A1AOA
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.51Å | 1.50Å | |
| O | C1 | doub | 1.21Å | 1.23Å | |
| C1 | N | sing | 1.35Å | 1.36Å | |
| N | C2 | sing | 1.48Å | 1.48Å | |
| C2 | C3 | sing | 1.54Å | 1.54Å | |
| C3 | C4 | sing | 1.54Å | 1.56Å | |
| C4 | C5 | sing | 1.55Å | 1.54Å | |
| N | C5 | sing | 1.49Å | 1.47Å | |
| C5 | C6 | sing | 1.51Å | 1.52Å | |
| C6 | C7 | doub | 1.38Å | 1.44Å | Aromatic |
| C7 | N1 | sing | 1.33Å | 1.34Å | Aromatic |
| N1 | C8 | doub | 1.32Å | 1.33Å | Aromatic |
| C8 | N2 | sing | 1.32Å | 1.34Å | Aromatic |
| N2 | C9 | doub | 1.33Å | 1.34Å | Aromatic |
| C6 | C9 | sing | 1.39Å | 1.42Å | Aromatic |
| C9 | N3 | sing | 1.39Å | 1.35Å | |
| N3 | C10 | sing | 1.46Å | 1.46Å | |
| C10 | C11 | sing | 1.51Å | 1.52Å | |
| C11 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | doub | 1.39Å | 1.40Å | Aromatic |
| C14 | C15 | sing | 1.37Å | 1.41Å | Aromatic |
| C16 | C15 | doub | 1.39Å | 1.39Å | Aromatic |
| C11 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | S | sing | 1.77Å | 1.73Å | |
| O1 | S | doub | 1.42Å | 1.44Å | |
| S | O2 | doub | 1.42Å | 1.44Å | |
| C17 | S | sing | 1.82Å | 1.76Å | |
| C18 | C17 | sing | 1.54Å | 1.53Å | |
| C19 | C18 | sing | 1.52Å | 1.52Å | |
| C14 | C19 | sing | 1.50Å | 1.51Å | |
| C20 | C10 | sing | 1.53Å | 1.54Å | |
| C21 | C20 | sing | 1.53Å | 1.53Å | |
| C22 | C20 | sing | 1.53Å | 1.52Å | |
| C23 | C7 | sing | 1.51Å | 1.51Å | |
| C2 | C23 | sing | 1.53Å | 1.53Å | |
| N3 | H11 | sing | 0.97Å | 1.00Å | |
| C4 | H8 | sing | 1.09Å | 1.10Å | |
| C4 | H9 | sing | 1.09Å | 1.10Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C8 | H10 | sing | 1.08Å | 1.08Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.08Å | 1.08Å | |
| C17 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H15 | sing | 1.09Å | 1.10Å | |
| C20 | H21 | sing | 1.09Å | 1.10Å | |
| C21 | H22 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C21 | H23 | sing | 1.09Å | 1.10Å | |
| C22 | H25 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.08Å | 1.08Å | |
| C16 | H14 | sing | 1.08Å | 1.08Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C | H5 | sing | 1.09Å | 1.10Å | |
| C | H4 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C2 | H | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | O | 121.9° | 120.0° |
| C | C1 | N | 117.7° | 119.9° |
| C1 | C | H5 | 109.5° | 109.4° |
| C1 | C | H4 | 109.5° | 109.4° |
| C1 | C | H3 | 109.5° | 109.5° |
| O | C1 | N | 120.5° | 120.0° |
| C1 | N | C2 | 128.6° | 128.4° |
