A1IKH
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | N | sing | 1.46Å | 1.47Å | |
| C1 | N | sing | 1.47Å | 1.47Å | |
| N | S | sing | 1.66Å | 1.62Å | |
| C3 | C4 | doub | 1.38Å | 1.38Å | Aromatic |
| C3 | C2 | sing | 1.39Å | 1.38Å | Aromatic |
| S | O | doub | 1.42Å | 1.43Å | |
| S | C2 | sing | 1.76Å | 1.76Å | |
| S | O1 | doub | 1.42Å | 1.43Å | |
| C4 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C2 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.55Å | 1.51Å | |
| C6 | N1 | sing | 1.48Å | 1.47Å | |
| C8 | C7 | sing | 1.55Å | 1.49Å | |
| C8 | C9 | sing | 1.54Å | 1.51Å | |
| C5 | N1 | sing | 1.39Å | 1.41Å | |
| C5 | C10 | doub | 1.40Å | 1.41Å | Aromatic |
| C11 | C10 | sing | 1.40Å | 1.39Å | Aromatic |
| N1 | C9 | sing | 1.47Å | 1.46Å | |
| C10 | C12 | sing | 1.47Å | 1.50Å | |
| O2 | C12 | doub | 1.22Å | 1.21Å | |
| C12 | N2 | sing | 1.35Å | 1.35Å | |
| N2 | C16 | sing | 1.47Å | 1.46Å | |
| N2 | C13 | sing | 1.47Å | 1.46Å | |
| C16 | C15 | sing | 1.53Å | 1.52Å | |
| C13 | C14 | sing | 1.53Å | 1.51Å | |
| C15 | N3 | sing | 1.47Å | 1.47Å | |
| C14 | N3 | sing | 1.47Å | 1.46Å | |
| N3 | C17 | sing | 1.40Å | 1.41Å | |
| C17 | C24 | doub | 1.39Å | 1.39Å | Aromatic |
| C17 | C18 | sing | 1.39Å | 1.40Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.38Å | Aromatic |
| C19 | C18 | sing | 1.51Å | 1.51Å | |
| C18 | C20 | doub | 1.38Å | 1.40Å | Aromatic |
| C23 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.51Å | 1.51Å | |
| C7 | H1 | sing | 1.09Å | 1.10Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C8 | H3 | sing | 1.09Å | 1.10Å | |
| C8 | H4 | sing | 1.09Å | 1.10Å | |
| C9 | H5 | sing | 1.09Å | 1.10Å | |
| C9 | H6 | sing | 1.09Å | 1.10Å | |
| C1 | H7 | sing | 1.09Å | 1.10Å | |
| C1 | H8 | sing | 1.09Å | 1.10Å | |
| C1 | H9 | sing | 1.09Å | 1.10Å | |
| C6 | H10 | sing | 1.09Å | 1.10Å | |
| C6 | H11 | sing | 1.09Å | 1.10Å | |
| C4 | H12 | sing | 1.08Å | 1.08Å | |
| C3 | H13 | sing | 1.08Å | 1.08Å | |
| C | H14 | sing | 1.09Å | 1.10Å | |
| C | H15 | sing | 1.09Å | 1.10Å | |
| C | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.08Å | 1.08Å | |
| C13 | H18 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C14 | H21 | sing | 1.09Å | 1.10Å | |
| C15 | H22 | sing | 1.09Å | 1.10Å | |
| C15 | H23 | sing | 1.09Å | 1.10Å | |
| C16 | H24 | sing | 1.09Å | 1.10Å | |
| C16 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| C21 | H29 | sing | 1.09Å | 1.10Å | |
| C21 | H30 | sing | 1.09Å | 1.10Å | |
| C21 | H31 | sing | 1.09Å | 1.10Å | |
