JGZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | doub | 1.39Å | 1.38Å | Aromatic |
| C1 | N6 | sing | 1.33Å | 1.37Å | Aromatic |
| C1 | O7 | sing | 1.35Å | 1.35Å | |
| C2 | C3 | sing | 1.38Å | 1.41Å | Aromatic |
| C3 | N4 | doub | 1.32Å | 1.36Å | Aromatic |
| N4 | C5 | sing | 1.32Å | 1.34Å | Aromatic |
| C5 | N6 | doub | 1.32Å | 1.33Å | Aromatic |
| C5 | N9 | sing | 1.38Å | 1.39Å | |
| O7 | C8 | sing | 1.36Å | 1.41Å | |
| C8 | C22 | doub | 1.39Å | 1.41Å | Aromatic |
| C8 | C26 | sing | 1.39Å | 1.43Å | Aromatic |
| N9 | C10 | sing | 1.46Å | 1.43Å | |
| C10 | C11 | sing | 1.53Å | 1.51Å | |
| C10 | C15 | sing | 1.53Å | 1.51Å | |
| C11 | C12 | sing | 1.53Å | 1.54Å | |
| C12 | N13 | sing | 1.47Å | 1.47Å | |
| N13 | C14 | sing | 1.47Å | 1.45Å | |
| N13 | C16 | sing | 1.40Å | 1.42Å | |
| C14 | C15 | sing | 1.53Å | 1.53Å | |
| C16 | C17 | doub | 1.39Å | 1.40Å | Aromatic |
| C16 | C21 | sing | 1.39Å | 1.41Å | Aromatic |
| C17 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C18 | C19 | doub | 1.38Å | 1.41Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.40Å | Aromatic |
| C19 | S31 | sing | 1.76Å | 1.77Å | |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C23 | sing | 1.38Å | 1.36Å | Aromatic |
| C22 | C28 | sing | 1.51Å | 1.52Å | |
| C23 | C24 | doub | 1.40Å | 1.40Å | Aromatic |
| C24 | C25 | sing | 1.40Å | 1.39Å | Aromatic |
| C24 | C29 | sing | 1.43Å | 1.43Å | |
| C25 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C26 | C27 | sing | 1.51Å | 1.51Å | |
| C29 | N30 | trip | 1.14Å | 1.13Å | |
| S31 | N32 | sing | 1.66Å | 1.66Å | |
| S31 | O33 | doub | 1.42Å | 1.41Å | |
| S31 | O34 | doub | 1.42Å | 1.41Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C3 | H3 | sing | 1.08Å | 1.08Å | |
| N9 | HN9 | sing | 0.97Å | 1.00Å | |
| C10 | H10 | 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 | |
| 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 | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C20 | H20 | sing | 1.08Å | 1.08Å | |
| C21 | H21 | sing | 1.08Å | 1.08Å | |
| C23 | H23 | sing | 1.08Å | 1.08Å | |
| C25 | H25 | sing | 1.08Å | 1.08Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C27 | H27A | sing | 1.09Å | 1.10Å | |
| C27 | H27B | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H28A | sing | 1.09Å | 1.10Å | |
| C28 | H28B | sing | 1.09Å | 1.10Å | |