| C1 | N | C5 | 125.1° | 128.3° |
| N | C2 | C3 | 101.8° | 105.0° |
| C2 | N | C5 | 106.2° | 103.3° |
| N | C2 | C23 | 108.7° | 108.1° |
| N | C2 | H | 112.1° | 111.0° |
| C2 | C3 | C4 | 105.6° | 105.1° |
| C3 | C2 | C23 | 111.6° | 110.3° |
| C2 | C3 | H6 | 110.4° | 110.3° |
| C2 | C3 | H7 | 110.4° | 110.4° |
| C3 | C2 | H | 111.0° | 111.4° |
| C3 | C4 | C5 | 104.4° | 104.2° |
| C3 | C4 | H8 | 110.8° | 110.5° |
| C3 | C4 | H9 | 110.8° | 110.6° |
| C4 | C3 | H6 | 110.4° | 110.3° |
| C4 | C3 | H7 | 110.4° | 110.3° |
| C4 | C5 | N | 101.4° | 103.6° |
| C4 | C5 | C6 | 99.8° | 105.9° |
| C5 | C4 | H8 | 110.7° | 110.5° |
| C5 | C4 | H9 | 110.7° | 110.5° |
| C4 | C5 | H1 | 113.9° | 113.1° |
| N | C5 | C6 | 110.8° | 106.7° |
| N | C5 | H1 | 115.1° | 113.7° |
| C5 | C6 | C7 | 119.9° | 120.3° |
| C5 | C6 | C9 | 125.8° | 120.5° |
| C6 | C5 | H1 | 114.2° | 113.0° |
| C6 | C7 | N1 | 123.4° | 118.7° |
| C7 | C6 | C9 | 114.3° | 119.2° |
| C6 | C7 | C23 | 119.8° | 121.5° |
| C7 | N1 | C8 | 115.1° | 120.8° |
| N1 | C7 | C23 | 116.7° | 119.7° |
| N1 | C8 | N2 | 128.3° | 122.2° |
| N1 | C8 | H10 | 115.8° | 118.9° |
| C8 | N2 | C9 | 116.8° | 120.5° |
| N2 | C8 | H10 | 115.9° | 118.9° |
| N2 | C9 | C6 | 122.1° | 118.5° |
| N2 | C9 | N3 | 118.1° | 120.8° |
| C6 | C9 | N3 | 119.9° | 120.7° |
| C9 | N3 | C10 | 124.6° | 120.0° |
| C9 | N3 | H11 | 105.6° | 120.0° |
| N3 | C10 | C11 | 112.8° | 109.5° |
| N3 | C10 | C20 | 109.1° | 109.5° |
| C10 | N3 | H11 | 105.6° | 120.0° |
| N3 | C10 | H2 | 107.9° | 109.5° |
| C10 | C11 | C12 | 122.1° | 120.3° |
| C10 | C11 | C16 | 119.9° | 120.3° |
| C11 | C10 | C20 | 112.8° | 109.4° |
| C11 | C10 | H2 | 107.1° | 109.5° |
| C11 | C12 | C13 | 121.1° | 119.9° |
| C12 | C11 | C16 | 118.0° | 119.4° |
| C11 | C12 | H12 | 119.4° | 120.0° |
| C12 | C13 | C14 | 122.0° | 121.0° |
| C12 | C13 | H13 | 119.0° | 119.5° |
| C13 | C12 | H12 | 119.5° | 120.1° |
| C13 | C14 | C15 | 116.3° | 118.8° |
| C13 | C14 | C19 | 119.9° | 116.5° |
| C14 | C13 | H13 | 119.0° | 119.5° |
| C14 | C15 | C16 | 121.8° | 120.2° |
| C14 | C15 | S | 124.2° | 121.9° |
| C15 | C14 | C19 | 123.8° | 124.7° |
| C15 | C16 | C11 | 120.9° | 120.6° |
| C16 | C15 | S | 114.1° | 117.8° |
| C15 | C16 | H14 | 119.6° | 119.7° |
| C11 | C16 | H14 | 119.5° | 119.7° |
| C15 | S | O1 | 108.5° | 104.4° |
| C15 | S | O2 | 107.9° | 104.4° |
| C15 | S | C17 | 102.1° | 103.6° |
| O1 | S | O2 | 117.7° | 121.2° |
| O1 | S | C17 | 109.9° | 110.7° |
| O2 | S | C17 | 109.5° | 110.6° |