| C22 | H32 | sing | 1.08Å | 1.08Å | |
| C23 | H33 | sing | 1.08Å | 1.08Å | |
| C24 | H34 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | N | C1 | 115.0° | 120.0° |
| C | N | S | 117.3° | 120.0° |
| N | C | H14 | 109.5° | 109.5° |
| N | C | H15 | 109.5° | 109.5° |
| N | C | H16 | 109.5° | 109.5° |
| C1 | N | S | 117.1° | 120.0° |
| N | C1 | H7 | 109.5° | 109.5° |
| N | C1 | H8 | 109.5° | 109.4° |
| N | C1 | H9 | 109.5° | 109.4° |
| N | S | O | 106.8° | 106.4° |
| N | S | C2 | 106.7° | 107.2° |
| N | S | O1 | 106.8° | 106.4° |
| C4 | C3 | C2 | 119.3° | 120.4° |
| C3 | C4 | C5 | 120.8° | 120.1° |
| C3 | C4 | H12 | 119.6° | 120.0° |
| C4 | C3 | H13 | 120.4° | 119.8° |
| C3 | C2 | S | 119.9° | 119.8° |
| C3 | C2 | C11 | 120.9° | 120.3° |
| C2 | C3 | H13 | 120.3° | 119.8° |
| O | S | C2 | 108.0° | 106.4° |
| O | S | O1 | 119.8° | 123.1° |
| C2 | S | O1 | 108.0° | 106.4° |
| S | C2 | C11 | 119.2° | 119.9° |
| C4 | C5 | N1 | 121.6° | 120.2° |
| C4 | C5 | C10 | 119.8° | 119.6° |
| C5 | C4 | H12 | 119.6° | 119.9° |
| C2 | C11 | C10 | 120.3° | 120.0° |
| C2 | C11 | H17 | 119.9° | 120.0° |
| C7 | C6 | N1 | 103.6° | 104.8° |
| C6 | C7 | C8 | 103.8° | 101.7° |
| C6 | C7 | H1 | 110.9° | 111.0° |
| C6 | C7 | H2 | 110.9° | 111.0° |
| C7 | C6 | H10 | 110.9° | 110.4° |
| C7 | C6 | H11 | 110.9° | 110.4° |
| C6 | N1 | C5 | 121.6° | 111.0° |
| C6 | N1 | C9 | 111.0° | 108.6° |
| N1 | C6 | H10 | 110.9° | 110.4° |
| N1 | C6 | H11 | 110.9° | 110.3° |
| C7 | C8 | C9 | 103.9° | 103.0° |
| C8 | C7 | H1 | 110.9° | 111.0° |
| C8 | C7 | H2 | 110.9° | 111.0° |
| C7 | C8 | H3 | 110.8° | 110.8° |
| C7 | C8 | H4 | 110.8° | 110.7° |
| C8 | C9 | N1 | 103.5° | 107.2° |
| C9 | C8 | H3 | 110.9° | 110.7° |
| C9 | C8 | H4 | 110.8° | 110.7° |
| C8 | C9 | H5 | 110.9° | 109.9° |
| C8 | C9 | H6 | 110.9° | 109.9° |
| N1 | C5 | C10 | 118.7° | 120.2° |
| C5 | N1 | C9 | 120.4° | 111.0° |
| C5 | C10 | C11 | 119.0° | 119.6° |
| C5 | C10 | C12 | 122.7° | 120.2° |
| C11 | C10 | C12 | 118.3° | 120.2° |
| C10 | C11 | H17 | 119.9° | 120.0° |
| N1 | C9 | H5 | 111.0° | 109.9° |
| N1 | C9 | H6 | 110.9° | 109.9° |
| C10 | C12 | O2 | 119.7° | 120.0° |
| C10 | C12 | N2 | 118.3° | 120.0° |
| O2 | C12 | N2 | 122.0° | 120.0° |
| C12 | N2 | C16 | 125.8° | 120.8° |
| C12 | N2 | C13 | 122.2° | 120.9° |
| C16 | N2 | C13 | 111.9° | 118.2° |
| N2 | C16 | C15 | 110.2° | 108.5° |
| N2 | C16 | H24 | 109.3° | 109.7° |
| N2 | C16 | H25 | 109.3° | 109.6° |
| N2 | C13 | C14 | 109.9° | 108.5° |
| N2 | C13 | H18 | 109.4° | 109.6° |
