A1AK4
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | N | sing | 1.47Å | 1.46Å | |
| N | C1 | sing | 1.35Å | 1.33Å | |
| O | C1 | doub | 1.22Å | 1.25Å | |
| C1 | C2 | sing | 1.48Å | 1.49Å | |
| C2 | C3 | doub | 1.40Å | 1.40Å | Aromatic |
| C3 | C4 | sing | 1.38Å | 1.38Å | Aromatic |
| C4 | C5 | doub | 1.38Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.40Å | 1.40Å | Aromatic |
| C6 | C7 | sing | 1.48Å | 1.47Å | |
| C7 | C8 | doub | 1.36Å | 1.38Å | Aromatic |
| C8 | C9 | sing | 1.46Å | 1.43Å | Aromatic |
| C9 | C10 | doub | 1.41Å | 1.42Å | Aromatic |
| C10 | N1 | sing | 1.38Å | 1.36Å | |
| N1 | C11 | sing | 1.47Å | 1.45Å | |
| C11 | C12 | sing | 1.51Å | 1.52Å | |
| C12 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.42Å | Aromatic |
| C17 | C16 | doub | 1.39Å | 1.40Å | Aromatic |
| C12 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C16 | S | sing | 1.77Å | 1.76Å | |
| O1 | S | doub | 1.42Å | 1.45Å | |
| S | O2 | doub | 1.42Å | 1.45Å | |
| C18 | S | sing | 1.82Å | 1.76Å | |
| C19 | C18 | sing | 1.54Å | 1.53Å | |
| C20 | C19 | sing | 1.52Å | 1.53Å | |
| C15 | C20 | sing | 1.50Å | 1.52Å | |
| C21 | C11 | sing | 1.53Å | 1.55Å | |
| C22 | C21 | sing | 1.53Å | 1.52Å | |
| C23 | C21 | sing | 1.53Å | 1.53Å | |
| N2 | C10 | sing | 1.33Å | 1.36Å | Aromatic |
| C24 | N2 | doub | 1.32Å | 1.34Å | Aromatic |
| N3 | C24 | sing | 1.32Å | 1.33Å | Aromatic |
| C25 | N3 | doub | 1.33Å | 1.35Å | Aromatic |
| C9 | C25 | sing | 1.41Å | 1.40Å | Aromatic |
| N4 | C25 | sing | 1.37Å | 1.38Å | Aromatic |
| C7 | N4 | sing | 1.38Å | 1.39Å | Aromatic |
| C26 | C6 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C26 | sing | 1.39Å | 1.40Å | Aromatic |
| N1 | H10 | sing | 0.97Å | 1.00Å | |
| C4 | H7 | sing | 1.08Å | 1.08Å | |
| C5 | H8 | sing | 1.08Å | 1.08Å | |
| C8 | H9 | sing | 1.08Å | 1.08Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C17 | H13 | sing | 1.08Å | 1.08Å | |
| C20 | H18 | sing | 1.09Å | 1.10Å | |
| C20 | H19 | sing | 1.09Å | 1.10Å | |
| C21 | H20 | sing | 1.09Å | 1.10Å | |
| C22 | H21 | sing | 1.09Å | 1.10Å | |
| C22 | H22 | sing | 1.09Å | 1.10Å | |
| C22 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H27 | sing | 1.08Å | 1.08Å | |
| C26 | H28 | sing | 1.08Å | 1.08Å | |
| C18 | H15 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C19 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C11 | H | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C23 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H25 | sing | 1.09Å | 1.10Å | |
