A1ANR
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | C1 | sing | 1.53Å | 1.52Å | |
| C2 | C1 | sing | 1.53Å | 1.52Å | |
| C1 | C3 | sing | 1.53Å | 1.55Å | |
| N | C3 | sing | 1.46Å | 1.46Å | |
| C4 | N | sing | 1.38Å | 1.36Å | |
| C4 | N1 | doub | 1.33Å | 1.35Å | Aromatic |
| N1 | C5 | sing | 1.32Å | 1.34Å | Aromatic |
| C5 | N2 | doub | 1.32Å | 1.34Å | Aromatic |
| N2 | C6 | sing | 1.33Å | 1.34Å | Aromatic |
| C6 | N3 | sing | 1.37Å | 1.37Å | Aromatic |
| N3 | C7 | sing | 1.38Å | 1.39Å | Aromatic |
| C8 | C7 | sing | 1.47Å | 1.49Å | |
| O | C8 | doub | 1.22Å | 1.24Å | |
| N4 | C8 | sing | 1.35Å | 1.34Å | |
| C9 | N4 | sing | 1.47Å | 1.46Å | |
| C9 | C10 | sing | 1.54Å | 1.54Å | |
| C10 | N5 | sing | 1.48Å | 1.48Å | |
| C11 | N5 | sing | 1.47Å | 1.46Å | |
| N5 | C12 | sing | 1.47Å | 1.47Å | |
| C12 | C9 | sing | 1.54Å | 1.54Å | |
| C7 | C13 | doub | 1.36Å | 1.37Å | Aromatic |
| C13 | C14 | sing | 1.41Å | 1.42Å | Aromatic |
| C14 | C4 | sing | 1.41Å | 1.43Å | Aromatic |
| C6 | C14 | doub | 1.41Å | 1.40Å | Aromatic |
| C3 | C15 | sing | 1.51Å | 1.51Å | |
| C15 | C16 | doub | 1.38Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| C17 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.40Å | Aromatic |
| C20 | C19 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C20 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | S | sing | 1.77Å | 1.73Å | |
| O1 | S | doub | 1.42Å | 1.44Å | |
| S | O2 | doub | 1.42Å | 1.44Å | |
| C21 | S | sing | 1.82Å | 1.76Å | |
| C22 | C21 | sing | 1.54Å | 1.52Å | |
| C23 | C22 | sing | 1.52Å | 1.51Å | |
| C18 | C23 | sing | 1.50Å | 1.51Å | |
| N3 | H1 | sing | 0.97Å | 1.00Å | |
| C5 | H10 | sing | 1.08Å | 1.08Å | |
| C10 | H13 | sing | 1.09Å | 1.10Å | |
| C10 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H20 | sing | 1.08Å | 1.08Å | |
| C17 | H22 | sing | 1.08Å | 1.08Å | |
| C20 | H23 | sing | 1.08Å | 1.08Å | |
| C21 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H24 | sing | 1.09Å | 1.10Å | |
| C22 | H27 | sing | 1.09Å | 1.10Å | |
| C22 | H26 | sing | 1.09Å | 1.10Å | |
| C23 | H28 | sing | 1.09Å | 1.10Å | |
| C23 | H29 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.08Å | 1.08Å | |
| C3 | H | sing | 1.09Å | 1.10Å | |
| C1 | H5 | sing | 1.09Å | 1.10Å | |
| C2 | H6 | sing | 1.09Å | 1.10Å | |
| C2 | H7 | sing | 1.09Å | 1.10Å | |
| C2 | H8 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H4 | sing | 1.09Å | 1.10Å | |
| N | H9 | sing | 0.97Å | 1.00Å | |
| N4 | H11 | sing | 0.97Å | 1.00Å | |