| N2 | C13 | H19 | 109.4° | 109.6° |
| C16 | C15 | N3 | 111.4° | 109.4° |
| C16 | C15 | H22 | 109.0° | 109.5° |
| C16 | C15 | H23 | 109.0° | 109.5° |
| C15 | C16 | H24 | 109.3° | 109.6° |
| C15 | C16 | H25 | 109.3° | 109.6° |
| C13 | C14 | N3 | 110.9° | 109.4° |
| C14 | C13 | H18 | 109.4° | 109.6° |
| C14 | C13 | H19 | 109.4° | 109.6° |
| C13 | C14 | H20 | 109.1° | 109.5° |
| C13 | C14 | H21 | 109.1° | 109.5° |
| C15 | N3 | C14 | 113.9° | 111.2° |
| C15 | N3 | C17 | 118.8° | 111.0° |
| N3 | C15 | H22 | 109.0° | 109.5° |
| N3 | C15 | H23 | 109.0° | 109.5° |
| C14 | N3 | C17 | 117.4° | 111.0° |
| N3 | C14 | H20 | 109.1° | 109.5° |
| N3 | C14 | H21 | 109.1° | 109.5° |
| N3 | C17 | C24 | 122.7° | 120.1° |
| N3 | C17 | C18 | 115.4° | 120.1° |
| C24 | C17 | C18 | 121.9° | 119.8° |
| C17 | C24 | C23 | 118.7° | 119.9° |
| C17 | C24 | H34 | 120.6° | 120.0° |
| C17 | C18 | C19 | 121.4° | 120.0° |
| C17 | C18 | C20 | 118.5° | 119.9° |
| C24 | C23 | C22 | 120.2° | 120.1° |
| C24 | C23 | H33 | 119.9° | 120.0° |
| C23 | C24 | H34 | 120.6° | 120.1° |
| C19 | C18 | C20 | 120.1° | 120.1° |
| C18 | C19 | H26 | 109.5° | 109.5° |
| C18 | C19 | H27 | 109.5° | 109.5° |
| C18 | C19 | H28 | 109.5° | 109.5° |
| C18 | C20 | C22 | 119.3° | 120.1° |
| C18 | C20 | C21 | 121.2° | 120.0° |
| C23 | C22 | C20 | 121.3° | 120.1° |
| C23 | C22 | H32 | 119.4° | 119.9° |
| C22 | C23 | H33 | 119.9° | 119.9° |
| C22 | C20 | C21 | 119.5° | 119.9° |
| C20 | C22 | H32 | 119.4° | 119.9° |
| C20 | C21 | H29 | 109.5° | 109.5° |
| C20 | C21 | H30 | 109.4° | 109.5° |
| C20 | C21 | H31 | 109.5° | 109.4° |
| H1 | C7 | H2 | 109.5° | 110.9° |
| H3 | C8 | H4 | 109.5° | 110.7° |
| H5 | C9 | H6 | 109.5° | 110.0° |
| H7 | C1 | H8 | 109.5° | 109.5° |
| H7 | C1 | H9 | 109.5° | 109.5° |
| H8 | C1 | H9 | 109.4° | 109.5° |
| H10 | C6 | H11 | 109.5° | 110.4° |
| H14 | C | H15 | 109.5° | 109.5° |
| H14 | C | H16 | 109.5° | 109.4° |
| H15 | C | H16 | 109.4° | 109.5° |
| H18 | C13 | H19 | 109.4° | 109.8° |
| H20 | C14 | H21 | 109.5° | 109.5° |
| H22 | C15 | H23 | 109.5° | 109.5° |
| H24 | C16 | H25 | 109.5° | 109.8° |
| H26 | C19 | H27 | 109.5° | 109.5° |
| H26 | C19 | H28 | 109.5° | 109.5° |
| H27 | C19 | H28 | 109.5° | 109.4° |
| H29 | C21 | H30 | 109.5° | 109.5° |
| H29 | C21 | H31 | 109.5° | 109.5° |
| H30 | C21 | H31 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | N | C1 | S | 143.8° | 180.0° |
| C | N | S | O | 32.0° | 23.6° |
| C | N | S | C2 | 83.4° | 90.0° |
| C | N | S | O1 | 161.3° | 156.5° |