| N4 | H1 | sing | 0.97Å | 1.00Å | |
| C3 | H6 | sing | 1.08Å | 1.08Å | |
| N | H5 | sing | 0.97Å | 1.00Å | |
| C | H4 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | N | C1 | 121.6° | 120.0° |
| C | N | H5 | 119.2° | 120.0° |
| N | C | H4 | 109.5° | 109.4° |
| N | C | H2 | 109.5° | 109.5° |
| N | C | H3 | 109.5° | 109.4° |
| N | C1 | O | 122.2° | 120.0° |
| N | C1 | C2 | 117.4° | 120.0° |
| C1 | N | H5 | 119.2° | 120.0° |
| O | C1 | C2 | 120.3° | 120.0° |
| C1 | C2 | C3 | 117.9° | 120.1° |
| C1 | C2 | C26 | 122.0° | 120.1° |
| C2 | C3 | C4 | 120.2° | 120.2° |
| C3 | C2 | C26 | 119.6° | 119.8° |
| C2 | C3 | H6 | 119.9° | 119.9° |
| C3 | C4 | C5 | 120.3° | 120.3° |
| C3 | C4 | H7 | 119.9° | 119.9° |
| C4 | C3 | H6 | 119.9° | 119.9° |
| C4 | C5 | C6 | 120.4° | 120.1° |
| C5 | C4 | H7 | 119.8° | 119.8° |
| C4 | C5 | H8 | 119.8° | 119.9° |
| C5 | C6 | C7 | 119.0° | 120.1° |
| C5 | C6 | C26 | 119.4° | 119.9° |
| C6 | C5 | H8 | 119.8° | 119.9° |
| C6 | C7 | C8 | 128.7° | 125.3° |
| C6 | C7 | N4 | 122.2° | 125.3° |
| C7 | C6 | C26 | 121.6° | 120.1° |
| C7 | C8 | C9 | 107.1° | 106.8° |
| C8 | C7 | N4 | 108.9° | 109.4° |
| C7 | C8 | H9 | 126.4° | 126.6° |
| C8 | C9 | C10 | 136.8° | 135.0° |
| C8 | C9 | C25 | 107.1° | 106.5° |
| C9 | C8 | H9 | 126.5° | 126.6° |
| C9 | C10 | N1 | 121.5° | 120.8° |
| C9 | C10 | N2 | 118.5° | 118.3° |
| C10 | C9 | C25 | 116.2° | 118.6° |
| C10 | N1 | C11 | 124.7° | 120.0° |
| N1 | C10 | N2 | 119.8° | 120.9° |
| C10 | N1 | H10 | 105.6° | 120.0° |
| N1 | C11 | C12 | 110.3° | 109.5° |
| N1 | C11 | C21 | 110.1° | 109.5° |
| C11 | N1 | H10 | 105.5° | 120.0° |
| N1 | C11 | H | 108.4° | 109.4° |
| C11 | C12 | C13 | 121.1° | 120.2° |
| C11 | C12 | C17 | 121.4° | 120.3° |
| C12 | C11 | C21 | 113.2° | 109.5° |
| C12 | C11 | H | 107.5° | 109.5° |
| C12 | C13 | C14 | 121.2° | 119.9° |
| C13 | C12 | C17 | 117.5° | 119.5° |
| C12 | C13 | H11 | 119.4° | 120.1° |
| C13 | C14 | C15 | 122.4° | 120.9° |
| C14 | C13 | H11 | 119.4° | 120.0° |
| C13 | C14 | H12 | 118.8° | 119.5° |
| C14 | C15 | C16 | 115.8° | 118.8° |
| C14 | C15 | C20 | 119.9° | 116.5° |
| C15 | C14 | H12 | 118.8° | 119.5° |
| C15 | C16 | C17 | 121.9° | 120.3° |
| C15 | C16 | S | 121.7° | 121.8° |
| C16 | C15 | C20 | 124.3° | 124.7° |
| C16 | C17 | C12 | 121.1° | 120.6° |
| C17 | C16 | S | 116.2° | 117.8° |