| S | C17 | C18 | 111.2° | 107.0° |
| S | C17 | H16 | 109.0° | 109.9° |
| S | C17 | H15 | 109.0° | 110.0° |
| C17 | C18 | C19 | 111.4° | 109.1° |
| C18 | C17 | H16 | 109.1° | 109.9° |
| C18 | C17 | H15 | 109.0° | 110.0° |
| C17 | C18 | H17 | 109.0° | 109.6° |
| C17 | C18 | H18 | 109.0° | 109.5° |
| C18 | C19 | C14 | 113.4° | 113.8° |
| C19 | C18 | H17 | 109.0° | 109.6° |
| C19 | C18 | H18 | 109.0° | 109.6° |
| C18 | C19 | H19 | 108.5° | 108.7° |
| C18 | C19 | H20 | 108.5° | 108.6° |
| C14 | C19 | H19 | 108.5° | 108.6° |
| C14 | C19 | H20 | 108.5° | 108.5° |
| C10 | C20 | C21 | 111.4° | 109.5° |
| C10 | C20 | C22 | 112.0° | 109.5° |
| C20 | C10 | H2 | 106.8° | 109.5° |
| C10 | C20 | H21 | 107.5° | 109.5° |
| C21 | C20 | C22 | 110.4° | 109.5° |
| C21 | C20 | H21 | 107.6° | 109.5° |
| C20 | C21 | H22 | 109.5° | 109.5° |
| C20 | C21 | H24 | 109.5° | 109.5° |
| C20 | C21 | H23 | 109.5° | 109.5° |
| C22 | C20 | H21 | 107.7° | 109.5° |
| C20 | C22 | H25 | 109.5° | 109.5° |
| C20 | C22 | H26 | 109.5° | 109.5° |
| C20 | C22 | H27 | 109.4° | 109.5° |
| C7 | C23 | C2 | 111.4° | 110.8° |
| C7 | C23 | H28 | 109.0° | 109.2° |
| C7 | C23 | H29 | 109.0° | 109.2° |
| C2 | C23 | H28 | 109.0° | 109.2° |
| C2 | C23 | H29 | 109.0° | 109.2° |
| C23 | C2 | H | 111.2° | 110.8° |
| H8 | C4 | H9 | 109.4° | 110.4° |
| H16 | C17 | H15 | 109.4° | 109.9° |
| H22 | C21 | H24 | 109.4° | 109.5° |
| H22 | C21 | H23 | 109.5° | 109.4° |
| H24 | C21 | H23 | 109.5° | 109.5° |
| H25 | C22 | H26 | 109.5° | 109.5° |
| H25 | C22 | H27 | 109.5° | 109.4° |
| H26 | C22 | H27 | 109.5° | 109.5° |
| H17 | C18 | H18 | 109.5° | 109.5° |
| H19 | C19 | H20 | 109.4° | 108.5° |
| H6 | C3 | H7 | 109.5° | 110.3° |
| H5 | C | H4 | 109.5° | 109.5° |
| H5 | C | H3 | 109.5° | 109.5° |
| H4 | C | H3 | 109.4° | 109.5° |
| H28 | C23 | H29 | 109.5° | 109.3° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | O | N | 179.3° | 180.0° |
| C | C1 | N | C2 | 0.7° | 0.0° |
| C | C1 | N | C5 | 176.0° | 180.0° |
| C1 | C | H5 | H4 | 120.0° | 119.9° |
| C1 | C | H5 | H3 | 120.0° | 120.0° |
| C1 | C | H4 | H3 | 120.0° | 120.0° |
| O | C1 | N | C2 | 178.7° | 180.0° |
| O | C1 | N | C5 | 4.7° | 0.0° |
| O | C1 | C | H5 | 0.0° | 89.9° |
| O | C1 | C | H4 | 120.0° | 30.0° |
| O | C1 | C | H3 | 120.0° | 150.0° |
| C1 | N | C2 | C5 | 177.1° | 180.0° |
| C1 | N | C2 | C3 | 134.9° | 139.5° |
| C1 | N | C5 | C4 | 131.2° | 136.8° |
| C1 | N | C5 | C6 | 123.6° | 111.7° |
| C1 | N | C2 | C23 | 107.1° | 102.8° |
| C1 | N | C5 | H1 | 7.8° | 13.6° |