| C | N | C1 | H7 | 180.0° | 90.0° |
| C | N | C1 | H8 | 60.0° | 30.0° |
| C | N | C1 | H9 | 60.0° | 150.0° |
| N | C | H14 | H15 | 120.0° | 120.0° |
| N | C | H14 | H16 | 120.0° | 120.0° |
| N | C | H15 | H16 | 120.0° | 120.0° |
| C1 | N | S | O | 175.0° | 156.4° |
| C1 | N | S | C2 | 59.6° | 90.0° |
| C1 | N | S | O1 | 55.7° | 23.5° |
| N | C1 | H7 | H8 | 120.0° | 120.0° |
| N | C1 | H7 | H9 | 120.0° | 120.0° |
| N | C1 | H8 | H9 | 120.0° | 120.0° |
| C1 | N | C | H14 | 180.0° | 0.0° |
| C1 | N | C | H15 | 60.0° | 120.0° |
| C1 | N | C | H16 | 60.0° | 120.0° |
| N | S | C2 | C3 | 62.5° | 90.0° |
| N | S | O | C2 | 114.5° | 114.1° |
| N | S | O | O1 | 121.4° | 123.0° |
| N | S | C2 | O1 | 114.5° | 113.5° |
| N | S | C2 | C11 | 118.0° | 90.0° |
| S | N | C1 | H7 | 36.2° | 90.0° |
| S | N | C1 | H8 | 83.9° | 150.0° |
| S | N | C1 | H9 | 156.2° | 30.0° |
| S | N | C | H14 | 36.2° | 180.0° |
| S | N | C | H15 | 156.2° | 60.0° |
| S | N | C | H16 | 83.8° | 60.0° |
| C4 | C3 | C2 | H13 | 180.0° | 180.0° |
| C4 | C3 | C2 | S | 179.7° | 180.0° |
| C3 | C4 | C5 | H12 | 180.0° | 179.9° |
| C4 | C3 | C2 | C11 | 0.2° | 0.0° |
| C3 | C4 | C5 | N1 | 179.2° | 180.0° |
| C3 | C4 | C5 | C10 | 0.3° | 0.2° |
| C3 | C2 | S | O | 52.0° | 23.6° |
| C3 | C2 | S | C11 | 179.4° | 180.0° |
| C3 | C2 | S | O1 | 177.0° | 156.5° |
| C2 | C3 | C4 | C5 | 0.1° | 0.0° |
| C3 | C2 | C11 | C10 | 0.0° | 0.3° |
| C2 | C3 | C4 | H12 | 180.0° | 180.0° |
| C3 | C2 | C11 | H17 | 180.0° | 180.0° |
| O | S | C2 | O1 | 131.0° | 132.9° |
| O | S | C2 | C11 | 127.4° | 156.4° |
| S | C2 | C11 | C10 | 179.4° | 179.7° |
| S | C2 | C3 | H13 | 0.3° | 0.0° |
| S | C2 | C11 | H17 | 0.5° | 0.0° |
| O1 | S | C2 | C11 | 3.6° | 23.5° |
| C4 | C5 | N1 | C6 | 106.6° | 61.0° |
| C4 | C5 | N1 | C10 | 179.5° | 179.8° |
| C4 | C5 | C10 | C11 | 0.5° | 0.5° |
| C4 | C5 | N1 | C9 | 41.3° | 59.8° |
| C4 | C5 | C10 | C12 | 180.0° | 179.8° |
| C5 | C4 | C3 | H13 | 179.9° | 180.0° |
| C2 | C11 | C10 | C5 | 0.4° | 0.5° |
| C2 | C11 | C10 | H17 | 180.0° | 179.7° |
| C2 | C11 | C10 | C12 | 179.9° | 179.8° |
| C11 | C2 | C3 | H13 | 179.8° | 180.0° |
| C7 | C6 | N1 | H10 | 119.1° | 118.9° |
| C7 | C6 | N1 | H11 | 119.0° | 118.8° |
| C6 | C7 | C8 | H1 | 119.1° | 118.1° |
| C6 | C7 | C8 | H2 | 119.1° | 118.1° |
| C6 | C7 | C8 | C9 | 38.3° | 35.7° |
| C7 | C6 | N1 | C5 | 162.1° | 146.4° |
| C7 | C6 | N1 | C9 | 11.6° | 24.1° |
| C6 | C7 | H1 | H2 | 122.6° | 123.9° |
| C6 | C7 | C8 | H3 | 80.9° | 82.7° |
| C6 | C7 | C8 | H4 | 157.4° | 154.1° |