| N32 | HN32 | sing | 0.97Å | 1.00Å | |
| N32 | HN3A | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C2 | C1 | N6 | 117.8° | 119.0° |
| C2 | C1 | O7 | 120.8° | 120.5° |
| C1 | C2 | C3 | 116.5° | 118.5° |
| C1 | C2 | H2 | 121.8° | 120.7° |
| N6 | C1 | O7 | 121.4° | 120.5° |
| C1 | N6 | C5 | 126.0° | 120.7° |
| C1 | O7 | C8 | 117.0° | 118.0° |
| C2 | C3 | N4 | 122.0° | 119.3° |
| C3 | C2 | H2 | 121.8° | 120.8° |
| C2 | C3 | H3 | 119.0° | 120.3° |
| C3 | N4 | C5 | 120.9° | 120.9° |
| N4 | C3 | H3 | 119.0° | 120.4° |
| N4 | C5 | N6 | 116.8° | 121.7° |
| N4 | C5 | N9 | 122.8° | 119.1° |
| N6 | C5 | N9 | 120.4° | 119.2° |
| C5 | N9 | C10 | 119.4° | 120.0° |
| C5 | N9 | HN9 | 106.3° | 120.0° |
| O7 | C8 | C22 | 120.3° | 119.9° |
| O7 | C8 | C26 | 122.0° | 119.9° |
| C22 | C8 | C26 | 117.7° | 120.2° |
| C8 | C22 | C23 | 120.1° | 120.1° |
| C8 | C22 | C28 | 121.8° | 120.0° |
| C8 | C26 | C25 | 121.4° | 120.0° |
| C8 | C26 | C27 | 120.5° | 119.9° |
| N9 | C10 | C11 | 110.7° | 109.5° |
| N9 | C10 | C15 | 100.2° | 109.5° |
| C10 | N9 | HN9 | 106.3° | 120.0° |
| N9 | C10 | H10 | 114.5° | 109.5° |
| C11 | C10 | C15 | 109.2° | 109.2° |
| C10 | C11 | C12 | 112.1° | 109.3° |
| C11 | C10 | H10 | 106.3° | 109.6° |
| C10 | C11 | H11 | 108.6° | 109.5° |
| C10 | C11 | H11A | 108.6° | 109.5° |
| C10 | C15 | C14 | 112.1° | 109.3° |
| C15 | C10 | H10 | 115.8° | 109.5° |
| C10 | C15 | H15 | 108.6° | 109.5° |
| C10 | C15 | H15A | 108.6° | 109.5° |
| C11 | C12 | N13 | 111.3° | 109.5° |
| C12 | C11 | H11 | 108.6° | 109.5° |
| C12 | C11 | H11A | 108.6° | 109.5° |
| C11 | C12 | H12 | 108.9° | 109.5° |
| C11 | C12 | H12A | 108.9° | 109.5° |
| C12 | N13 | C14 | 107.4° | 111.2° |
| C12 | N13 | C16 | 119.0° | 111.0° |
| N13 | C12 | H12 | 108.9° | 109.5° |
| N13 | C12 | H12A | 108.8° | 109.5° |
| C14 | N13 | C16 | 109.1° | 111.0° |
| N13 | C14 | C15 | 110.8° | 109.5° |
| N13 | C14 | H14 | 109.0° | 109.5° |
| N13 | C14 | H14A | 109.0° | 109.5° |
| N13 | C16 | C17 | 118.5° | 120.0° |
| N13 | C16 | C21 | 123.6° | 120.1° |
| C15 | C14 | H14 | 109.1° | 109.4° |
| C15 | C14 | H14A | 109.0° | 109.4° |
| C14 | C15 | H15 | 108.6° | 109.5° |
| C14 | C15 | H15A | 108.6° | 109.5° |
| C17 | C16 | C21 | 117.8° | 119.8° |
| C16 | C17 | C18 | 121.1° | 119.9° |
| C16 | C17 | H17 | 119.5° | 120.0° |
| C16 | C21 | C20 | 122.0° | 119.9° |
| C16 | C21 | H21 | 119.0° | 120.0° |