| C9 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H19 | sing | 1.09Å | 1.10Å | |
| C12 | H18 | sing | 1.09Å | 1.10Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | C1 | C2 | 110.7° | 109.5° |
| C | C1 | C3 | 111.4° | 109.5° |
| C | C1 | H5 | 107.9° | 109.5° |
| C1 | C | H3 | 109.5° | 109.4° |
| C1 | C | H2 | 109.5° | 109.5° |
| C1 | C | H4 | 109.4° | 109.4° |
| C2 | C1 | C3 | 111.3° | 109.5° |
| C2 | C1 | H5 | 107.8° | 109.4° |
| C1 | C2 | H6 | 109.5° | 109.5° |
| C1 | C2 | H7 | 109.5° | 109.5° |
| C1 | C2 | H8 | 109.5° | 109.5° |
| C1 | C3 | N | 111.8° | 109.4° |
| C1 | C3 | C15 | 111.9° | 109.5° |
| C1 | C3 | H | 106.2° | 109.4° |
| C3 | C1 | H5 | 107.5° | 109.5° |
| C3 | N | C4 | 125.8° | 120.0° |
| N | C3 | C15 | 112.8° | 109.5° |
| N | C3 | H | 107.2° | 109.5° |
| C3 | N | H9 | 105.3° | 119.9° |
| N | C4 | N1 | 119.0° | 120.8° |
| N | C4 | C14 | 121.1° | 120.8° |
| C4 | N | H9 | 105.3° | 120.1° |
| C4 | N1 | C5 | 117.3° | 121.1° |
| N1 | C4 | C14 | 119.9° | 118.4° |
| N1 | C5 | N2 | 129.0° | 122.7° |
| N1 | C5 | H10 | 115.5° | 118.6° |
| C5 | N2 | C6 | 112.9° | 120.8° |
| N2 | C5 | H10 | 115.5° | 118.6° |
| N2 | C6 | N3 | 126.5° | 134.0° |
| N2 | C6 | C14 | 125.2° | 118.6° |
| C6 | N3 | C7 | 108.4° | 108.9° |
| N3 | C6 | C14 | 108.2° | 107.4° |
| C6 | N3 | H1 | 125.8° | 125.5° |
| N3 | C7 | C8 | 121.9° | 125.5° |
| N3 | C7 | C13 | 109.2° | 109.0° |
| C7 | N3 | H1 | 125.8° | 125.6° |
| C7 | C8 | O | 120.7° | 120.0° |
| C7 | C8 | N4 | 116.2° | 120.0° |
| C8 | C7 | C13 | 128.9° | 125.5° |
| O | C8 | N4 | 123.1° | 120.0° |
| C8 | N4 | C9 | 123.5° | 120.0° |
| C8 | N4 | H11 | 118.2° | 120.0° |
| N4 | C9 | C10 | 119.2° | 114.1° |
| N4 | C9 | C12 | 117.4° | 114.1° |
| C9 | N4 | H11 | 118.3° | 120.0° |
| N4 | C9 | H12 | 111.1° | 113.2° |
| C9 | C10 | N5 | 84.5° | 87.9° |
| C10 | C9 | C12 | 87.1° | 83.6° |
| C9 | C10 | H13 | 115.3° | 113.5° |
| C9 | C10 | H14 | 115.3° | 113.6° |
| C10 | C9 | H12 | 109.9° | 114.2° |
| C10 | N5 | C11 | 113.8° | 111.0° |
| C10 | N5 | C12 | 92.2° | 87.8° |
| N5 | C10 | H13 | 115.3° | 113.4° |
| N5 | C10 | H14 | 115.3° | 113.5° |
| C11 | N5 | C12 | 117.7° | 111.0° |
| N5 | C11 | H15 | 109.5° | 109.5° |
| N5 | C11 | H17 | 109.4° | 109.5° |
| N5 | C11 | H16 | 109.5° | 109.4° |
| N5 | C12 | C9 | 84.8° | 87.9° |
| N5 | C12 | H19 | 115.2° | 113.5° |
| N5 | C12 | H18 | 115.2° | 113.5° |
| C12 | C9 | H12 | 109.9° | 114.4° |
| C9 | C12 | H19 | 115.2° | 113.5° |
| C9 | C12 | H18 | 115.2° | 113.4° |