| C7 | C6 | H10 | H11 | 122.8° | 122.3° |
| N1 | C6 | C7 | C8 | 30.6° | 37.1° |
| C6 | N1 | C9 | C8 | 11.7° | 1.0° |
| C6 | N1 | C5 | C9 | 147.9° | 120.9° |
| C6 | N1 | C5 | C10 | 72.9° | 119.2° |
| N1 | C6 | C7 | H1 | 149.7° | 81.0° |
| N1 | C6 | C7 | H2 | 88.5° | 155.2° |
| C6 | N1 | C9 | H5 | 130.7° | 120.4° |
| C6 | N1 | C9 | H6 | 107.3° | 118.4° |
| N1 | C6 | H10 | H11 | 122.7° | 122.3° |
| C7 | C8 | C9 | H3 | 119.1° | 118.4° |
| C7 | C8 | C9 | H4 | 119.1° | 118.4° |
| C7 | C8 | C9 | N1 | 30.7° | 22.3° |
| C8 | C7 | H1 | H2 | 122.6° | 123.8° |
| C7 | C8 | H3 | H4 | 122.5° | 123.2° |
| C7 | C8 | C9 | H5 | 149.8° | 97.1° |
| C7 | C8 | C9 | H6 | 88.3° | 141.7° |
| C8 | C7 | C6 | H10 | 149.7° | 81.7° |
| C8 | C7 | C6 | H11 | 88.4° | 155.9° |
| C8 | C9 | N1 | C5 | 139.3° | 123.2° |
| C8 | C9 | N1 | H5 | 119.0° | 119.5° |
| C8 | C9 | N1 | H6 | 119.0° | 119.3° |
| C9 | C8 | C7 | H1 | 157.4° | 82.4° |
| C9 | C8 | C7 | H2 | 80.8° | 153.8° |
| C9 | C8 | H3 | H4 | 122.6° | 123.1° |
| C8 | C9 | H5 | H6 | 122.8° | 121.1° |
| N1 | C5 | C10 | C11 | 179.0° | 179.7° |
| N1 | C5 | C10 | C12 | 0.5° | 0.0° |
| C5 | N1 | C9 | H5 | 20.3° | 117.3° |
| C5 | N1 | C9 | H6 | 101.7° | 3.9° |
| C5 | N1 | C6 | H10 | 78.8° | 27.5° |
| C5 | N1 | C6 | H11 | 43.1° | 94.8° |
| N1 | C5 | C4 | H12 | 0.8° | 0.1° |
| C5 | C10 | C11 | C12 | 179.5° | 179.7° |
| C10 | C5 | N1 | C9 | 139.2° | 120.0° |
| C5 | C10 | C12 | O2 | 88.8° | 52.3° |
| C5 | C10 | C12 | N2 | 89.6° | 127.7° |
| C10 | C5 | C4 | H12 | 179.7° | 179.7° |
| C5 | C10 | C11 | H17 | 179.7° | 179.7° |
| C11 | C10 | C12 | O2 | 90.7° | 127.4° |
| C11 | C10 | C12 | N2 | 90.9° | 52.6° |
| N1 | C9 | C8 | H3 | 88.4° | 96.1° |
| N1 | C9 | C8 | H4 | 149.8° | 140.7° |
| N1 | C9 | H5 | H6 | 122.8° | 121.1° |
| C9 | N1 | C6 | H10 | 130.7° | 94.8° |
| C9 | N1 | C6 | H11 | 107.4° | 142.9° |
| C10 | C12 | O2 | N2 | 178.4° | 180.0° |
| C10 | C12 | N2 | C16 | 0.7° | 176.0° |
| C10 | C12 | N2 | C13 | 179.3° | 3.7° |
| C12 | C10 | C11 | H17 | 0.1° | 0.0° |
| O2 | C12 | N2 | C16 | 177.7° | 4.0° |
| O2 | C12 | N2 | C13 | 0.8° | 176.3° |
| C12 | N2 | C16 | C13 | 178.7° | 179.7° |
| C12 | N2 | C16 | C15 | 120.8° | 128.6° |
| C12 | N2 | C13 | C14 | 119.5° | 128.5° |
| C12 | N2 | C13 | H18 | 0.6° | 111.7° |
| C12 | N2 | C13 | H19 | 120.4° | 8.8° |
| C12 | N2 | C16 | H24 | 119.1° | 8.8° |
| C12 | N2 | C16 | H25 | 0.7° | 111.8° |
| N2 | C16 | C15 | H24 | 120.1° | 119.7° |
| N2 | C16 | C15 | H25 | 120.1° | 119.6° |
| C16 | N2 | C13 | C14 | 59.3° | 51.1° |