| C17 | C18 | C19 | 120.1° | 120.1° |
| C18 | C17 | H17 | 119.5° | 120.1° |
| C17 | C18 | H18 | 120.0° | 120.0° |
| C18 | C19 | C20 | 119.9° | 120.2° |
| C18 | C19 | S31 | 119.4° | 119.9° |
| C19 | C18 | H18 | 119.9° | 120.0° |
| C20 | C19 | S31 | 120.7° | 119.9° |
| C19 | C20 | C21 | 119.1° | 120.1° |
| C19 | C20 | H20 | 120.4° | 120.0° |
| C19 | S31 | N32 | 106.1° | 107.3° |
| C19 | S31 | O33 | 105.1° | 106.4° |
| C19 | S31 | O34 | 107.3° | 106.4° |
| C21 | C20 | H20 | 120.4° | 120.0° |
| C20 | C21 | H21 | 119.0° | 120.0° |
| C23 | C22 | C28 | 118.2° | 120.0° |
| C22 | C23 | C24 | 121.8° | 120.0° |
| C22 | C23 | H23 | 119.1° | 120.0° |
| C22 | C28 | H28 | 109.5° | 109.5° |
| C22 | C28 | H28A | 109.4° | 109.5° |
| C22 | C28 | H28B | 109.5° | 109.5° |
| C23 | C24 | C25 | 119.9° | 119.8° |
| C23 | C24 | C29 | 118.3° | 120.2° |
| C24 | C23 | H23 | 119.1° | 120.0° |
| C25 | C24 | C29 | 121.8° | 120.1° |
| C24 | C25 | C26 | 119.0° | 120.0° |
| C24 | C25 | H25 | 120.5° | 120.0° |
| C24 | C29 | N30 | 179.9° | 179.9° |
| C25 | C26 | C27 | 118.1° | 120.0° |
| C26 | C25 | H25 | 120.5° | 120.0° |
| C26 | C27 | H27 | 109.5° | 109.5° |
| C26 | C27 | H27A | 109.4° | 109.5° |
| C26 | C27 | H27B | 109.4° | 109.5° |
| N32 | S31 | O33 | 110.4° | 106.4° |
| N32 | S31 | O34 | 104.4° | 106.4° |
| S31 | N32 | HN32 | 109.5° | 119.9° |
| S31 | N32 | HN3A | 109.5° | 120.0° |
| O33 | S31 | O34 | 122.5° | 123.1° |
| H11 | C11 | H11A | 110.3° | 109.5° |
| H12 | C12 | H12A | 110.1° | 109.4° |
| H14 | C14 | H14A | 109.9° | 109.4° |
| H15 | C15 | H15A | 110.3° | 109.5° |
| H27 | C27 | H27A | 109.5° | 109.4° |
| H27 | C27 | H27B | 109.5° | 109.4° |
| H27A | C27 | H27B | 109.5° | 109.5° |
| H28 | C28 | H28A | 109.5° | 109.5° |
| H28 | C28 | H28B | 109.5° | 109.5° |
| H28A | C28 | H28B | 109.5° | 109.4° |
| HN32 | N32 | HN3A | 109.4° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C2 | C1 | N6 | O7 | 179.7° | 179.7° |
| C1 | C2 | C3 | H2 | 180.0° | 180.0° |
| C1 | C2 | C3 | N4 | 0.1° | 0.1° |
| C2 | C1 | N6 | C5 | 0.9° | 0.0° |
| C2 | C1 | O7 | C8 | 178.6° | 179.9° |
| C1 | C2 | C3 | H3 | 179.9° | 180.0° |
| N6 | C1 | C2 | C3 | 0.3° | 0.0° |
| C1 | N6 | C5 | N4 | 1.2° | 0.1° |
| C1 | N6 | C5 | N9 | 179.4° | 180.0° |
| N6 | C1 | O7 | C8 | 1.7° | 0.4° |
| N6 | C1 | C2 | H2 | 179.7° | 180.0° |
| O7 | C1 | C2 | C3 | 179.4° | 179.7° |