| C7 | C13 | C14 | 107.1° | 107.6° |
| C7 | C13 | H20 | 126.4° | 126.2° |
| C13 | C14 | C4 | 137.2° | 134.5° |
| C13 | C14 | C6 | 107.0° | 107.2° |
| C14 | C13 | H20 | 126.4° | 126.2° |
| C4 | C14 | C6 | 115.7° | 118.4° |
| C3 | C15 | C16 | 120.5° | 120.2° |
| C3 | C15 | C20 | 121.1° | 120.3° |
| C15 | C3 | H | 106.5° | 109.5° |
| C15 | C16 | C17 | 121.1° | 119.9° |
| C16 | C15 | C20 | 118.3° | 119.4° |
| C15 | C16 | H21 | 119.5° | 120.1° |
| C16 | C17 | C18 | 121.9° | 121.0° |
| C16 | C17 | H22 | 119.0° | 119.5° |
| C17 | C16 | H21 | 119.4° | 120.1° |
| C17 | C18 | C19 | 116.5° | 118.8° |
| C17 | C18 | C23 | 119.8° | 116.5° |
| C18 | C17 | H22 | 119.0° | 119.5° |
| C18 | C19 | C20 | 121.7° | 120.2° |
| C18 | C19 | S | 122.6° | 121.9° |
| C19 | C18 | C23 | 123.7° | 124.6° |
| C19 | C20 | C15 | 120.4° | 120.7° |
| C20 | C19 | S | 115.6° | 117.9° |
| C19 | C20 | H23 | 119.8° | 119.6° |
| C15 | C20 | H23 | 119.8° | 119.7° |
| C19 | S | O1 | 108.5° | 104.4° |
| C19 | S | O2 | 108.4° | 104.4° |
| C19 | S | C21 | 103.1° | 103.7° |
| O1 | S | O2 | 117.9° | 121.2° |
| O1 | S | C21 | 110.0° | 110.6° |
| O2 | S | C21 | 108.0° | 110.6° |
| S | C21 | C22 | 110.9° | 107.1° |
| S | C21 | H25 | 109.1° | 109.9° |
| S | C21 | H24 | 109.1° | 110.0° |
| C21 | C22 | C23 | 110.2° | 109.1° |
| C22 | C21 | H25 | 109.1° | 109.9° |
| C22 | C21 | H24 | 109.1° | 110.0° |
| C21 | C22 | H27 | 109.3° | 109.6° |
| C21 | C22 | H26 | 109.3° | 109.6° |
| C22 | C23 | C18 | 112.8° | 113.8° |
| C23 | C22 | H27 | 109.3° | 109.5° |
| C23 | C22 | H26 | 109.3° | 109.6° |
| C22 | C23 | H28 | 108.6° | 108.6° |
| C22 | C23 | H29 | 108.6° | 108.6° |
| C18 | C23 | H28 | 108.6° | 108.6° |
| C18 | C23 | H29 | 108.6° | 108.5° |
| H13 | C10 | H14 | 109.5° | 112.7° |
| H25 | C21 | H24 | 109.5° | 109.9° |
| H27 | C22 | H26 | 109.5° | 109.5° |
| H28 | C23 | H29 | 109.5° | 108.6° |
| H6 | C2 | H7 | 109.5° | 109.5° |
| H6 | C2 | H8 | 109.5° | 109.4° |
| H7 | C2 | H8 | 109.5° | 109.5° |
| H3 | C | H2 | 109.5° | 109.6° |
| H3 | C | H4 | 109.5° | 109.4° |
| H2 | C | H4 | 109.5° | 109.5° |
| H19 | C12 | H18 | 109.5° | 112.8° |
| H15 | C11 | H17 | 109.5° | 109.5° |
| H15 | C11 | H16 | 109.4° | 109.5° |
| H17 | C11 | H16 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | C1 | C2 | C3 | 124.5° | 120.0° |
| C | C1 | C2 | H5 | 117.8° | 120.0° |
| C | C1 | C3 | H5 | 118.0° | 120.0° |
| C | C1 | C3 | N | 178.4° | 60.0° |
| C | C1 | C3 | C15 | 53.9° | 180.0° |
| C | C1 | C3 | H | 61.9° | 60.0° |