| N | C1 | C | H5 | 179.4° | 90.0° |
| N | C1 | C | H4 | 59.3° | 150.0° |
| N | C1 | C | H3 | 60.6° | 30.0° |
| C1 | N | C2 | H | 16.2° | 19.0° |
| N | C2 | C3 | C23 | 115.8° | 116.2° |
| N | C2 | C3 | H | 119.5° | 120.2° |
| N | C2 | C3 | C4 | 21.0° | 21.6° |
| C2 | N | C5 | C4 | 46.1° | 43.2° |
| C2 | N | C5 | C6 | 59.1° | 68.3° |
| N | C2 | C23 | C7 | 48.9° | 44.6° |
| N | C2 | C23 | H | 123.8° | 121.9° |
| C2 | N | C5 | H1 | 169.5° | 166.4° |
| N | C2 | C3 | H6 | 98.4° | 140.5° |
| N | C2 | C3 | H7 | 140.4° | 97.4° |
| N | C2 | C23 | H28 | 71.4° | 75.7° |
| N | C2 | C23 | H29 | 169.2° | 164.9° |
| C2 | C3 | C4 | H6 | 119.4° | 118.9° |
| C2 | C3 | C4 | H7 | 119.4° | 119.0° |
| C2 | C3 | C4 | C5 | 5.6° | 4.6° |
| C3 | C2 | N | C5 | 42.2° | 40.5° |
| C3 | C2 | C23 | C7 | 62.6° | 69.6° |
| C3 | C2 | C23 | H | 124.6° | 123.9° |
| C2 | C3 | C4 | H8 | 113.6° | 123.3° |
| C2 | C3 | C4 | H9 | 124.8° | 114.2° |
| C2 | C3 | H6 | H7 | 121.8° | 122.2° |
| C3 | C2 | C23 | H28 | 177.1° | 170.1° |
| C3 | C2 | C23 | H29 | 57.7° | 50.7° |
| C3 | C4 | C5 | H8 | 119.2° | 118.7° |
| C3 | C4 | C5 | H9 | 119.2° | 118.9° |
| C3 | C4 | C5 | N | 30.2° | 29.1° |
| C3 | C4 | C5 | C6 | 83.5° | 83.1° |
| C4 | C3 | C2 | C23 | 94.8° | 94.7° |
| C3 | C4 | H8 | H9 | 122.4° | 122.7° |
| C3 | C4 | C5 | H1 | 154.5° | 152.7° |
| C4 | C3 | H6 | H7 | 121.8° | 122.1° |
| C4 | C3 | C2 | H | 140.5° | 141.8° |
| C4 | C5 | N | C6 | 105.2° | 111.6° |
| C4 | C5 | N | H1 | 123.4° | 123.2° |
| C4 | C5 | C6 | H1 | 121.9° | 124.4° |
| C4 | C5 | C6 | C7 | 86.1° | 77.7° |
| C4 | C5 | C6 | C9 | 95.1° | 102.3° |
| C5 | C4 | H8 | H9 | 122.3° | 122.5° |
| C5 | C4 | C3 | H6 | 125.0° | 114.3° |
| C5 | C4 | C3 | H7 | 113.8° | 123.6° |
| N | C5 | C6 | H1 | 131.9° | 125.7° |
| N | C5 | C6 | C7 | 20.2° | 32.2° |
| N | C5 | C6 | C9 | 158.7° | 147.8° |
| C5 | N | C2 | C23 | 75.7° | 77.2° |
| N | C5 | C4 | H8 | 89.0° | 147.7° |
| N | C5 | C4 | H9 | 149.5° | 89.8° |
| C5 | N | C2 | H | 161.0° | 161.0° |
| C5 | C6 | C7 | C9 | 179.0° | 180.0° |
| C5 | C6 | C7 | N1 | 177.2° | 179.2° |
| C5 | C6 | C9 | N2 | 178.0° | 179.5° |
| C5 | C6 | C9 | N3 | 0.7° | 0.4° |
| C5 | C6 | C7 | C23 | 4.9° | 1.4° |
| C6 | C5 | C4 | H8 | 157.3° | 35.6° |
| C6 | C5 | C4 | H9 | 35.7° | 158.1° |
| C6 | C7 | N1 | C23 | 178.0° | 179.4° |
| C6 | C7 | N1 | C8 | 1.4° | 0.5° |
| C7 | C6 | C9 | N2 | 0.9° | 0.5° |
| C7 | C6 | C9 | N3 | 179.6° | 179.6° |
| C6 | C7 | C23 | C2 | 9.5° | 7.2° |
| C7 | C6 | C5 | H1 | 152.1° | 157.9° |
