C15 | C14 | C12 | 0.0° | 0.1° |
| C15 | C16 | N3 | C11 | 0.0° | 0.5° |
| C16 | C15 | C14 | H11 | 180.0° | 180.0° |
| C15 | C16 | C17 | H13 | 179.9° | 90.0° |
| C15 | C16 | C17 | H14 | 60.2° | 150.0° |
| C15 | C16 | C17 | H15 | 59.9° | 30.0° |
| C14 | C15 | C16 | N3 | 0.1° | 0.2° |
| C15 | C14 | C12 | H11 | 180.0° | 179.9° |
| C15 | C14 | C12 | C11 | 0.1° | 0.0° |
| C15 | C14 | C12 | O | 179.9° | 180.0° |
| C16 | N3 | C11 | C12 | 0.2° | 0.5° |
| C16 | N3 | C11 | C10 | 178.5° | 179.8° |
| N3 | C16 | C15 | H12 | 179.9° | 180.0° |
| N3 | C16 | C17 | H13 | 0.0° | 89.8° |
| N3 | C16 | C17 | H14 | 120.0° | 30.2° |
| N3 | C16 | C17 | H15 | 120.0° | 150.2° |
| C14 | C12 | C11 | N3 | 0.3° | 0.3° |
| C14 | C12 | C11 | O | 179.9° | 180.0° |
| C14 | C12 | C11 | C10 | 178.4° | 179.9° |
| C14 | C12 | O | C13 | 0.8° | 0.0° |
| C12 | C14 | C15 | H12 | 180.0° | 179.7° |
| N3 | C11 | C12 | C10 | 178.6° | 179.7° |
| N3 | C11 | C12 | O | 179.8° | 179.7° |
| N3 | C11 | C10 | C9 | 108.2° | 35.3° |
| N3 | C11 | C10 | C18 | 70.7° | 144.8° |
| C11 | C12 | O | C13 | 179.1° | 180.0° |
| C12 | C11 | C10 | C9 | 73.0° | 145.0° |
| C12 | C11 | C10 | C18 | 108.0° | 34.9° |
| C11 | C12 | C14 | H11 | 179.9° | 179.9° |
| O | C12 | C11 | C10 | 1.6° | 0.1° |
| C12 | O | C13 | H8 | 180.0° | 180.0° |
| C12 | O | C13 | H9 | 60.0° | 59.9° |
| C12 | O | C13 | H10 | 60.0° | 60.0° |
| O | C12 | C14 | H11 | 0.1° | 0.1° |
| C11 | C10 | C9 | C18 | 179.0° | 179.9° |
| C11 | C10 | C9 | C8 | 178.3° | 180.0° |
| C11 | C10 | C18 | C19 | 178.2° | 179.7° |
| C11 | C10 | C9 | H1 | 1.7° | 0.0° |
| C11 | C10 | C18 | H16 | 1.8° | 0.0° |
| O | C13 | H8 | H9 | 120.0° | 120.0° |
| O | C13 | H8 | H10 | 120.0° | 120.0° |
| O | C13 | H9 | H10 | 120.0° | 119.9° |
| C10 | C9 | C8 | H1 | 180.0° | 180.0° |
| C9 | C10 | C18 | C19 | 0.8° | 0.3° |
| C10 | C9 | C8 | CL | 179.5° | 180.0° |
| C10 | C9 | C8 | C7 | 0.4° | 0.0° |
| C9 | C10 | C18 | H16 | 179.2° | 180.0° |
| C18 | C10 | C9 | C8 | 0.7° | 0.1° |
| C10 | C18 | C19 | H16 | 180.0° | 179.7° |
| C10 | C18 | C19 | C7 | 0.2° | 0.6° |
| C18 | C10 | C9 | H1 | 179.3° | 180.0° |
| C10 | C18 | C19 | H17 | 179.7° | 180.0° |
| C9 | C8 | CL | C7 | 179.9° | 180.0° |
| C9 | C8 | C7 | C19 | 1.4° | 0.3° |
| C9 | C8 | C7 | C6 | 174.1° | 180.0° |
| C18 | C19 | C7 | C8 | 1.3° | 0.6° |
| C18 | C19 | C7 | H17 | 180.0° | 179.4° |
| C18 | C19 | C7 | C6 | 174.3° | 179.7° |
| CL | C8 | C7 | C19 | 178.5° | 179.8° |
| CL | C8 | C7 | C6 | 6.0° | 0.1° |
| CL | C8 | C9 | H1 | 0.5° | 0.0° |
| C8 | C7 | C19 | C6 | 175.6° | 179.7° |
| C8 | C7 | C6 | C20 | 109.1° | 105.0° |
| C8 | C7 | C6 | C5 | 72.9° | 75.0° |
| C7 | C8 | C9 | H1 | 179.6° | 180.0° |
| C8 | C7 | C19 | H17 | 178.7° | 180.0° |
| C19 | C7 | C6 | C20 | 66.4° | 74.7° |
| C19 | C7 | C6 | C5 | 111.7° | 105.3° |
