GD9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C15 | sing | 1.43Å | 1.42Å | |
| O3 | C16 | sing | 1.43Å | 1.42Å | |
| C4 | N2 | doub | 1.32Å | 1.36Å | Aromatic |
| C4 | N3 | sing | 1.39Å | 1.37Å | |
| C4 | C1 | sing | 1.41Å | 1.40Å | Aromatic |
| C5 | C6 | doub | 1.32Å | 1.33Å | Aromatic |
| C5 | C7 | sing | 1.51Å | 1.51Å | |
| C5 | S1 | sing | 1.75Å | 1.68Å | Aromatic |
| C6 | C2 | sing | 1.45Å | 1.45Å | Aromatic |
| N1 | C2 | sing | 1.35Å | 1.33Å | Aromatic |
| N1 | C3 | doub | 1.32Å | 1.35Å | Aromatic |
| C7 | N4 | sing | 1.47Å | 1.44Å | |
| C8 | C3 | sing | 1.48Å | 1.39Å | Aromatic |
| C8 | C18 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | C22 | sing | 1.41Å | 1.37Å | Aromatic |
| N2 | C3 | sing | 1.33Å | 1.36Å | Aromatic |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| C9 | N4 | sing | 1.47Å | 1.46Å | |
| C10 | N5 | sing | 1.47Å | 1.47Å | |
| C11 | C12 | sing | 1.53Å | 1.51Å | |
| C11 | N5 | sing | 1.47Å | 1.44Å | |
| C12 | N4 | sing | 1.47Å | 1.45Å | |
| N3 | C14 | sing | 1.47Å | 1.46Å | |
| N3 | C17 | sing | 1.47Å | 1.46Å | |
| C13 | S2 | sing | 1.81Å | 1.82Å | |
| C14 | C15 | sing | 1.53Å | 1.52Å | |
| O2 | S2 | doub | 1.42Å | 1.47Å | |
| S2 | O1 | doub | 1.42Å | 1.47Å | |
| S2 | N5 | sing | 1.66Å | 1.72Å | |
| S1 | C1 | sing | 1.76Å | 1.70Å | Aromatic |
| C2 | C1 | doub | 1.40Å | 1.37Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.39Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.38Å | Aromatic |
| C21 | N6 | sing | 1.37Å | 1.38Å | Aromatic |
| C21 | C22 | doub | 1.41Å | 1.34Å | Aromatic |
| N6 | N7 | sing | 1.40Å | 1.43Å | Aromatic |
| C22 | C23 | sing | 1.41Å | 1.43Å | Aromatic |
| C23 | N7 | doub | 1.30Å | 1.35Å | Aromatic |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C6 | H6 | sing | 1.08Å | 1.08Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H7A | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H9A | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H10A | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C11 | H11A | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H12A | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H13A | sing | 1.09Å | 1.10Å | |
| C13 | H13B | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H14A | sing | 1.09Å | 1.10Å | |
| C15 | H15 | sing | 1.09Å | 1.10Å | |