| O7 | C1 | N6 | C5 | 178.8° | 179.7° |
| C1 | O7 | C8 | C22 | 71.0° | 90.1° |
| C1 | O7 | C8 | C26 | 108.3° | 90.3° |
| O7 | C1 | C2 | H2 | 0.6° | 0.3° |
| C2 | C3 | N4 | H3 | 180.0° | 179.9° |
| C2 | C3 | N4 | C5 | 0.3° | 0.0° |
| C3 | N4 | C5 | N6 | 0.8° | 0.0° |
| C3 | N4 | C5 | N9 | 179.7° | 180.0° |
| N4 | C3 | C2 | H2 | 179.9° | 180.0° |
| N4 | C5 | N6 | N9 | 179.4° | 180.0° |
| N4 | C5 | N9 | C10 | 174.1° | 0.0° |
| C5 | N4 | C3 | H3 | 179.6° | 180.0° |
| N4 | C5 | N9 | HN9 | 65.8° | 180.0° |
| N6 | C5 | N9 | C10 | 6.5° | 179.9° |
| N6 | C5 | N9 | HN9 | 113.5° | 0.0° |
| C5 | N9 | C10 | HN9 | 120.0° | 180.0° |
| C5 | N9 | C10 | C11 | 148.6° | 155.0° |
| C5 | N9 | C10 | C15 | 96.2° | 85.3° |
| C5 | N9 | C10 | H10 | 28.5° | 34.8° |
| O7 | C8 | C22 | C26 | 179.4° | 179.7° |
| O7 | C8 | C22 | C23 | 177.7° | 180.0° |
| O7 | C8 | C22 | C28 | 2.0° | 0.1° |
| O7 | C8 | C26 | C25 | 179.2° | 179.7° |
| O7 | C8 | C26 | C27 | 0.9° | 0.0° |
| C8 | C22 | C23 | C28 | 179.7° | 179.9° |
| C8 | C22 | C23 | C24 | 1.9° | 0.1° |
| C22 | C8 | C26 | C25 | 0.1° | 0.6° |
| C22 | C8 | C26 | C27 | 179.8° | 179.7° |
| C8 | C22 | C23 | H23 | 178.1° | 179.9° |
| C8 | C22 | C28 | H28 | 90.1° | 90.0° |
| C8 | C22 | C28 | H28A | 149.9° | 149.9° |
| C8 | C22 | C28 | H28B | 29.9° | 30.0° |
| C26 | C8 | C22 | C23 | 1.7° | 0.4° |
| C26 | C8 | C22 | C28 | 178.6° | 179.7° |
| C8 | C26 | C25 | C24 | 1.2° | 0.5° |
| C8 | C26 | C25 | C27 | 179.9° | 179.7° |
| C8 | C26 | C25 | H25 | 178.8° | 179.6° |
| C8 | C26 | C27 | H27 | 90.0° | 90.0° |
| C8 | C26 | C27 | H27A | 149.9° | 150.0° |
| C8 | C26 | C27 | H27B | 29.9° | 30.0° |
| N9 | C10 | C11 | C15 | 109.5° | 119.9° |
| N9 | C10 | C11 | H10 | 124.9° | 120.2° |
| N9 | C10 | C15 | H10 | 123.7° | 120.1° |
| N9 | C10 | C11 | C12 | 158.9° | 177.5° |
| N9 | C10 | C15 | C14 | 167.7° | 177.5° |
| N9 | C10 | C11 | H11 | 81.0° | 62.5° |
| N9 | C10 | C11 | H11A | 38.9° | 57.6° |
| N9 | C10 | C15 | H15 | 47.7° | 57.6° |
| N9 | C10 | C15 | H15A | 72.4° | 62.5° |
| C11 | C10 | C15 | H10 | 119.9° | 119.9° |
| C10 | C11 | C12 | H11 | 120.0° | 120.0° |
| C10 | C11 | C12 | H11A | 120.0° | 119.9° |
| C10 | C11 | C12 | N13 | 56.3° | 59.2° |
| C11 | C10 | C15 | C14 | 51.3° | 57.6° |
| C11 | C10 | N9 | HN9 | 28.6° | 25.0° |
| C10 | C11 | H11 | H11A | 118.9° | 120.1° |
| C10 | C11 | C12 | H12 | 63.7° | 60.9° |