| C7 | C19 | C18 | H16 | 179.8° | 179.7° |
| C7 | C6 | C20 | O1 | 15.1° | 0.1° |
| C7 | C6 | C20 | C5 | 178.1° | 179.9° |
| C7 | C6 | C20 | N4 | 166.2° | 179.5° |
| C7 | C6 | C5 | C4 | 173.9° | 180.0° |
| C7 | C6 | C5 | H3 | 6.2° | 0.0° |
| C6 | C7 | C19 | H17 | 5.7° | 0.3° |
| O1 | C20 | C6 | N4 | 178.7° | 179.6° |
| O1 | C20 | C6 | C5 | 166.8° | 180.0° |
| O1 | C20 | N4 | C21 | 10.8° | 0.0° |
| O1 | C20 | N4 | C3 | 165.8° | 179.5° |
| C20 | C6 | C5 | C4 | 4.1° | 0.0° |
| C6 | C20 | N4 | C21 | 170.4° | 179.6° |
| C6 | C20 | N4 | C3 | 13.0° | 0.9° |
| C20 | C6 | C5 | H3 | 175.9° | 180.0° |
| C5 | C6 | C20 | N4 | 11.9° | 0.4° |
| C6 | C5 | C4 | H3 | 180.0° | 180.0° |
| C6 | C5 | C4 | C3 | 3.2° | 0.0° |
| C6 | C5 | C4 | C2 | 177.1° | 179.3° |
| C20 | N4 | C21 | C22 | 67.1° | 90.0° |
| C20 | N4 | C21 | C3 | 176.7° | 179.5° |
| C20 | N4 | C3 | C4 | 5.9° | 0.9° |
| C20 | N4 | C3 | N2 | 171.7° | 179.6° |
| C20 | N4 | C21 | H18 | 172.5° | 30.0° |
| C20 | N4 | C21 | H19 | 53.3° | 150.0° |
| O3 | C25 | C24 | H24 | 120.3° | 119.8° |
| O3 | C25 | C24 | H25 | 120.2° | 119.8° |
| O3 | C25 | C24 | N5 | 171.6° | 174.4° |
| C25 | O3 | C22 | C21 | 174.9° | 178.8° |
| C25 | O3 | C22 | O2 | 65.5° | 58.8° |
| O3 | C25 | C24 | C23 | 47.3° | 54.5° |
| C25 | O3 | C22 | H20 | 54.9° | 61.2° |
| O3 | C25 | C24 | H23 | 69.5° | 65.3° |
| O3 | C25 | H24 | H25 | 119.2° | 120.2° |
| C25 | C24 | N5 | C23 | 123.2° | 119.4° |
| C25 | C24 | N5 | H23 | 118.5° | 120.3° |
| C24 | C25 | O3 | C22 | 57.6° | 58.0° |
| C25 | C24 | C23 | H23 | 116.9° | 119.8° |
| C25 | C24 | C23 | O2 | 47.3° | 54.5° |
| C25 | C24 | C23 | H21 | 73.0° | 174.4° |
| C25 | C24 | C23 | H22 | 167.5° | 65.4° |
| C24 | C25 | H24 | H25 | 119.2° | 120.3° |
| C25 | C24 | N5 | H26 | 180.0° | 60.6° |
| C25 | C24 | N5 | H27 | 60.0° | 175.5° |
| N5 | C24 | C23 | H23 | 118.7° | 120.3° |
| N5 | C24 | C23 | O2 | 171.7° | 174.5° |
| N5 | C24 | C23 | H21 | 51.5° | 65.7° |
| N5 | C24 | C23 | H22 | 68.1° | 54.5° |
| N5 | C24 | C25 | H24 | 51.4° | 54.6° |
| N5 | C24 | C25 | H25 | 68.1° | 65.8° |
| C24 | N5 | H26 | H27 | 120.0° | 123.9° |
| O3 | C22 | C21 | O2 | 118.8° | 119.9° |
| O3 | C22 | C21 | H20 | 121.0° | 120.0° |
| O3 | C22 | O2 | H20 | 120.4° | 120.0° |
| O3 | C22 | C21 | N4 | 166.5° | 60.0° |
| O3 | C22 | O2 | C23 | 65.4° | 58.8° |
| O3 | C22 | C21 | H18 | 73.1° | 60.1° |
| O3 | C22 | C21 | H19 | 46.1° | 180.0° |
| C22 | O3 | C25 | H24 | 62.6° | 61.8° |
| C22 | O3 | C25 | H25 | 177.8° | 177.8° |
| C5 | C4 | C3 | N4 | 2.5° | 0.5° |
| C5 | C4 | C3 | C2 | 179.7° | 179.3° |
| C5 | C4 | C3 | N2 | 179.9° | 180.0° |
| C5 | C4 | C2 | N1 | 179.6° | 179.8° |
| C5 | C4 | C2 | H2 | 0.4° | 0.3° |
| C21 | C22 | O2 | H20 | 119.3° | 120.0° |
| C22 | C21 | N4 | H18 | 120.4° | 120.0° |
| C22 | C21 | N4 | H19 | 120.4° | 120.0° |