| C16 | C17 | H13 | 119.5° | 119.7° |
| C12 | C17 | H13 | 119.5° | 119.7° |
| C16 | S | O1 | 108.1° | 104.5° |
| C16 | S | O2 | 107.9° | 104.4° |
| C16 | S | C18 | 103.5° | 103.7° |
| O1 | S | O2 | 116.9° | 121.2° |
| O1 | S | C18 | 110.1° | 110.6° |
| O2 | S | C18 | 109.4° | 110.7° |
| S | C18 | C19 | 111.1° | 107.1° |
| S | C18 | H15 | 109.0° | 110.0° |
| S | C18 | H14 | 109.1° | 109.9° |
| C18 | C19 | C20 | 110.8° | 109.1° |
| C19 | C18 | H15 | 109.1° | 110.0° |
| C19 | C18 | H14 | 109.0° | 110.0° |
| C18 | C19 | H16 | 109.2° | 109.6° |
| C18 | C19 | H17 | 109.1° | 109.5° |
| C19 | C20 | C15 | 113.2° | 113.8° |
| C19 | C20 | H18 | 108.5° | 108.6° |
| C19 | C20 | H19 | 108.5° | 108.6° |
| C20 | C19 | H16 | 109.1° | 109.5° |
| C20 | C19 | H17 | 109.1° | 109.5° |
| C15 | C20 | H18 | 108.5° | 108.6° |
| C15 | C20 | H19 | 108.5° | 108.7° |
| C11 | C21 | C22 | 111.4° | 109.5° |
| C11 | C21 | C23 | 111.7° | 109.4° |
| C11 | C21 | H20 | 107.4° | 109.5° |
| C21 | C11 | H | 107.2° | 109.5° |
| C22 | C21 | C23 | 110.7° | 109.4° |
| C22 | C21 | H20 | 107.7° | 109.5° |
| C21 | C22 | H21 | 109.5° | 109.5° |
| C21 | C22 | H22 | 109.5° | 109.5° |
| C21 | C22 | H23 | 109.5° | 109.5° |
| C23 | C21 | H20 | 107.6° | 109.5° |
| C21 | C23 | H24 | 109.5° | 109.5° |
| C21 | C23 | H26 | 109.5° | 109.4° |
| C21 | C23 | H25 | 109.5° | 109.5° |
| C10 | N2 | C24 | 118.9° | 121.0° |
| N2 | C24 | N3 | 127.9° | 122.7° |
| N2 | C24 | H27 | 116.0° | 118.6° |
| C24 | N3 | C25 | 112.8° | 120.8° |
| N3 | C24 | H27 | 116.0° | 118.6° |
| N3 | C25 | C9 | 125.7° | 118.5° |
| N3 | C25 | N4 | 125.9° | 134.1° |
| C9 | C25 | N4 | 108.4° | 107.4° |
| C25 | N4 | C7 | 108.4° | 109.9° |
| C25 | N4 | H1 | 125.8° | 125.0° |
| C7 | N4 | H1 | 125.8° | 125.1° |
| C6 | C26 | C2 | 120.0° | 119.7° |
| C6 | C26 | H28 | 120.0° | 120.2° |
| C2 | C26 | H28 | 120.0° | 120.1° |
| H18 | C20 | H19 | 109.5° | 108.4° |
| H21 | C22 | H22 | 109.4° | 109.4° |
| H21 | C22 | H23 | 109.5° | 109.5° |
| H22 | C22 | H23 | 109.5° | 109.4° |
| H15 | C18 | H14 | 109.5° | 109.9° |
| H16 | C19 | H17 | 109.5° | 109.6° |
| H24 | C23 | H26 | 109.5° | 109.5° |
| H24 | C23 | H25 | 109.5° | 109.5° |
| H26 | C23 | H25 | 109.4° | 109.4° |
| H4 | C | H2 | 109.5° | 109.5° |
| H4 | C | H3 | 109.4° | 109.5° |
| H2 | C | H3 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | N | C1 | H5 | 180.0° | 180.0° |
| C | N | C1 | O | 5.0° | 0.0° |