| C | C1 | C2 | H6 | 180.0° | 60.0° |
| C | C1 | C2 | H7 | 60.0° | 60.0° |
| C | C1 | C2 | H8 | 60.0° | 180.0° |
| C1 | C | H3 | H2 | 120.0° | 120.0° |
| C1 | C | H3 | H4 | 120.0° | 119.9° |
| C1 | C | H2 | H4 | 120.0° | 120.0° |
| C2 | C1 | C3 | H5 | 117.9° | 120.0° |
| C2 | C1 | C3 | N | 54.4° | 180.0° |
| C2 | C1 | C3 | C15 | 178.0° | 60.0° |
| C2 | C1 | C3 | H | 62.1° | 60.0° |
| C1 | C2 | H6 | H7 | 120.0° | 120.0° |
| C1 | C2 | H6 | H8 | 120.0° | 120.0° |
| C1 | C2 | H7 | H8 | 120.0° | 120.0° |
| C2 | C1 | C | H3 | 180.0° | 180.0° |
| C2 | C1 | C | H2 | 60.0° | 59.9° |
| C2 | C1 | C | H4 | 60.0° | 60.0° |
| C1 | C3 | N | C15 | 127.1° | 120.0° |
| C1 | C3 | N | H | 115.9° | 120.0° |
| C1 | C3 | N | C4 | 135.7° | 85.0° |
| C1 | C3 | C15 | H | 115.6° | 120.0° |
| C1 | C3 | C15 | C16 | 111.4° | 80.0° |
| C1 | C3 | C15 | C20 | 69.4° | 99.7° |
| C3 | C1 | C2 | H6 | 55.5° | 60.0° |
| C3 | C1 | C2 | H7 | 175.5° | 180.0° |
| C3 | C1 | C2 | H8 | 64.5° | 60.0° |
| C3 | C1 | C | H3 | 55.6° | 60.0° |
| C3 | C1 | C | H2 | 64.4° | 179.9° |
| C3 | C1 | C | H4 | 175.6° | 60.0° |
| C1 | C3 | N | H9 | 102.1° | 95.0° |
| C3 | N | C4 | H9 | 122.2° | 180.0° |
| C3 | N | C4 | N1 | 11.3° | 0.0° |
| C3 | N | C4 | C14 | 171.4° | 180.0° |
| N | C3 | C15 | H | 117.3° | 120.0° |
| N | C3 | C15 | C16 | 121.6° | 40.0° |
| N | C3 | C15 | C20 | 57.7° | 140.3° |
| N | C3 | C1 | H5 | 63.5° | 60.1° |
| N | C4 | N1 | C14 | 177.3° | 180.0° |
| N | C4 | N1 | C5 | 176.5° | 180.0° |
| N | C4 | C14 | C13 | 0.3° | 0.0° |
| N | C4 | C14 | C6 | 174.7° | 180.0° |
| C4 | N | C3 | C15 | 97.2° | 155.0° |
| C4 | N | C3 | H | 19.8° | 35.0° |
| C4 | N1 | C5 | N2 | 1.5° | 0.0° |
| N1 | C4 | C14 | C13 | 177.5° | 180.0° |
| N1 | C4 | C14 | C6 | 2.6° | 0.0° |
| C4 | N1 | C5 | H10 | 178.5° | 180.0° |
| N1 | C4 | N | H9 | 133.5° | 180.0° |
| N1 | C5 | N2 | H10 | 180.0° | 179.9° |
| N1 | C5 | N2 | C6 | 1.5° | 0.0° |
| C5 | N1 | C4 | C14 | 0.8° | 0.0° |
| C5 | N2 | C6 | N3 | 176.3° | 180.0° |
| C5 | N2 | C6 | C14 | 0.7° | 0.0° |
| N2 | C6 | N3 | C14 | 177.4° | 179.9° |
| N2 | C6 | N3 | C7 | 178.3° | 180.0° |
| N2 | C6 | C14 | C13 | 179.0° | 180.0° |
| N2 | C6 | C14 | C4 | 2.6° | 0.0° |
| N2 | C6 | N3 | H1 | 1.7° | 0.0° |
| C6 | N2 | C5 | H10 | 178.5° | 180.0° |
| C6 | N3 | C7 | H1 | 180.0° | 180.0° |
| C6 | N3 | C7 | C8 | 177.6° | 179.9° |
| C6 | N3 | C7 | C13 | 0.2° | 0.0° |
| N3 | C6 | C14 | C13 | 1.6° | 0.1° |
| N3 | C6 | C14 | C4 | 174.9° | 180.0° |
| N3 | C7 | C8 | C13 | 177.3° | 179.9° |