| C15 | H15A | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| N6 | HN6 | sing | 0.97Å | 1.00Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H16A | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H17A | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C15 | O3 | C16 | 110.6° | 113.8° |
| O3 | C15 | C14 | 112.3° | 109.3° |
| O3 | C15 | H15 | 108.5° | 109.5° |
| O3 | C15 | H15A | 107.9° | 109.5° |
| O3 | C16 | C17 | 107.8° | 109.3° |
| O3 | C16 | H16 | 110.0° | 109.5° |
| O3 | C16 | H16A | 110.4° | 109.5° |
| N2 | C4 | N3 | 118.9° | 120.5° |
| N2 | C4 | C1 | 116.4° | 119.0° |
| C4 | N2 | C3 | 122.1° | 120.8° |
| N3 | C4 | C1 | 124.7° | 120.5° |
| C4 | N3 | C14 | 117.1° | 111.0° |
| C4 | N3 | C17 | 123.6° | 111.0° |
| C4 | C1 | S1 | 128.3° | 131.4° |
| C4 | C1 | C2 | 119.7° | 118.8° |
| C6 | C5 | C7 | 121.4° | 124.3° |
| C6 | C5 | S1 | 116.1° | 111.3° |
| C5 | C6 | C2 | 109.0° | 114.8° |
| C5 | C6 | H6 | 125.5° | 122.6° |
| C7 | C5 | S1 | 122.5° | 124.4° |
| C5 | C7 | N4 | 111.5° | 109.5° |
| C5 | C7 | H7 | 108.8° | 109.4° |
| C5 | C7 | H7A | 108.3° | 109.5° |
| C5 | S1 | C1 | 90.7° | 92.1° |
| C6 | C2 | N1 | 125.6° | 129.9° |
| C6 | C2 | C1 | 112.2° | 112.0° |
| C2 | C6 | H6 | 125.5° | 122.6° |
| C2 | N1 | C3 | 118.4° | 121.0° |
| N1 | C2 | C1 | 122.2° | 118.1° |
| N1 | C3 | C8 | 116.2° | 118.9° |
| N1 | C3 | N2 | 121.1° | 122.2° |
| C7 | N4 | C9 | 113.3° | 111.0° |
| C7 | N4 | C12 | 111.1° | 111.0° |
| N4 | C7 | H7 | 108.8° | 109.5° |
| N4 | C7 | H7A | 108.4° | 109.5° |
| C3 | C8 | C18 | 121.3° | 120.3° |
| C3 | C8 | C22 | 120.9° | 120.3° |
| C8 | C3 | N2 | 122.7° | 118.9° |
| C18 | C8 | C22 | 117.8° | 119.5° |
| C8 | C18 | C19 | 119.3° | 120.4° |
| C8 | C18 | H18 | 120.3° | 119.8° |
| C8 | C22 | C21 | 124.0° | 119.5° |
| C8 | C22 | C23 | 129.4° | 133.6° |
| C10 | C9 | N4 | 108.1° | 109.3° |
| C9 | C10 | N5 | 108.9° | 108.5° |
| C10 | C9 | H9 | 109.9° | 109.5° |
| C10 | C9 | H9A | 110.2° | 109.5° |
| C9 | C10 | H10 | 109.7° | 109.6° |
| C9 | C10 | H10A | 109.8° | 109.7° |
| C9 | N4 | C12 | 111.9° | 111.3° |
| N4 | C9 | H9 | 109.9° | 109.5° |
| N4 | C9 | H9A | 110.2° | 109.5° |
| C10 | N5 | C11 | 111.5° | 118.2° |
| C10 | N5 | S2 | 112.7° | 120.9° |
| N5 | C10 | H10 | 109.7° | 109.6° |
| N5 | C10 | H10A | 109.8° | 109.6° |
| C12 | C11 | N5 | 104.7° | 108.6° |
| C11 | C12 | N4 | 101.8° | 109.3° |
| C12 | C11 | H11 | 111.1° | 109.6° |
| C12 | C11 | H11A | 112.1° | 109.7° |
| C11 | C12 | H12 | 112.1° | 109.5° |
| C11 | C12 | H12A | 113.7° | 109.5° |