| C | N | C1 | C2 | 174.9° | 180.0° |
| N | C | H4 | H2 | 120.0° | 120.0° |
| N | C | H4 | H3 | 120.0° | 120.0° |
| N | C | H2 | H3 | 120.0° | 120.0° |
| N | C1 | O | C2 | 179.9° | 180.0° |
| N | C1 | C2 | C3 | 152.4° | 0.0° |
| N | C1 | C2 | C26 | 34.9° | 179.5° |
| C1 | N | C | H4 | 180.0° | 60.0° |
| C1 | N | C | H2 | 60.0° | 60.0° |
| C1 | N | C | H3 | 60.0° | 180.0° |
| O | C1 | C2 | C3 | 27.5° | 180.0° |
| O | C1 | C2 | C26 | 145.3° | 0.5° |
| O | C1 | N | H5 | 175.0° | 180.0° |
| C1 | C2 | C3 | C26 | 172.9° | 179.5° |
| C1 | C2 | C3 | C4 | 172.1° | 179.9° |
| C1 | C2 | C26 | C6 | 172.4° | 179.7° |
| C1 | C2 | C26 | H28 | 7.6° | 0.2° |
| C1 | C2 | C3 | H6 | 7.8° | 0.5° |
| C2 | C1 | N | H5 | 5.1° | 0.0° |
| C2 | C3 | C4 | H6 | 180.0° | 179.4° |
| C2 | C3 | C4 | C5 | 0.5° | 0.6° |
| C3 | C2 | C26 | C6 | 0.2° | 0.2° |
| C2 | C3 | C4 | H7 | 179.5° | 179.7° |
| C3 | C2 | C26 | H28 | 179.8° | 179.8° |
| C3 | C4 | C5 | H7 | 180.0° | 179.6° |
| C3 | C4 | C5 | C6 | 2.3° | 0.4° |
| C4 | C3 | C2 | C26 | 0.8° | 0.5° |
| C3 | C4 | C5 | H8 | 177.7° | 179.8° |
| C4 | C5 | C6 | H8 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 177.9° | 179.9° |
| C4 | C5 | C6 | C26 | 2.8° | 0.0° |
| C5 | C4 | C3 | H6 | 179.5° | 180.0° |
| C5 | C6 | C7 | C26 | 179.3° | 179.9° |
| C5 | C6 | C7 | C8 | 6.8° | 0.1° |
| C5 | C6 | C7 | N4 | 177.2° | 180.0° |
| C5 | C6 | C26 | C2 | 1.5° | 0.1° |
| C6 | C5 | C4 | H7 | 177.7° | 180.0° |
| C5 | C6 | C26 | H28 | 178.4° | 180.0° |
| C6 | C7 | C8 | N4 | 176.5° | 179.9° |
| C6 | C7 | C8 | C9 | 176.6° | 179.9° |
| C6 | C7 | N4 | C25 | 176.6° | 179.9° |
| C7 | C6 | C26 | C2 | 179.2° | 180.0° |
| C7 | C6 | C5 | H8 | 2.1° | 0.0° |
| C6 | C7 | C8 | H9 | 3.4° | 0.1° |
| C7 | C6 | C26 | H28 | 0.8° | 0.1° |
| C6 | C7 | N4 | H1 | 3.4° | 0.0° |
| C7 | C8 | C9 | H9 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 179.3° | 180.0° |
| C7 | C8 | C9 | C25 | 0.4° | 0.0° |
| C8 | C7 | N4 | C25 | 0.1° | 0.0° |
| C8 | C7 | C6 | C26 | 174.0° | 180.0° |
| C8 | C7 | N4 | H1 | 179.8° | 179.9° |
| C8 | C9 | C10 | C25 | 178.8° | 179.9° |
| C8 | C9 | C10 | N1 | 6.3° | 0.0° |
| C8 | C9 | C10 | N2 | 178.7° | 179.9° |
| C8 | C9 | C25 | N3 | 179.8° | 180.0° |
| C8 | C9 | C25 | N4 | 0.5° | 0.0° |
| C9 | C8 | C7 | N4 | 0.2° | 0.0° |
| C9 | C10 | N1 | N2 | 174.9° | 180.0° |
| C9 | C10 | N1 | C11 | 166.8° | 180.0° |
| C9 | C10 | N2 | C24 | 1.4° | 0.1° |
| C10 | C9 | C25 | N3 | 1.1° | 0.0° |