| N3 | C7 | C8 | O | 177.6° | 180.0° |
| N3 | C7 | C8 | N4 | 3.5° | 0.0° |
| N3 | C7 | C13 | C14 | 1.2° | 0.0° |
| C7 | N3 | C6 | C14 | 0.9° | 0.0° |
| N3 | C7 | C13 | H20 | 178.9° | 180.0° |
| C7 | C8 | O | N4 | 178.8° | 180.0° |
| C7 | C8 | N4 | C9 | 173.8° | 180.0° |
| C8 | C7 | C13 | C14 | 176.4° | 180.0° |
| C8 | C7 | N3 | H1 | 2.4° | 0.0° |
| C8 | C7 | C13 | H20 | 3.5° | 0.1° |
| C7 | C8 | N4 | H11 | 6.2° | 0.1° |
| O | C8 | N4 | C9 | 7.4° | 0.0° |
| O | C8 | C7 | C13 | 0.2° | 0.1° |
| O | C8 | N4 | H11 | 172.6° | 180.0° |
| C8 | N4 | C9 | H11 | 180.0° | 179.9° |
| C8 | N4 | C9 | C10 | 82.0° | 155.0° |
| C8 | N4 | C9 | C12 | 175.0° | 111.2° |
| N4 | C8 | C7 | C13 | 179.1° | 180.0° |
| C8 | N4 | C9 | H12 | 47.3° | 22.0° |
| N4 | C9 | C10 | C12 | 120.0° | 113.6° |
| N4 | C9 | C10 | H12 | 129.8° | 132.5° |
| N4 | C9 | C10 | N5 | 144.6° | 139.7° |
| N4 | C9 | C12 | N5 | 146.2° | 139.7° |
| N4 | C9 | C12 | H12 | 128.3° | 132.7° |
| N4 | C9 | C10 | H13 | 100.0° | 105.6° |
| N4 | C9 | C10 | H14 | 29.1° | 24.9° |
| N4 | C9 | C12 | H19 | 98.3° | 24.9° |
| N4 | C9 | C12 | H18 | 30.8° | 105.5° |
| C9 | C10 | N5 | H13 | 115.5° | 114.7° |
| C9 | C10 | N5 | H14 | 115.4° | 114.9° |
| C9 | C10 | N5 | C11 | 147.4° | 138.7° |
| C10 | C9 | C12 | N5 | 24.6° | 26.1° |
| C10 | C9 | C12 | H12 | 110.1° | 113.7° |
| C9 | C10 | H13 | H14 | 131.9° | 130.9° |
| C10 | C9 | N4 | H11 | 98.0° | 25.0° |
| C10 | C9 | C12 | H19 | 140.1° | 88.7° |
| C10 | C9 | C12 | H18 | 90.9° | 140.9° |
| C10 | N5 | C11 | C12 | 106.2° | 96.0° |
| N5 | C10 | H13 | H14 | 131.9° | 130.8° |
| N5 | C10 | C9 | H12 | 85.6° | 87.8° |
| C10 | N5 | C12 | H19 | 141.2° | 87.7° |
| C10 | N5 | C12 | H18 | 89.7° | 141.8° |
| C10 | N5 | C11 | H15 | 180.0° | 60.0° |
| C10 | N5 | C11 | H17 | 60.0° | 180.0° |
| C10 | N5 | C11 | H16 | 60.0° | 60.0° |
| C11 | N5 | C12 | C9 | 144.2° | 138.7° |
| C11 | N5 | C10 | H13 | 97.1° | 106.5° |
| C11 | N5 | C10 | H14 | 32.0° | 23.8° |
| C11 | N5 | C12 | H19 | 100.3° | 23.9° |
| C11 | N5 | C12 | H18 | 28.7° | 106.5° |
| N5 | C11 | H15 | H17 | 120.0° | 120.0° |
| N5 | C11 | H15 | H16 | 120.0° | 119.9° |
| N5 | C11 | H17 | H16 | 120.0° | 120.0° |
| N5 | C12 | C9 | H19 | 115.5° | 114.8° |
| N5 | C12 | C9 | H18 | 115.5° | 114.8° |
| C12 | N5 | C10 | H13 | 141.2° | 141.8° |
| C12 | N5 | C10 | H14 | 89.7° | 87.8° |
| N5 | C12 | C9 | H12 | 85.5° | 87.6° |
| N5 | C12 | H19 | H18 | 131.8° | 130.9° |
| C12 | N5 | C11 | H15 | 73.8° | 36.0° |