| C22 | C21 | N4 | C3 | 116.2° | 89.5° |
| C21 | C22 | O2 | C23 | 174.3° | 178.8° |
| C22 | C21 | H18 | H19 | 118.8° | 120.0° |
| O2 | C22 | C21 | N4 | 74.8° | 60.0° |
| C22 | O2 | C23 | C24 | 57.4° | 58.0° |
| O2 | C22 | C21 | H18 | 45.6° | 180.0° |
| O2 | C22 | C21 | H19 | 164.9° | 60.0° |
| C22 | O2 | C23 | H21 | 62.9° | 177.8° |
| C22 | O2 | C23 | H22 | 177.6° | 62.0° |
| C21 | N4 | C3 | C4 | 177.6° | 179.5° |
| C21 | N4 | C3 | N2 | 4.9° | 0.1° |
| N4 | C21 | H18 | H19 | 118.8° | 120.0° |
| N4 | C21 | C22 | H20 | 45.5° | 180.0° |
| N4 | C3 | C4 | N2 | 177.4° | 179.5° |
| N4 | C3 | C4 | C2 | 177.7° | 179.8° |
| N4 | C3 | N2 | C1 | 177.1° | 180.0° |
| C3 | N4 | C21 | H18 | 4.2° | 150.5° |
| C3 | N4 | C21 | H19 | 123.4° | 30.5° |
| C24 | C23 | O2 | H21 | 120.3° | 119.8° |
| C24 | C23 | O2 | H22 | 120.2° | 120.0° |
| C24 | C23 | H21 | H22 | 119.2° | 120.3° |
| C23 | C24 | C25 | H24 | 72.9° | 65.3° |
| C23 | C24 | C25 | H25 | 167.6° | 174.3° |
| C23 | C24 | N5 | H26 | 56.7° | 180.0° |
| C23 | C24 | N5 | H27 | 63.2° | 56.1° |
| C23 | O2 | C22 | H20 | 55.0° | 61.2° |
| O2 | C23 | H21 | H22 | 119.2° | 120.2° |
| O2 | C23 | C24 | H23 | 69.6° | 65.3° |
| C3 | C4 | C2 | N1 | 0.7° | 0.5° |
| C4 | C3 | N2 | C1 | 0.4° | 0.5° |
| C3 | C4 | C2 | H2 | 179.3° | 179.5° |
| C3 | C4 | C5 | H3 | 176.8° | 180.0° |
| C2 | C4 | C3 | N2 | 0.3° | 0.8° |
| C4 | C2 | N1 | H2 | 180.0° | 180.0° |
| C4 | C2 | N1 | C1 | 0.3° | 0.1° |
| C2 | C4 | C5 | H3 | 2.9° | 0.8° |
| C3 | N2 | C1 | N1 | 0.8° | 0.1° |
| C3 | N2 | C1 | N | 178.2° | 179.7° |
| C2 | N1 | C1 | N2 | 0.5° | 0.2° |
| C2 | N1 | C1 | N | 178.6° | 180.0° |
| N2 | C1 | N1 | N | 179.1° | 179.8° |
| N2 | C1 | N | C | 10.7° | 179.8° |
| N2 | C1 | N | H4 | 111.2° | 0.3° |
| N1 | C1 | N | C | 170.1° | 0.0° |
| C1 | N1 | C2 | H2 | 179.7° | 180.0° |
| N1 | C1 | N | H4 | 68.0° | 179.9° |
| C1 | N | C | H4 | 121.9° | 180.0° |
| C1 | N | C | H5 | 180.0° | 180.0° |
| C1 | N | C | H6 | 60.0° | 60.0° |
| C1 | N | C | H7 | 60.0° | 60.0° |
| N | C | H5 | H6 | 120.0° | 119.9° |
| N | C | H5 | H7 | 120.0° | 120.0° |
| N | C | H6 | H7 | 120.0° | 120.0° |
| H4 | N | C | H5 | 58.1° | 0.1° |
| H4 | N | C | H6 | 178.0° | 120.0° |
| H4 | N | C | H7 | 61.9° | 120.0° |
| H5 | C | H6 | H7 | 119.9° | 120.1° |
| H8 | C13 | H9 | H10 | 120.0° | 120.1° |
| H11 | C14 | C15 | H12 | 0.0° | 0.2° |
| H13 | C17 | H14 | H15 | 120.0° | 120.0° |
| H16 | C18 | C19 | H17 | 0.3° | 0.3° |
| H18 | C21 | C22 | H20 | 165.8° | 59.9° |
| H19 | C21 | C22 | H20 | 74.9° | 60.0° |
| H21 | C23 | C24 | H23 | 170.1° | 54.6° |
| H22 | C23 | C24 | H23 | 50.6° | 174.8° |
| H23 | C24 | C25 | H24 | 170.2° | 174.9° |
| H23 | C24 | C25 | H25 | 50.7° | 54.5° |
| H23 | C24 | N5 | H26 | 61.5° | 59.7° |
| H23 | C24 | N5 | H27 | 178.5° | 64.2° |