| C10 | C9 | C25 | N4 | 179.7° | 180.0° |
| C9 | C10 | N1 | H10 | 71.1° | 0.3° |
| C10 | C9 | C8 | H9 | 0.7° | 0.1° |
| C10 | N1 | C11 | H10 | 122.1° | 179.7° |
| C10 | N1 | C11 | C12 | 89.0° | 155.2° |
| C10 | N1 | C11 | C21 | 145.4° | 84.7° |
| N1 | C10 | N2 | C24 | 173.7° | 180.0° |
| N1 | C10 | C9 | C25 | 172.5° | 180.0° |
| C10 | N1 | C11 | H | 28.5° | 35.3° |
| N1 | C11 | C12 | C21 | 123.8° | 120.0° |
| N1 | C11 | C12 | H | 118.0° | 120.0° |
| N1 | C11 | C12 | C13 | 126.3° | 40.1° |
| N1 | C11 | C12 | C17 | 53.5° | 140.0° |
| N1 | C11 | C21 | H | 117.7° | 119.9° |
| N1 | C11 | C21 | C22 | 177.6° | 175.0° |
| N1 | C11 | C21 | C23 | 58.0° | 65.1° |
| C11 | N1 | C10 | N2 | 18.2° | 0.0° |
| N1 | C11 | C21 | H20 | 59.8° | 55.0° |
| C11 | C12 | C13 | C17 | 179.8° | 180.0° |
| C11 | C12 | C13 | C14 | 177.2° | 179.6° |
| C11 | C12 | C17 | C16 | 178.9° | 179.4° |
| C12 | C11 | C21 | H | 118.3° | 120.0° |
| C12 | C11 | C21 | C22 | 53.6° | 65.0° |
| C12 | C11 | C21 | C23 | 178.0° | 55.0° |
| C12 | C11 | N1 | H10 | 149.0° | 25.0° |
| C11 | C12 | C13 | H11 | 2.8° | 0.6° |
| C11 | C12 | C17 | H13 | 1.1° | 0.2° |
| C12 | C11 | C21 | H20 | 64.2° | 175.0° |
| C12 | C13 | C14 | H11 | 180.0° | 179.7° |
| C12 | C13 | C14 | C15 | 3.5° | 0.3° |
| C13 | C12 | C17 | C16 | 0.8° | 0.5° |
| C13 | C12 | C11 | C21 | 109.9° | 80.0° |
| C13 | C12 | C17 | H13 | 179.1° | 179.7° |
| C12 | C13 | C14 | H12 | 176.5° | 179.7° |
| C13 | C12 | C11 | H | 8.2° | 160.0° |
| C13 | C14 | C15 | H12 | 180.0° | 179.9° |
| C13 | C14 | C15 | C16 | 2.4° | 0.8° |
| C14 | C13 | C12 | C17 | 2.6° | 0.3° |
| C13 | C14 | C15 | C20 | 175.7° | 178.3° |
| C14 | C15 | C16 | C20 | 178.0° | 179.0° |
| C14 | C15 | C16 | C17 | 0.7° | 0.6° |
| C14 | C15 | C16 | S | 175.1° | 178.6° |
| C14 | C15 | C20 | C19 | 156.6° | 156.3° |
| C15 | C14 | C13 | H11 | 176.5° | 179.9° |
| C14 | C15 | C20 | H18 | 82.9° | 82.7° |
| C14 | C15 | C20 | H19 | 36.0° | 35.1° |
| C15 | C16 | C17 | S | 176.0° | 179.2° |
| C15 | C16 | C17 | C12 | 0.1° | 0.1° |
| C15 | C16 | S | O1 | 132.2° | 103.4° |
| C15 | C16 | S | O2 | 100.4° | 128.5° |
| C15 | C16 | S | C18 | 15.5° | 12.5° |
| C16 | C15 | C20 | C19 | 25.5° | 24.7° |
| C15 | C16 | C17 | H13 | 180.0° | 179.3° |
| C16 | C15 | C20 | H18 | 95.0° | 96.4° |
| C16 | C15 | C20 | H19 | 146.0° | 145.8° |
| C16 | C15 | C14 | H12 | 177.6° | 179.3° |
| C16 | C17 | C12 | H13 | 180.0° | 179.2° |
| C17 | C16 | S | O1 | 51.8° | 75.9° |