| C11 | N5 | S2 | 106.8° | 120.9° |
| N5 | C11 | H11 | 111.1° | 109.6° |
| N5 | C11 | H11A | 112.1° | 109.6° |
| N4 | C12 | H12 | 112.1° | 109.5° |
| N4 | C12 | H12A | 113.7° | 109.5° |
| C14 | N3 | C17 | 116.1° | 110.8° |
| N3 | C14 | C15 | 109.4° | 109.3° |
| N3 | C14 | H14 | 109.5° | 109.5° |
| N3 | C14 | H14A | 109.5° | 109.5° |
| N3 | C17 | C16 | 105.6° | 109.3° |
| N3 | C17 | H17 | 110.8° | 109.5° |
| N3 | C17 | H17A | 111.6° | 109.5° |
| C13 | S2 | O2 | 111.7° | 110.5° |
| C13 | S2 | O1 | 109.4° | 110.5° |
| C13 | S2 | N5 | 108.2° | 104.5° |
| S2 | C13 | H13 | 109.5° | 109.4° |
| S2 | C13 | H13A | 109.5° | 109.5° |
| S2 | C13 | H13B | 109.5° | 109.5° |
| C15 | C14 | H14 | 109.5° | 109.5° |
| C15 | C14 | H14A | 109.5° | 109.5° |
| C14 | C15 | H15 | 108.6° | 109.5° |
| C14 | C15 | H15A | 107.9° | 109.6° |
| O2 | S2 | O1 | 110.2° | 121.0° |
| O2 | S2 | N5 | 107.1° | 104.3° |
| O1 | S2 | N5 | 110.2° | 104.3° |
| S1 | C1 | C2 | 112.0° | 109.8° |
| C18 | C19 | C20 | 120.5° | 120.8° |
| C19 | C18 | H18 | 120.4° | 119.8° |
| C18 | C19 | H19 | 119.7° | 119.6° |
| C19 | C20 | C21 | 120.0° | 120.1° |
| C20 | C19 | H19 | 119.8° | 119.6° |
| C19 | C20 | H20 | 120.0° | 119.9° |
| C20 | C21 | N6 | 129.6° | 133.7° |
| C20 | C21 | C22 | 118.4° | 119.8° |
| C21 | C20 | H20 | 120.0° | 119.9° |
| N6 | C21 | C22 | 112.1° | 106.6° |
| C21 | N6 | N7 | 104.3° | 108.1° |
| C21 | N6 | HN6 | 127.9° | 126.0° |
| C21 | C22 | C23 | 106.6° | 106.9° |
| N6 | N7 | C23 | 109.6° | 109.7° |
| N7 | N6 | HN6 | 127.8° | 125.9° |
| C22 | C23 | N7 | 107.4° | 108.7° |
| C22 | C23 | H23 | 126.3° | 125.6° |
| N7 | C23 | H23 | 126.3° | 125.7° |
| C17 | C16 | H16 | 110.0° | 109.5° |
| C17 | C16 | H16A | 110.4° | 109.5° |
| C16 | C17 | H17 | 110.8° | 109.6° |
| C16 | C17 | H17A | 111.6° | 109.5° |
| H7 | C7 | H7A | 111.1° | 109.4° |
| H9 | C9 | H9A | 108.5° | 109.5° |
| H10 | C10 | H10A | 109.1° | 109.8° |
| H11 | C11 | H11A | 105.9° | 109.8° |
| H12 | C12 | H12A | 103.7° | 109.6° |
| H13 | C13 | H13A | 109.5° | 109.5° |
| H13 | C13 | H13B | 109.4° | 109.5° |
| H13A | C13 | H13B | 109.5° | 109.5° |
| H14 | C14 | H14A | 109.4° | 109.5° |
| H15 | C15 | H15A | 111.7° | 109.6° |
| H16 | C16 | H16A | 108.2° | 109.6° |
| H17 | C17 | H17A | 106.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C15 | C14 | N3 | 47.2° | 56.8° |
| O3 | C15 | C14 | H15 | 120.0° | 119.9° |
| O3 | C15 | C14 | H15A | 118.8° | 120.0° |
| C15 | O3 | C16 | C17 | 67.4° | 58.6° |