| N2 | C16 | C15 | N3 | 52.8° | 53.8° |
| C16 | N2 | C13 | H18 | 179.3° | 68.6° |
| C16 | N2 | C13 | H19 | 60.8° | 170.9° |
| N2 | C16 | C15 | H22 | 173.1° | 173.8° |
| N2 | C16 | C15 | H23 | 67.5° | 66.2° |
| N2 | C16 | H24 | H25 | 119.6° | 120.5° |
| C13 | N2 | C16 | C15 | 57.9° | 51.1° |
| N2 | C13 | C14 | H18 | 120.1° | 119.7° |
| N2 | C13 | C14 | H19 | 120.1° | 119.7° |
| N2 | C13 | C14 | N3 | 55.3° | 53.8° |
| N2 | C13 | H18 | H19 | 119.8° | 120.5° |
| N2 | C13 | C14 | H20 | 64.9° | 66.2° |
| N2 | C13 | C14 | H21 | 175.5° | 173.8° |
| C13 | N2 | C16 | H24 | 62.2° | 170.9° |
| C13 | N2 | C16 | H25 | 178.0° | 68.5° |
| C16 | C15 | N3 | H22 | 120.3° | 120.0° |
| C16 | C15 | N3 | H23 | 120.3° | 120.0° |
| C16 | C15 | N3 | C14 | 51.5° | 63.1° |
| C16 | C15 | N3 | C17 | 93.4° | 172.8° |
| C16 | C15 | H22 | H23 | 119.1° | 120.0° |
| C15 | C16 | H24 | H25 | 119.7° | 120.5° |
| C13 | C14 | N3 | C15 | 52.7° | 63.1° |
| C13 | C14 | N3 | H20 | 120.2° | 120.0° |
| C13 | C14 | N3 | H21 | 120.2° | 120.0° |
| C13 | C14 | N3 | C17 | 92.7° | 172.8° |
| C14 | C13 | H18 | H19 | 119.8° | 120.5° |
| C13 | C14 | H20 | H21 | 119.3° | 120.0° |
| C15 | N3 | C14 | C17 | 145.4° | 124.1° |
| C15 | N3 | C17 | C24 | 80.2° | 64.3° |
| C15 | N3 | C17 | C18 | 101.1° | 116.0° |
| C15 | N3 | C14 | H20 | 67.5° | 56.9° |
| C15 | N3 | C14 | H21 | 172.9° | 176.9° |
| N3 | C15 | H22 | H23 | 119.1° | 120.1° |
| N3 | C15 | C16 | H24 | 67.4° | 173.6° |
| N3 | C15 | C16 | H25 | 172.9° | 65.8° |
| C14 | N3 | C17 | C24 | 63.4° | 60.0° |
| C14 | N3 | C17 | C18 | 115.2° | 119.7° |
| N3 | C14 | C13 | H18 | 175.4° | 65.9° |
| N3 | C14 | C13 | H19 | 64.8° | 173.5° |
| N3 | C14 | H20 | H21 | 119.4° | 120.1° |
| C14 | N3 | C15 | H22 | 171.8° | 176.9° |
| C14 | N3 | C15 | H23 | 68.8° | 56.9° |
| N3 | C17 | C24 | C18 | 178.5° | 179.6° |
| N3 | C17 | C24 | C23 | 178.4° | 179.8° |
| N3 | C17 | C18 | C19 | 1.7° | 0.1° |
| N3 | C17 | C18 | C20 | 178.3° | 180.0° |
| C17 | N3 | C14 | H20 | 147.1° | 67.3° |
| C17 | N3 | C14 | H21 | 27.5° | 52.8° |
| C17 | N3 | C15 | H22 | 26.9° | 52.8° |
| C17 | N3 | C15 | H23 | 146.3° | 67.3° |
| N3 | C17 | C24 | H34 | 1.6° | 0.0° |
| C17 | C24 | C23 | H34 | 180.0° | 179.8° |
| C24 | C17 | C18 | C19 | 179.7° | 179.7° |
| C24 | C17 | C18 | C20 | 0.3° | 0.3° |
| C17 | C24 | C23 | C22 | 0.1° | 0.6° |
| C17 | C24 | C23 | H33 | 179.9° | 179.7° |
| C18 | C17 | C24 | C23 | 0.1° | 0.6° |
| C17 | C18 | C19 | C20 | 180.0° | 179.9° |
| C17 | C18 | C20 | C22 | 0.3° | 0.1° |