| C17 | C16 | S | O2 | 75.6° | 52.3° |
| C17 | C16 | S | C18 | 168.5° | 168.2° |
| C17 | C16 | C15 | C20 | 177.3° | 178.5° |
| C12 | C17 | C16 | S | 176.1° | 179.3° |
| C17 | C12 | C11 | C21 | 70.4° | 100.0° |
| C17 | C12 | C13 | H11 | 177.5° | 179.4° |
| C17 | C12 | C11 | H | 171.5° | 20.0° |
| C16 | S | O1 | O2 | 122.0° | 117.1° |
| C16 | S | O1 | C18 | 112.4° | 111.0° |
| C16 | S | O2 | C18 | 112.0° | 110.9° |
| C16 | S | C18 | C19 | 44.8° | 44.9° |
| S | C16 | C15 | C20 | 6.9° | 2.3° |
| S | C16 | C17 | H13 | 3.9° | 1.5° |
| C16 | S | C18 | H15 | 75.5° | 164.3° |
| C16 | S | C18 | H14 | 165.0° | 74.5° |
| O1 | S | O2 | C18 | 125.9° | 131.9° |
| O1 | S | C18 | C19 | 160.2° | 66.6° |
| O1 | S | C18 | H15 | 39.9° | 52.8° |
| O1 | S | C18 | H14 | 79.6° | 174.0° |
| O2 | S | C18 | C19 | 70.1° | 156.3° |
| O2 | S | C18 | H15 | 169.7° | 84.3° |
| O2 | S | C18 | H14 | 50.2° | 36.9° |
| S | C18 | C19 | H15 | 120.2° | 119.4° |
| S | C18 | C19 | H14 | 120.2° | 119.4° |
| S | C18 | C19 | C20 | 68.7° | 71.3° |
| S | C18 | H15 | H14 | 119.2° | 121.2° |
| S | C18 | C19 | H16 | 171.1° | 168.8° |
| S | C18 | C19 | H17 | 51.5° | 48.5° |
| C18 | C19 | C20 | H16 | 120.2° | 119.9° |
| C18 | C19 | C20 | H17 | 120.2° | 119.8° |
| C18 | C19 | C20 | C15 | 56.8° | 61.5° |
| C18 | C19 | C20 | H18 | 63.7° | 59.6° |
| C18 | C19 | C20 | H19 | 177.4° | 177.3° |
| C19 | C18 | H15 | H14 | 119.2° | 121.2° |
| C18 | C19 | H16 | H17 | 119.4° | 120.2° |
| C19 | C20 | C15 | H18 | 120.5° | 121.1° |
| C19 | C20 | C15 | H19 | 120.5° | 121.1° |
| C19 | C20 | H18 | H19 | 118.3° | 117.8° |
| C20 | C19 | C18 | H15 | 51.5° | 169.2° |
| C20 | C19 | C18 | H14 | 171.0° | 48.1° |
| C20 | C19 | H16 | H17 | 119.4° | 120.2° |
| C15 | C20 | H18 | H19 | 118.3° | 117.9° |
| C15 | C20 | C19 | H16 | 177.1° | 178.6° |
| C15 | C20 | C19 | H17 | 63.3° | 58.3° |
| C20 | C15 | C14 | H12 | 4.3° | 1.6° |
| C11 | C21 | C22 | C23 | 124.9° | 119.9° |
| C11 | C21 | C22 | H20 | 117.6° | 120.1° |
| C11 | C21 | C23 | H20 | 117.7° | 120.1° |
| C21 | C11 | N1 | H10 | 23.4° | 95.1° |
| C11 | C21 | C22 | H21 | 180.0° | 59.9° |
| C11 | C21 | C22 | H22 | 60.0° | 60.1° |
| C11 | C21 | C22 | H23 | 60.0° | 180.0° |
| C11 | C21 | C23 | H24 | 180.0° | 60.0° |
| C11 | C21 | C23 | H26 | 60.0° | 180.0° |
| C11 | C21 | C23 | H25 | 60.0° | 60.1° |
| C22 | C21 | C23 | H20 | 117.5° | 120.0° |
| C21 | C22 | H21 | H22 | 120.0° | 120.0° |