| C12 | N5 | C11 | H17 | 166.1° | 84.0° |
| C12 | N5 | C11 | H16 | 46.2° | 156.0° |
| C12 | C9 | C10 | H13 | 140.0° | 140.8° |
| C12 | C9 | C10 | H14 | 90.9° | 88.7° |
| C12 | C9 | N4 | H11 | 5.0° | 68.8° |
| C9 | C12 | H19 | H18 | 131.8° | 130.7° |
| C7 | C13 | C14 | H20 | 180.0° | 179.9° |
| C7 | C13 | C14 | C4 | 173.6° | 180.0° |
| C7 | C13 | C14 | C6 | 1.7° | 0.1° |
| C13 | C7 | N3 | H1 | 179.8° | 180.0° |
| C13 | C14 | C4 | C6 | 174.9° | 180.0° |
| C4 | C14 | C13 | H20 | 6.4° | 0.0° |
| C14 | C4 | N | H9 | 49.2° | 0.0° |
| C14 | C6 | N3 | H1 | 179.1° | 180.0° |
| C6 | C14 | C13 | H20 | 178.4° | 180.0° |
| C3 | C15 | C16 | C20 | 179.3° | 179.7° |
| C3 | C15 | C16 | C17 | 179.4° | 179.3° |
| C3 | C15 | C20 | C19 | 177.6° | 179.8° |
| C3 | C15 | C20 | H23 | 2.4° | 0.3° |
| C3 | C15 | C16 | H21 | 0.6° | 0.7° |
| C15 | C3 | C1 | H5 | 64.1° | 60.0° |
| C15 | C3 | N | H9 | 25.0° | 25.0° |
| C15 | C16 | C17 | H21 | 180.0° | 179.9° |
| C15 | C16 | C17 | C18 | 0.8° | 0.1° |
| C16 | C15 | C20 | C19 | 1.6° | 0.0° |
| C15 | C16 | C17 | H22 | 179.1° | 180.0° |
| C16 | C15 | C20 | H23 | 178.4° | 180.0° |
| C16 | C15 | C3 | H | 4.3° | 160.0° |
| C16 | C17 | C18 | H22 | 180.0° | 179.9° |
| C16 | C17 | C18 | C19 | 0.2° | 0.8° |
| C17 | C16 | C15 | C20 | 0.1° | 0.5° |
| C16 | C17 | C18 | C23 | 178.7° | 178.2° |
| C17 | C18 | C19 | C23 | 178.8° | 178.9° |
| C17 | C18 | C19 | C20 | 2.0° | 1.3° |
| C17 | C18 | C19 | S | 172.5° | 178.0° |
| C17 | C18 | C23 | C22 | 153.2° | 155.7° |
| C17 | C18 | C23 | H28 | 86.3° | 34.6° |
| C17 | C18 | C23 | H29 | 32.7° | 83.3° |
| C18 | C17 | C16 | H21 | 179.1° | 180.0° |
| C18 | C19 | C20 | S | 174.8° | 179.3° |
| C18 | C19 | C20 | C15 | 2.8° | 0.9° |
| C18 | C19 | S | O1 | 132.6° | 102.9° |
| C18 | C19 | S | O2 | 98.3° | 128.9° |
| C18 | C19 | S | C21 | 16.0° | 12.9° |
| C19 | C18 | C23 | C22 | 28.0° | 25.3° |
| C19 | C18 | C17 | H22 | 179.8° | 179.1° |
| C18 | C19 | C20 | H23 | 177.2° | 179.1° |
| C19 | C18 | C23 | H28 | 92.5° | 146.5° |
| C19 | C18 | C23 | H29 | 148.5° | 95.7° |
| C19 | C20 | C15 | H23 | 180.0° | 180.0° |
| C20 | C19 | S | O1 | 52.6° | 76.3° |
| C20 | C19 | S | O2 | 76.5° | 51.8° |
| C20 | C19 | S | C21 | 169.2° | 167.8° |
| C20 | C19 | C18 | C23 | 176.8° | 177.6° |
| C15 | C20 | C19 | S | 172.1° | 178.4° |
| C20 | C15 | C16 | H21 | 179.9° | 179.6° |
| C20 | C15 | C3 | H | 175.0° | 20.2° |
| C19 | S | O1 | O2 | 123.5° | 117.1° |
| C19 | S | O1 | C21 | 112.1° | 111.0° |
| C19 | S | O2 | C21 | 111.1° | 111.0° |