| C10 | C11 | C12 | H12A | 176.2° | 179.2° |
| C11 | C10 | C15 | H15 | 68.7° | 62.3° |
| C11 | C10 | C15 | H15A | 171.3° | 177.6° |
| C15 | C10 | C11 | C12 | 49.5° | 57.6° |
| C10 | C15 | C14 | N13 | 60.2° | 59.2° |
| C10 | C15 | C14 | H15 | 120.0° | 119.9° |
| C10 | C15 | C14 | H15A | 120.0° | 120.0° |
| C15 | C10 | N9 | HN9 | 143.8° | 94.7° |
| C15 | C10 | C11 | H11 | 169.5° | 177.6° |
| C15 | C10 | C11 | H11A | 70.5° | 62.3° |
| C10 | C15 | C14 | H14 | 59.8° | 60.9° |
| C10 | C15 | C14 | H14A | 179.8° | 179.2° |
| C10 | C15 | H15 | H15A | 118.9° | 120.1° |
| C11 | C12 | N13 | H12 | 120.0° | 120.1° |
| C11 | C12 | N13 | H12A | 120.0° | 120.0° |
| C11 | C12 | N13 | C14 | 61.8° | 61.8° |
| C11 | C12 | N13 | C16 | 173.8° | 174.2° |
| C12 | C11 | C10 | H10 | 76.2° | 62.3° |
| C12 | C11 | H11 | H11A | 118.9° | 120.1° |
| C11 | C12 | H12 | H12A | 119.3° | 119.9° |
| C12 | N13 | C14 | C16 | 130.2° | 124.1° |
| C12 | N13 | C14 | C15 | 63.5° | 61.7° |
| C12 | N13 | C16 | C17 | 161.5° | 180.0° |
| C12 | N13 | C16 | C21 | 18.8° | 0.3° |
| N13 | C12 | C11 | H11 | 176.3° | 179.2° |
| N13 | C12 | C11 | H11A | 63.7° | 60.7° |
| N13 | C12 | H12 | H12A | 119.2° | 120.0° |
| C12 | N13 | C14 | H14 | 56.6° | 58.3° |
| C12 | N13 | C14 | H14A | 176.5° | 178.2° |
| N13 | C14 | C15 | H14 | 120.0° | 120.0° |
| N13 | C14 | C15 | H14A | 120.0° | 120.0° |
| C14 | N13 | C16 | C17 | 74.9° | 55.8° |
| C14 | N13 | C16 | C21 | 104.8° | 123.9° |
| C14 | N13 | C12 | H12 | 58.2° | 58.3° |
| C14 | N13 | C12 | H12A | 178.2° | 178.2° |
| N13 | C14 | H14 | H14A | 119.4° | 120.0° |
| N13 | C14 | C15 | H15 | 59.8° | 60.8° |
| N13 | C14 | C15 | H15A | 179.8° | 179.1° |
| C16 | N13 | C14 | C15 | 166.3° | 174.2° |
| N13 | C16 | C17 | C21 | 179.7° | 179.7° |
| N13 | C16 | C17 | C18 | 179.4° | 180.0° |
| N13 | C16 | C21 | C20 | 180.0° | 179.8° |
| C16 | N13 | C12 | H12 | 66.2° | 65.8° |
| C16 | N13 | C12 | H12A | 53.8° | 54.1° |
| C16 | N13 | C14 | H14 | 73.7° | 65.8° |
| C16 | N13 | C14 | H14A | 46.3° | 54.2° |
| N13 | C16 | C17 | H17 | 0.6° | 0.0° |
| N13 | C16 | C21 | H21 | 0.0° | 0.0° |
| C14 | C15 | C10 | H10 | 68.6° | 62.3° |
| C15 | C14 | H14 | H14A | 119.5° | 119.9° |
| C14 | C15 | H15 | H15A | 118.9° | 120.1° |
| C16 | C17 | C18 | H17 | 180.0° | 180.0° |
| C16 | C17 | C18 | C19 | 0.9° | 0.0° |
| C17 | C16 | C21 | C20 | 0.3° | 0.5° |
| C16 | C17 | C18 | H18 | 179.1° | 180.0° |