| C6 | C7 | C23 | H28 | 110.8° | 113.1° |
| C6 | C7 | C23 | H29 | 129.8° | 127.5° |
| C7 | N1 | C8 | N2 | 0.2° | 0.1° |
| N1 | C7 | C6 | C9 | 1.7° | 0.7° |
| N1 | C7 | C23 | C2 | 168.5° | 173.4° |
| C7 | N1 | C8 | H10 | 179.8° | 179.9° |
| N1 | C7 | C23 | H28 | 71.2° | 66.3° |
| N1 | C7 | C23 | H29 | 48.3° | 53.1° |
| N1 | C8 | N2 | H10 | 180.0° | 180.0° |
| N1 | C8 | N2 | C9 | 0.6° | 0.2° |
| C8 | N1 | C7 | C23 | 176.5° | 178.8° |
| C8 | N2 | C9 | C6 | 0.2° | 0.0° |
| C8 | N2 | C9 | N3 | 178.6° | 179.9° |
| N2 | C9 | C6 | N3 | 178.8° | 179.9° |
| N2 | C9 | N3 | C10 | 12.2° | 0.0° |
| N2 | C9 | N3 | H11 | 109.8° | 180.0° |
| C9 | N2 | C8 | H10 | 179.4° | 179.8° |
| C6 | C9 | N3 | C10 | 168.9° | 180.0° |
| C9 | C6 | C7 | C23 | 176.2° | 178.6° |
| C6 | C9 | N3 | H11 | 69.0° | 0.1° |
| C9 | C6 | C5 | H1 | 26.8° | 22.1° |
| C9 | N3 | C10 | H11 | 122.0° | 180.0° |
| C9 | N3 | C10 | C11 | 88.9° | 155.0° |
| C9 | N3 | C10 | C20 | 144.8° | 85.0° |
| C9 | N3 | C10 | H2 | 29.2° | 35.0° |
| N3 | C10 | C11 | C20 | 124.2° | 120.0° |
| N3 | C10 | C11 | H2 | 118.5° | 120.1° |
| N3 | C10 | C11 | C12 | 130.1° | 39.9° |
| N3 | C10 | C11 | C16 | 48.1° | 140.0° |
| N3 | C10 | C20 | H2 | 116.3° | 120.1° |
| N3 | C10 | C20 | C21 | 58.9° | 180.0° |
| N3 | C10 | C20 | C22 | 176.9° | 60.0° |
| N3 | C10 | C20 | H21 | 58.7° | 60.0° |
| C10 | C11 | C12 | C16 | 178.3° | 180.0° |
| C10 | C11 | C12 | C13 | 178.8° | 179.7° |
| C10 | C11 | C16 | C15 | 179.5° | 179.6° |
| C11 | C10 | C20 | H2 | 117.5° | 120.0° |
| C11 | C10 | C20 | C21 | 174.9° | 60.0° |
| C11 | C10 | C20 | C22 | 50.6° | 180.0° |
| C11 | C10 | N3 | H11 | 149.0° | 25.0° |
| C11 | C10 | C20 | H21 | 67.5° | 60.0° |
| C10 | C11 | C12 | H12 | 1.2° | 0.3° |
| C10 | C11 | C16 | H14 | 0.5° | 0.4° |
| C11 | C12 | C13 | H12 | 180.0° | 180.0° |
| C11 | C12 | C13 | C14 | 0.9° | 0.1° |
| C12 | C11 | C16 | C15 | 1.2° | 0.5° |
| C12 | C11 | C10 | C20 | 105.7° | 80.0° |
| C12 | C11 | C10 | H2 | 11.6° | 160.0° |
| C11 | C12 | C13 | H13 | 179.1° | 179.6° |
| C12 | C11 | C16 | H14 | 178.8° | 179.6° |
| C12 | C13 | C14 | H13 | 180.0° | 179.7° |
| C12 | C13 | C14 | C15 | 1.7° | 0.4° |
| C13 | C12 | C11 | C16 | 0.5° | 0.4° |
| C12 | C13 | C14 | C19 | 176.5° | 178.5° |
| C13 | C14 | C15 | C19 | 178.1° | 178.8° |
| C13 | C14 | C15 | C16 | 1.0° | 0.3° |
| C13 | C14 | C15 | S | 179.2° | 179.0° |
| C13 | C14 | C19 | C18 | 161.6° | 156.6° |
| C13 | C14 | C19 | H19 | 77.8° | 35.5° |
| C13 | C14 | C19 | H20 | 41.0° | 82.3° |
| C14 | C13 | C12 | H12 | 179.1° | 179.9° |