| C19 | S | C21 | C22 | 44.7° | 44.9° |
| S | C19 | C18 | C23 | 8.7° | 3.1° |
| S | C19 | C20 | H23 | 7.9° | 1.6° |
| C19 | S | C21 | H25 | 75.5° | 74.5° |
| C19 | S | C21 | H24 | 164.9° | 164.4° |
| O1 | S | O2 | C21 | 125.3° | 131.9° |
| O1 | S | C21 | C22 | 160.2° | 66.5° |
| O1 | S | C21 | H25 | 40.0° | 174.1° |
| O1 | S | C21 | H24 | 79.6° | 53.0° |
| O2 | S | C21 | C22 | 69.9° | 156.3° |
| O2 | S | C21 | H25 | 169.9° | 37.0° |
| O2 | S | C21 | H24 | 50.3° | 84.2° |
| S | C21 | C22 | H25 | 120.2° | 119.4° |
| S | C21 | C22 | H24 | 120.2° | 119.5° |
| S | C21 | C22 | C23 | 69.4° | 71.3° |
| S | C21 | H25 | H24 | 119.3° | 121.2° |
| S | C21 | C22 | H27 | 170.5° | 48.6° |
| S | C21 | C22 | H26 | 50.7° | 168.8° |
| C21 | C22 | C23 | H27 | 120.1° | 119.9° |
| C21 | C22 | C23 | H26 | 120.1° | 120.0° |
| C21 | C22 | C23 | C18 | 58.7° | 61.7° |
| C22 | C21 | H25 | H24 | 119.4° | 121.2° |
| C21 | C22 | H27 | H26 | 119.7° | 120.2° |
| C21 | C22 | C23 | H28 | 61.8° | 177.1° |
| C21 | C22 | C23 | H29 | 179.2° | 59.2° |
| C22 | C23 | C18 | H28 | 120.5° | 121.1° |
| C22 | C23 | C18 | H29 | 120.5° | 121.0° |
| C23 | C22 | C21 | H25 | 50.8° | 48.1° |
| C23 | C22 | C21 | H24 | 170.5° | 169.3° |
| C23 | C22 | H27 | H26 | 119.7° | 120.2° |
| C22 | C23 | H28 | H29 | 118.5° | 117.9° |
| C23 | C18 | C17 | H22 | 1.3° | 1.9° |
| C18 | C23 | C22 | H27 | 178.8° | 58.2° |
| C18 | C23 | C22 | H26 | 61.4° | 178.3° |
| C18 | C23 | H28 | H29 | 118.5° | 117.8° |
| H13 | C10 | C9 | H12 | 29.8° | 26.9° |
| H14 | C10 | C9 | H12 | 158.9° | 157.4° |
| H22 | C17 | C16 | H21 | 0.9° | 0.1° |
| H25 | C21 | C22 | H27 | 69.3° | 168.0° |
| H25 | C21 | C22 | H26 | 170.9° | 71.9° |
| H24 | C21 | C22 | H27 | 50.4° | 70.9° |
| H24 | C21 | C22 | H26 | 69.5° | 49.3° |
| H27 | C22 | C23 | H28 | 58.3° | 63.0° |
| H27 | C22 | C23 | H29 | 60.7° | 179.2° |
| H26 | C22 | C23 | H28 | 178.1° | 57.2° |
| H26 | C22 | C23 | H29 | 59.1° | 60.7° |
| H | C3 | C1 | H5 | 179.9° | 180.0° |
| H | C3 | N | H9 | 142.0° | 145.0° |
| H5 | C1 | C2 | H6 | 62.2° | 180.0° |
| H5 | C1 | C2 | H7 | 57.8° | 60.0° |
| H5 | C1 | C2 | H8 | 177.8° | 60.1° |
| H5 | C1 | C | H3 | 62.2° | 60.1° |
| H5 | C1 | C | H2 | 177.8° | 60.0° |
| H5 | C1 | C | H4 | 57.8° | 180.0° |
| H6 | C2 | H7 | H8 | 120.0° | 120.0° |
| H3 | C | H2 | H4 | 120.0° | 120.0° |
| H11 | N4 | C9 | H12 | 132.7° | 158.0° |
| H12 | C9 | C12 | H19 | 30.0° | 157.6° |
| H12 | C9 | C12 | H18 | 159.0° | 27.1° |
| H15 | C11 | H17 | H16 | 120.0° | 120.0° |