| O3 | C15 | C14 | H14 | 72.8° | 63.1° |
| O3 | C15 | C14 | H14A | 167.3° | 176.8° |
| O3 | C15 | H15 | H15A | 118.8° | 120.1° |
| C15 | O3 | C16 | H16 | 172.6° | 178.6° |
| C15 | O3 | C16 | H16A | 53.2° | 61.3° |
| O3 | C16 | C17 | N3 | 63.4° | 56.9° |
| C16 | O3 | C15 | C14 | 59.2° | 58.6° |
| O3 | C16 | C17 | H16 | 120.0° | 119.9° |
| O3 | C16 | C17 | H16A | 120.6° | 119.9° |
| C16 | O3 | C15 | H15 | 60.8° | 61.3° |
| C16 | O3 | C15 | H15A | 178.0° | 178.6° |
| O3 | C16 | H16 | H16A | 120.7° | 120.1° |
| O3 | C16 | C17 | H17 | 176.6° | 176.8° |
| O3 | C16 | C17 | H17A | 58.0° | 63.1° |
| N2 | C4 | N3 | C1 | 178.0° | 179.7° |
| C4 | N2 | C3 | N1 | 0.8° | 0.0° |
| C4 | N2 | C3 | C8 | 179.0° | 179.5° |
| N2 | C4 | N3 | C14 | 25.6° | 0.0° |
| N2 | C4 | N3 | C17 | 133.4° | 123.6° |
| N2 | C4 | C1 | S1 | 179.5° | 179.9° |
| N2 | C4 | C1 | C2 | 0.2° | 0.0° |
| N3 | C4 | N2 | C3 | 178.4° | 180.0° |
| C4 | N3 | C14 | C17 | 160.6° | 123.8° |
| C4 | N3 | C14 | C15 | 150.7° | 177.6° |
| N3 | C4 | C1 | S1 | 2.5° | 0.3° |
| N3 | C4 | C1 | C2 | 178.3° | 179.8° |
| C4 | N3 | C17 | C16 | 144.3° | 177.6° |
| C4 | N3 | C14 | H14 | 89.3° | 62.5° |
| C4 | N3 | C14 | H14A | 30.7° | 57.6° |
| C4 | N3 | C17 | H17 | 24.2° | 57.6° |
| C4 | N3 | C17 | H17A | 94.3° | 62.4° |
| C4 | C1 | S1 | C5 | 180.0° | 180.0° |
| C4 | C1 | C2 | C6 | 179.9° | 179.9° |
| C4 | C1 | C2 | N1 | 0.8° | 0.5° |
| C1 | C4 | N2 | C3 | 0.2° | 0.3° |
| C1 | C4 | N3 | C14 | 152.3° | 179.7° |
| C1 | C4 | N3 | C17 | 48.6° | 56.6° |
| C4 | C1 | S1 | C2 | 179.3° | 179.9° |
| C6 | C5 | C7 | S1 | 179.5° | 179.7° |
| C5 | C6 | C2 | H6 | 180.0° | 180.0° |
| C5 | C6 | C2 | N1 | 179.4° | 179.4° |
| C6 | C5 | C7 | N4 | 77.1° | 90.0° |
| C6 | C5 | S1 | C1 | 0.5° | 0.2° |
| C5 | C6 | C2 | C1 | 0.3° | 0.2° |
| C6 | C5 | C7 | H7 | 162.9° | 150.0° |
| C6 | C5 | C7 | H7A | 42.1° | 30.1° |
| C7 | C5 | C6 | C2 | 179.3° | 180.0° |
| C5 | C7 | N4 | H7 | 120.0° | 120.0° |
| C5 | C7 | N4 | H7A | 119.1° | 120.1° |
| C5 | C7 | N4 | C9 | 159.7° | 170.0° |
| C5 | C7 | N4 | C12 | 73.3° | 65.7° |
| C7 | C5 | S1 | C1 | 179.0° | 179.9° |
| C7 | C5 | C6 | H6 | 0.7° | 0.0° |
| C5 | C7 | H7 | H7A | 119.2° | 120.0° |
| S1 | C5 | C6 | C2 | 0.2° | 0.2° |
| S1 | C5 | C7 | N4 | 103.4° | 89.7° |
| C5 | S1 | C1 | C2 | 0.7° | 0.1° |
| S1 | C5 | C6 | H6 | 179.8° | 179.8° |
| S1 | C5 | C7 | H7 | 16.6° | 30.3° |
| S1 | C5 | C7 | H7A | 137.5° | 150.2° |