| C14 | C15 | C16 | S | 179.9° | 179.3° |
| C14 | C15 | C16 | C11 | 0.5° | 0.1° |
| C14 | C15 | S | O1 | 130.4° | 103.4° |
| C14 | C15 | S | O2 | 101.0° | 128.4° |
| C14 | C15 | S | C17 | 14.4° | 12.5° |
| C15 | C14 | C19 | C18 | 20.4° | 24.5° |
| C15 | C14 | C13 | H13 | 178.3° | 179.3° |
| C15 | C14 | C19 | H19 | 100.2° | 145.7° |
| C15 | C14 | C19 | H20 | 141.0° | 96.5° |
| C14 | C15 | C16 | H14 | 179.5° | 179.9° |
| C15 | C16 | C11 | H14 | 180.0° | 180.0° |
| C16 | C15 | S | O1 | 49.5° | 75.9° |
| C16 | C15 | S | O2 | 79.1° | 52.3° |
| C16 | C15 | S | C17 | 165.5° | 168.2° |
| C16 | C15 | C14 | C19 | 177.1° | 178.5° |
| C11 | C16 | C15 | S | 179.4° | 179.5° |
| C16 | C11 | C10 | C20 | 76.1° | 100.0° |
| C16 | C11 | C10 | H2 | 166.6° | 19.9° |
| C16 | C11 | C12 | H12 | 179.5° | 179.6° |
| C15 | S | O1 | O2 | 122.8° | 117.1° |
| C15 | S | O1 | C17 | 110.9° | 110.9° |
| C15 | S | O2 | C17 | 110.4° | 110.9° |
| C15 | S | C17 | C18 | 45.2° | 45.0° |
| S | C15 | C14 | C19 | 2.8° | 2.2° |
| C15 | S | C17 | H16 | 75.1° | 164.3° |
| C15 | S | C17 | H15 | 165.4° | 74.5° |
| S | C15 | C16 | H14 | 0.6° | 0.6° |
| O1 | S | O2 | C17 | 126.5° | 132.0° |
| O1 | S | C17 | C18 | 160.1° | 66.4° |
| O1 | S | C17 | H16 | 39.9° | 52.9° |
| O1 | S | C17 | H15 | 79.6° | 174.1° |
| O2 | S | C17 | C18 | 69.1° | 156.3° |
| O2 | S | C17 | H16 | 170.7° | 84.3° |
| O2 | S | C17 | H15 | 51.2° | 36.8° |
| S | C17 | C18 | H16 | 120.3° | 119.4° |
| S | C17 | C18 | H15 | 120.3° | 119.5° |
| S | C17 | C18 | C19 | 68.7° | 71.4° |
| S | C17 | H16 | H15 | 119.2° | 121.2° |
| S | C17 | C18 | H17 | 171.0° | 48.5° |
| S | C17 | C18 | H18 | 51.6° | 168.6° |
| C17 | C18 | C19 | H17 | 120.3° | 119.9° |
| C17 | C18 | C19 | H18 | 120.3° | 119.9° |
| C17 | C18 | C19 | C14 | 53.8° | 61.5° |
| C18 | C17 | H16 | H15 | 119.2° | 121.2° |
| C17 | C18 | H17 | H18 | 119.1° | 120.2° |
| C17 | C18 | C19 | H19 | 66.7° | 177.4° |
| C17 | C18 | C19 | H20 | 174.5° | 59.5° |
| C18 | C19 | C14 | H19 | 120.6° | 121.2° |
| C18 | C19 | C14 | H20 | 120.6° | 121.1° |
| C19 | C18 | C17 | H16 | 51.5° | 169.2° |
| C19 | C18 | C17 | H15 | 171.0° | 48.0° |
| C19 | C18 | H17 | H18 | 119.2° | 120.2° |
| C18 | C19 | H19 | H20 | 118.2° | 117.9° |
| C19 | C14 | C13 | H13 | 3.5° | 1.8° |
| C14 | C19 | C18 | H17 | 174.1° | 58.4° |
| C14 | C19 | C18 | H18 | 66.4° | 178.6° |
| C14 | C19 | H19 | H20 | 118.2° | 117.7° |
| C10 | C20 | C21 | C22 | 125.2° | 120.0° |
| C10 | C20 | C21 | H21 | 117.5° | 120.0° |