| C17 | C18 | C20 | C21 | 179.3° | 180.0° |
| C17 | C18 | C19 | H26 | 90.0° | 90.1° |
| C17 | C18 | C19 | H27 | 150.0° | 150.0° |
| C17 | C18 | C19 | H28 | 30.0° | 30.0° |
| C18 | C17 | C24 | H34 | 179.9° | 179.7° |
| C24 | C23 | C22 | H33 | 180.0° | 179.7° |
| C24 | C23 | C22 | C20 | 0.1° | 0.4° |
| C24 | C23 | C22 | H32 | 179.9° | 179.7° |
| C19 | C18 | C20 | C22 | 179.7° | 179.9° |
| C19 | C18 | C20 | C21 | 0.7° | 0.1° |
| C18 | C19 | H26 | H27 | 120.0° | 120.0° |
| C18 | C19 | H26 | H28 | 120.0° | 120.1° |
| C18 | C19 | H27 | H28 | 120.0° | 120.1° |
| C18 | C20 | C22 | C23 | 0.1° | 0.1° |
| C18 | C20 | C22 | C21 | 179.6° | 179.9° |
| C20 | C18 | C19 | H26 | 90.0° | 90.0° |
| C20 | C18 | C19 | H27 | 30.0° | 30.0° |
| C20 | C18 | C19 | H28 | 150.0° | 150.0° |
| C18 | C20 | C21 | H29 | 89.8° | 89.9° |
| C18 | C20 | C21 | H30 | 150.2° | 150.0° |
| C18 | C20 | C21 | H31 | 30.2° | 30.1° |
| C18 | C20 | C22 | H32 | 179.9° | 179.9° |
| C23 | C22 | C20 | H32 | 180.0° | 179.9° |
| C23 | C22 | C20 | C21 | 179.5° | 180.0° |
| C22 | C23 | C24 | H34 | 179.9° | 179.7° |
| C22 | C20 | C21 | H29 | 89.8° | 90.0° |
| C22 | C20 | C21 | H30 | 30.2° | 30.1° |
| C22 | C20 | C21 | H31 | 150.2° | 150.0° |
| C20 | C22 | C23 | H33 | 179.9° | 180.0° |
| C20 | C21 | H29 | H30 | 120.0° | 120.1° |
| C20 | C21 | H29 | H31 | 120.0° | 120.0° |
| C20 | C21 | H30 | H31 | 120.0° | 119.9° |
| C21 | C20 | C22 | H32 | 0.5° | 0.1° |
| H1 | C7 | C8 | H3 | 38.2° | 159.1° |
| H1 | C7 | C8 | H4 | 83.5° | 35.9° |
| H1 | C7 | C6 | H10 | 91.2° | 160.1° |
| H1 | C7 | C6 | H11 | 30.7° | 37.7° |
| H2 | C7 | C8 | H3 | 160.0° | 35.4° |
| H2 | C7 | C8 | H4 | 38.3° | 87.8° |
| H2 | C7 | C6 | H10 | 30.6° | 36.3° |
| H2 | C7 | C6 | H11 | 152.5° | 86.1° |
| H3 | C8 | C9 | H5 | 30.7° | 144.5° |
| H3 | C8 | C9 | H6 | 152.6° | 23.2° |
| H4 | C8 | C9 | H5 | 91.1° | 21.3° |
| H4 | C8 | C9 | H6 | 30.8° | 99.9° |
| H7 | C1 | H8 | H9 | 120.0° | 120.1° |
| H12 | C4 | C3 | H13 | 0.0° | 0.1° |
| H14 | C | H15 | H16 | 120.0° | 120.0° |
| H18 | C13 | C14 | H20 | 55.2° | 174.1° |
| H18 | C13 | C14 | H21 | 64.4° | 54.1° |
| H19 | C13 | C14 | H20 | 175.0° | 53.6° |
| H19 | C13 | C14 | H21 | 55.5° | 66.4° |
| H22 | C15 | C16 | H24 | 52.9° | 66.5° |
| H22 | C15 | C16 | H25 | 66.8° | 54.1° |
| H23 | C15 | C16 | H24 | 172.3° | 53.6° |
| H23 | C15 | C16 | H25 | 52.6° | 174.2° |
| H26 | C19 | H27 | H28 | 120.0° | 120.0° |
| H29 | C21 | H30 | H31 | 120.0° | 120.0° |
| H32 | C22 | C23 | H33 | 0.1° | 0.0° |
| H33 | C23 | C24 | H34 | 0.1° | 0.0° |