| C6 | C2 | N1 | C1 | 179.0° | 179.2° |
| C6 | C2 | N1 | C3 | 179.7° | 180.0° |
| C6 | C2 | C1 | S1 | 0.7° | 0.0° |
| C2 | N1 | C3 | C8 | 179.7° | 180.0° |
| C2 | N1 | C3 | N2 | 1.3° | 0.6° |
| N1 | C2 | C1 | S1 | 179.8° | 179.4° |
| N1 | C2 | C6 | H6 | 0.7° | 0.5° |
| N1 | C3 | C8 | N2 | 178.3° | 179.5° |
| N1 | C3 | C8 | C18 | 32.9° | 180.0° |
| N1 | C3 | C8 | C22 | 144.7° | 0.3° |
| C3 | N1 | C2 | C1 | 1.4° | 0.8° |
| C7 | N4 | C9 | C10 | 173.1° | 172.7° |
| C7 | N4 | C9 | C12 | 126.5° | 124.1° |
| C7 | N4 | C12 | C11 | 161.7° | 172.8° |
| N4 | C7 | H7 | H7A | 119.2° | 120.0° |
| C7 | N4 | C9 | H9 | 53.1° | 52.8° |
| C7 | N4 | C9 | H9A | 66.4° | 67.3° |
| C7 | N4 | C12 | H12 | 78.3° | 67.3° |
| C7 | N4 | C12 | H12A | 38.9° | 52.8° |
| C3 | C8 | C18 | C22 | 177.7° | 179.7° |
| C3 | C8 | C18 | C19 | 179.1° | 180.0° |
| C3 | C8 | C22 | C21 | 178.6° | 179.8° |
| C3 | C8 | C22 | C23 | 2.1° | 0.0° |
| C3 | C8 | C18 | H18 | 0.9° | 0.1° |
| C18 | C8 | C3 | N2 | 148.8° | 0.5° |
| C8 | C18 | C19 | H18 | 180.0° | 179.9° |
| C8 | C18 | C19 | C20 | 1.1° | 0.0° |
| C18 | C8 | C22 | C21 | 0.9° | 0.5° |
| C18 | C8 | C22 | C23 | 179.7° | 179.7° |
| C8 | C18 | C19 | H19 | 178.9° | 180.0° |
| C22 | C8 | C3 | N2 | 33.6° | 179.2° |
| C22 | C8 | C18 | C19 | 1.4° | 0.3° |
| C8 | C22 | C21 | C20 | 0.0° | 0.6° |
| C8 | C22 | C21 | N6 | 179.6° | 179.7° |
| C8 | C22 | C21 | C23 | 179.5° | 179.8° |
| C8 | C22 | C23 | N7 | 179.8° | 179.2° |
| C22 | C8 | C18 | H18 | 178.6° | 179.8° |
| C8 | C22 | C23 | H23 | 0.2° | 0.0° |
| C10 | C9 | N4 | H9 | 120.0° | 119.9° |
| C10 | C9 | N4 | H9A | 120.5° | 120.0° |
| C9 | C10 | N5 | H10 | 120.0° | 119.7° |
| C9 | C10 | N5 | H10A | 120.2° | 119.8° |
| C9 | C10 | N5 | C11 | 57.1° | 51.2° |
| C10 | C9 | N4 | C12 | 60.4° | 63.2° |
| C9 | C10 | N5 | S2 | 177.1° | 128.8° |
| C10 | C9 | H9 | H9A | 120.5° | 120.1° |
| C9 | C10 | H10 | H10A | 120.3° | 120.5° |
| N4 | C9 | C10 | N5 | 49.6° | 53.9° |
| C9 | N4 | C12 | C11 | 70.5° | 63.1° |
| C9 | N4 | C7 | H7 | 80.3° | 70.0° |
| C9 | N4 | C7 | H7A | 40.6° | 50.0° |
| N4 | C9 | H9 | H9A | 120.6° | 120.1° |
| N4 | C9 | C10 | H10 | 169.6° | 173.5° |
| N4 | C9 | C10 | H10A | 70.6° | 65.8° |
| C9 | N4 | C12 | H12 | 49.5° | 56.8° |
| C9 | N4 | C12 | H12A | 166.7° | 176.9° |
| C10 | N5 | C11 | C12 | 68.7° | 51.2° |
| C10 | N5 | C11 | S2 | 123.5° | 179.9° |
| C10 | N5 | S2 | C13 | 65.4° | 90.0° |
| C10 | N5 | S2 | O2 | 55.1° | 26.1° |