| C10 | C20 | C22 | H21 | 118.0° | 120.0° |
| C20 | C10 | N3 | H11 | 22.8° | 94.9° |
| C10 | C20 | C21 | H22 | 180.0° | 59.9° |
| C10 | C20 | C21 | H24 | 60.0° | 179.9° |
| C10 | C20 | C21 | H23 | 60.0° | 60.0° |
| C10 | C20 | C22 | H25 | 180.0° | 60.0° |
| C10 | C20 | C22 | H26 | 60.0° | 180.0° |
| C10 | C20 | C22 | H27 | 60.0° | 60.0° |
| C21 | C20 | C22 | H21 | 117.2° | 120.0° |
| C21 | C20 | C10 | H2 | 57.5° | 59.9° |
| C20 | C21 | H22 | H24 | 120.0° | 120.0° |
| C20 | C21 | H22 | H23 | 120.0° | 120.0° |
| C20 | C21 | H24 | H23 | 120.0° | 120.0° |
| C21 | C20 | C22 | H25 | 55.2° | 180.0° |
| C21 | C20 | C22 | H26 | 175.2° | 60.0° |
| C21 | C20 | C22 | H27 | 64.8° | 60.0° |
| C22 | C20 | C10 | H2 | 66.8° | 60.0° |
| C22 | C20 | C21 | H22 | 54.8° | 60.0° |
| C22 | C20 | C21 | H24 | 65.2° | 60.0° |
| C22 | C20 | C21 | H23 | 174.8° | 180.0° |
| C20 | C22 | H25 | H26 | 120.0° | 120.0° |
| C20 | C22 | H25 | H27 | 120.0° | 120.0° |
| C20 | C22 | H26 | H27 | 120.0° | 120.0° |
| C7 | C23 | C2 | H28 | 120.3° | 120.3° |
| C7 | C23 | C2 | H29 | 120.3° | 120.3° |
| C7 | C23 | H28 | H29 | 119.1° | 119.4° |
| C7 | C23 | C2 | H | 172.8° | 166.5° |
| C23 | C2 | C3 | H6 | 145.8° | 24.3° |
| C23 | C2 | C3 | H7 | 24.6° | 146.4° |
| C2 | C23 | H28 | H29 | 119.1° | 119.4° |
| H11 | N3 | C10 | H2 | 92.9° | 145.0° |
| H8 | C4 | C5 | H1 | 35.3° | 88.7° |
| H8 | C4 | C3 | H6 | 5.8° | 4.3° |
| H8 | C4 | C3 | H7 | 127.0° | 117.7° |
| H9 | C4 | C5 | H1 | 86.3° | 33.8° |
| H9 | C4 | C3 | H6 | 115.8° | 126.9° |
| H9 | C4 | C3 | H7 | 5.4° | 4.8° |
| H2 | C10 | C20 | H21 | 175.0° | 179.9° |
| H13 | C13 | C12 | H12 | 0.9° | 0.4° |
| H16 | C17 | C18 | H17 | 68.7° | 70.9° |
| H16 | C17 | C18 | H18 | 171.8° | 49.2° |
| H15 | C17 | C18 | H17 | 50.7° | 168.0° |
| H15 | C17 | C18 | H18 | 68.7° | 71.9° |
| H21 | C20 | C21 | H22 | 62.5° | 180.0° |
| H21 | C20 | C21 | H24 | 177.5° | 60.0° |
| H21 | C20 | C21 | H23 | 57.5° | 60.0° |
| H21 | C20 | C22 | H25 | 62.0° | 60.0° |
| H21 | C20 | C22 | H26 | 58.0° | 60.0° |
| H21 | C20 | C22 | H27 | 178.0° | 180.0° |
| H22 | C21 | H24 | H23 | 120.0° | 119.9° |
| H25 | C22 | H26 | H27 | 120.0° | 120.0° |
| H17 | C18 | C19 | H19 | 53.5° | 62.7° |
| H17 | C18 | C19 | H20 | 65.3° | 179.4° |
| H18 | C18 | C19 | H19 | 173.0° | 57.5° |
| H18 | C18 | C19 | H20 | 54.2° | 60.4° |
| H6 | C3 | C2 | H | 21.1° | 99.3° |
| H7 | C3 | C2 | H | 100.1° | 22.9° |
| H5 | C | H4 | H3 | 120.0° | 120.1° |
| H28 | C23 | C2 | H | 52.5° | 46.2° |
| H29 | C23 | C2 | H | 67.0° | 73.2° |