| C21 | C22 | H21 | H23 | 120.0° | 120.1° |
| C21 | C22 | H22 | H23 | 120.0° | 120.0° |
| C22 | C21 | C11 | H | 64.7° | 55.1° |
| C22 | C21 | C23 | H24 | 55.2° | 60.0° |
| C22 | C21 | C23 | H26 | 64.8° | 60.1° |
| C22 | C21 | C23 | H25 | 175.2° | 180.0° |
| C23 | C21 | C22 | H21 | 55.1° | 60.0° |
| C23 | C21 | C22 | H22 | 175.0° | 180.0° |
| C23 | C21 | C22 | H23 | 65.0° | 60.0° |
| C23 | C21 | C11 | H | 59.7° | 175.0° |
| C21 | C23 | H24 | H26 | 120.0° | 120.0° |
| C21 | C23 | H24 | H25 | 120.0° | 120.0° |
| C21 | C23 | H26 | H25 | 120.0° | 120.0° |
| C10 | N2 | C24 | N3 | 1.5° | 0.0° |
| N2 | C10 | C9 | C25 | 2.5° | 0.0° |
| N2 | C10 | N1 | H10 | 103.8° | 179.7° |
| C10 | N2 | C24 | H27 | 178.4° | 179.9° |
| N2 | C24 | N3 | H27 | 180.0° | 180.0° |
| N2 | C24 | N3 | C25 | 2.9° | 0.0° |
| C24 | N3 | C25 | C9 | 1.4° | 0.0° |
| C24 | N3 | C25 | N4 | 177.7° | 180.0° |
| N3 | C25 | C9 | N4 | 179.3° | 180.0° |
| N3 | C25 | N4 | C7 | 179.7° | 180.0° |
| C25 | N3 | C24 | H27 | 177.1° | 180.0° |
| N3 | C25 | N4 | H1 | 0.3° | 0.0° |
| C9 | C25 | N4 | C7 | 0.4° | 0.0° |
| C25 | C9 | C8 | H9 | 179.6° | 180.0° |
| C9 | C25 | N4 | H1 | 179.6° | 179.9° |
| C25 | N4 | C7 | H1 | 180.0° | 180.0° |
| N4 | C7 | C6 | C26 | 2.1° | 0.1° |
| N4 | C7 | C8 | H9 | 179.8° | 180.0° |
| C6 | C26 | C2 | H28 | 180.0° | 179.9° |
| C26 | C6 | C5 | H8 | 177.2° | 179.9° |
| C26 | C2 | C3 | H6 | 179.3° | 179.9° |
| H10 | N1 | C11 | H | 93.6° | 145.0° |
| H7 | C4 | C5 | H8 | 2.4° | 0.1° |
| H7 | C4 | C3 | H6 | 0.6° | 0.3° |
| H11 | C13 | C14 | H12 | 3.5° | 0.0° |
| H18 | C20 | C19 | H16 | 56.5° | 60.3° |
| H18 | C20 | C19 | H17 | 176.1° | 179.4° |
| H19 | C20 | C19 | H16 | 62.4° | 57.4° |
| H19 | C20 | C19 | H17 | 57.2° | 62.8° |
| H20 | C21 | C22 | H21 | 62.4° | 180.0° |
| H20 | C21 | C22 | H22 | 57.6° | 60.0° |
| H20 | C21 | C22 | H23 | 177.6° | 60.0° |
| H20 | C21 | C11 | H | 177.5° | 65.0° |
| H20 | C21 | C23 | H24 | 62.3° | 180.0° |
| H20 | C21 | C23 | H26 | 177.7° | 60.0° |
| H20 | C21 | C23 | H25 | 57.7° | 60.0° |
| H21 | C22 | H22 | H23 | 120.0° | 120.0° |
| H15 | C18 | C19 | H16 | 68.7° | 49.3° |
| H15 | C18 | C19 | H17 | 171.7° | 71.0° |
| H14 | C18 | C19 | H16 | 50.8° | 71.8° |
| H14 | C18 | C19 | H17 | 68.8° | 167.9° |
| H24 | C23 | H26 | H25 | 120.0° | 120.0° |
| H5 | N | C | H4 | 0.0° | 120.0° |
| H5 | N | C | H2 | 120.0° | 120.0° |
| H5 | N | C | H3 | 120.0° | 0.0° |
| H4 | C | H2 | H3 | 120.0° | 120.1° |