| C10 | N5 | S2 | O1 | 175.1° | 153.9° |
| N5 | C10 | C9 | H9 | 169.6° | 173.8° |
| N5 | C10 | C9 | H9A | 70.9° | 66.1° |
| N5 | C10 | H10 | H10A | 120.2° | 120.5° |
| C10 | N5 | C11 | H11 | 51.3° | 68.5° |
| C10 | N5 | C11 | H11A | 169.5° | 170.9° |
| C12 | C11 | N5 | H11 | 120.0° | 119.7° |
| C12 | C11 | N5 | H11A | 121.8° | 119.8° |
| C11 | C12 | N4 | H12 | 120.0° | 119.9° |
| C11 | C12 | N4 | H12A | 122.8° | 120.0° |
| C12 | C11 | N5 | S2 | 167.8° | 128.8° |
| C12 | C11 | H11 | H11A | 121.9° | 120.5° |
| C11 | C12 | H12 | H12A | 123.1° | 120.1° |
| N5 | C11 | C12 | N4 | 71.3° | 53.8° |
| C11 | N5 | S2 | C13 | 171.8° | 90.0° |
| C11 | N5 | S2 | O2 | 67.6° | 153.9° |
| C11 | N5 | S2 | O1 | 52.3° | 26.0° |
| C11 | N5 | C10 | H10 | 177.0° | 170.9° |
| C11 | N5 | C10 | H10A | 63.2° | 68.6° |
| N5 | C11 | H11 | H11A | 121.9° | 120.4° |
| N5 | C11 | C12 | H12 | 48.7° | 66.1° |
| N5 | C11 | C12 | H12A | 166.0° | 173.8° |
| C12 | N4 | C7 | H7 | 46.7° | 54.3° |
| C12 | N4 | C7 | H7A | 167.5° | 174.3° |
| C12 | N4 | C9 | H9 | 179.7° | 176.9° |
| C12 | N4 | C9 | H9A | 60.2° | 56.9° |
| N4 | C12 | C11 | H11 | 48.7° | 65.9° |
| N4 | C12 | C11 | H11A | 166.9° | 173.5° |
| N4 | C12 | H12 | H12A | 123.1° | 120.1° |
| N3 | C14 | C15 | H14 | 120.0° | 119.9° |
| N3 | C14 | C15 | H14A | 120.0° | 120.0° |
| C14 | N3 | C17 | C16 | 56.5° | 58.6° |
| N3 | C14 | H14 | H14A | 120.0° | 120.1° |
| N3 | C14 | C15 | H15 | 72.8° | 63.1° |
| N3 | C14 | C15 | H15A | 166.0° | 176.7° |
| C14 | N3 | C17 | H17 | 176.5° | 178.6° |
| C14 | N3 | C17 | H17A | 64.9° | 61.4° |
| C17 | N3 | C14 | C15 | 48.7° | 58.6° |
| N3 | C17 | C16 | H17 | 120.0° | 120.0° |
| N3 | C17 | C16 | H17A | 121.4° | 119.9° |
| C17 | N3 | C14 | H14 | 71.3° | 61.3° |
| C17 | N3 | C14 | H14A | 168.7° | 178.6° |
| N3 | C17 | C16 | H16 | 176.6° | 176.8° |
| N3 | C17 | C16 | H16A | 57.2° | 63.1° |
| N3 | C17 | H17 | H17A | 121.5° | 120.0° |
| C13 | S2 | O2 | O1 | 121.8° | 131.5° |
| C13 | S2 | O2 | N5 | 118.3° | 111.8° |
| C13 | S2 | O1 | N5 | 118.8° | 111.8° |
| S2 | C13 | H13 | H13A | 120.0° | 120.0° |
| S2 | C13 | H13 | H13B | 120.0° | 120.0° |
| S2 | C13 | H13A | H13B | 120.0° | 120.0° |
| C15 | C14 | H14 | H14A | 120.0° | 120.1° |
| C14 | C15 | H15 | H15A | 118.9° | 120.2° |
| O2 | S2 | O1 | N5 | 118.0° | 116.8° |
| O2 | S2 | C13 | H13 | 126.9° | 51.6° |
| O2 | S2 | C13 | H13A | 6.8° | 171.7° |
| O2 | S2 | C13 | H13B | 113.2° | 68.3° |
| O1 | S2 | C13 | H13 | 110.9° | 171.7° |
| O1 | S2 | C13 | H13A | 129.1° | 51.7° |
| O1 | S2 | C13 | H13B | 9.1° | 68.4° |
| S2 | N5 | C10 | H10 | 62.9° | 9.1° |
| S2 | N5 | C10 | H10A | 56.9° | 111.5° |
| S2 | N5 | C11 | H11 | 72.2° | 111.5° |
| S2 | N5 | C11 | H11A | 46.1° | 9.0° |
| N5 | S2 | C13 | H13 | 9.2° | 60.0° |
| N5 | S2 | C13 | H13A | 110.8° | 60.0° |
| N5 | S2 | C13 | H13B | 129.1° | 180.0° |
| C1 | C2 | C6 | H6 | 179.7° | 179.8° |
| C18 | C19 | C20 | H19 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.1° | 0.0° |
| C18 | C19 | C20 | H20 | 179.9° | 180.0° |
| C19 | C20 | C21 | H20 | 180.0° | 180.0° |
| C19 | C20 | C21 | N6 | 179.9° | 180.0° |
| C19 | C20 | C21 | C22 | 0.4° | 0.3° |
| C20 | C19 | C18 | H18 | 178.9° | 180.0° |
| C20 | C21 | N6 | C22 | 179.5° | 179.7° |
| C20 | C21 | N6 | N7 | 179.7° | 180.0° |
| C20 | C21 | C22 | C23 | 179.5° | 179.6° |
| C21 | C20 | C19 | H19 | 179.9° | 180.0° |
| C20 | C21 | N6 | HN6 | 0.3° | 0.1° |
| C21 | N6 | N7 | HN6 | 180.0° | 179.9° |
| N6 | C21 | C22 | C23 | 0.1° | 0.1° |
| C21 | N6 | N7 | C23 | 0.4° | 0.6° |
| N6 | C21 | C20 | H20 | 0.1° | 0.0° |
| C22 | C21 | N6 | N7 | 0.1° | 0.3° |
| C21 | C22 | C23 | N7 | 0.4° | 0.5° |
| C22 | C21 | C20 | H20 | 179.6° | 179.7° |
| C22 | C21 | N6 | HN6 | 179.9° | 179.8° |
| C21 | C22 | C23 | H23 | 179.6° | 179.8° |
| N6 | N7 | C23 | C22 | 0.5° | 0.7° |
| N6 | N7 | C23 | H23 | 179.5° | 179.9° |
| C22 | C23 | N7 | H23 | 180.0° | 179.2° |
| C23 | N7 | N6 | HN6 | 179.6° | 179.5° |
| C17 | C16 | H16 | H16A | 120.7° | 120.1° |
| C16 | C17 | H17 | H17A | 121.6° | 120.1° |
| H9 | C9 | C10 | H10 | 70.4° | 66.6° |
| H9 | C9 | C10 | H10A | 49.4° | 54.1° |
| H9A | C9 | C10 | H10 | 49.1° | 53.5° |
| H9A | C9 | C10 | H10A | 168.9° | 174.2° |
| H11 | C11 | C12 | H12 | 168.7° | 174.2° |
| H11 | C11 | C12 | H12A | 74.1° | 54.1° |
| H11A | C11 | C12 | H12 | 73.0° | 53.6° |
| H11A | C11 | C12 | H12A | 44.2° | 66.5° |
| H13 | C13 | H13A | H13B | 120.0° | 120.1° |
| H14 | C14 | C15 | H15 | 167.2° | 177.0° |
| H14 | C14 | C15 | H15A | 46.0° | 56.8° |
| H14A | C14 | C15 | H15 | 47.3° | 56.9° |
| H14A | C14 | C15 | H15A | 74.0° | 63.3° |
| H18 | C18 | C19 | H19 | 1.1° | 0.1° |
| H19 | C19 | C20 | H20 | 0.1° | 0.0° |
| H16 | C16 | C17 | H17 | 56.6° | 63.3° |
| H16 | C16 | C17 | H17A | 62.0° | 56.8° |
| H16A | C16 | C17 | H17 | 62.8° | 56.9° |
| H16A | C16 | C17 | H17A | 178.6° | 177.0° |