| C17 | C16 | C21 | H21 | 179.7° | 179.7° |
| C21 | C16 | C17 | C18 | 0.9° | 0.2° |
| C16 | C21 | C20 | C19 | 0.4° | 0.5° |
| C16 | C21 | C20 | H21 | 180.0° | 179.8° |
| C21 | C16 | C17 | H17 | 179.1° | 179.7° |
| C16 | C21 | C20 | H20 | 179.7° | 179.7° |
| C17 | C18 | C19 | H18 | 180.0° | 180.0° |
| C17 | C18 | C19 | C20 | 0.3° | 0.0° |
| C17 | C18 | C19 | S31 | 178.5° | 180.0° |
| C18 | C19 | C20 | S31 | 178.7° | 180.0° |
| C18 | C19 | C20 | C21 | 0.3° | 0.2° |
| C18 | C19 | S31 | N32 | 30.9° | 90.0° |
| C18 | C19 | S31 | O33 | 147.9° | 156.5° |
| C18 | C19 | S31 | O34 | 80.3° | 23.6° |
| C19 | C18 | C17 | H17 | 179.1° | 180.0° |
| C18 | C19 | C20 | H20 | 179.7° | 180.0° |
| C19 | C20 | C21 | H20 | 180.0° | 179.8° |
| C20 | C19 | S31 | N32 | 147.9° | 90.0° |
| C20 | C19 | S31 | O33 | 30.9° | 23.5° |
| C20 | C19 | S31 | O34 | 101.0° | 156.4° |
| C20 | C19 | C18 | H18 | 179.7° | 180.0° |
| C19 | C20 | C21 | H21 | 179.6° | 179.7° |
| S31 | C19 | C20 | C21 | 179.1° | 179.8° |
| C19 | S31 | N32 | O33 | 113.3° | 113.5° |
| C19 | S31 | N32 | O34 | 113.2° | 113.6° |
| C19 | S31 | O33 | O34 | 122.5° | 123.0° |
| S31 | C19 | C18 | H18 | 1.5° | 0.0° |
| S31 | C19 | C20 | H20 | 0.9° | 0.0° |
| C19 | S31 | N32 | HN32 | 180.0° | 0.1° |
| C19 | S31 | N32 | HN3A | 60.0° | 180.0° |
| C22 | C23 | C24 | H23 | 180.0° | 180.0° |
| C22 | C23 | C24 | C25 | 0.6° | 0.0° |
| C22 | C23 | C24 | C29 | 179.9° | 180.0° |
| C23 | C22 | C28 | H28 | 90.2° | 90.1° |
| C23 | C22 | C28 | H28A | 29.8° | 30.0° |
| C23 | C22 | C28 | H28B | 149.8° | 150.0° |
| C28 | C22 | C23 | C24 | 178.4° | 180.0° |
| C28 | C22 | C23 | H23 | 1.6° | 0.0° |
| C22 | C28 | H28 | H28A | 120.0° | 120.0° |
| C22 | C28 | H28 | H28B | 120.0° | 120.0° |
| C22 | C28 | H28A | H28B | 120.0° | 120.0° |
| C23 | C24 | C25 | C29 | 179.5° | 179.9° |
| C23 | C24 | C25 | C26 | 1.0° | 0.3° |
| C23 | C24 | C29 | N30 | 35.6° | 44.0° |
| C23 | C24 | C25 | H25 | 179.0° | 179.9° |
| C24 | C25 | C26 | H25 | 180.0° | 179.8° |
| C24 | C25 | C26 | C27 | 178.9° | 179.7° |
| C25 | C24 | C29 | N30 | 143.9° | 136.1° |
| C25 | C24 | C23 | H23 | 179.4° | 179.9° |
| C29 | C24 | C25 | C26 | 178.6° | 179.8° |
| C29 | C24 | C23 | H23 | 0.1° | 0.0° |
| C29 | C24 | C25 | H25 | 1.5° | 0.0° |
| C25 | C26 | C27 | H27 | 90.0° | 89.7° |
| C25 | C26 | C27 | H27A | 30.0° | 30.2° |
| C25 | C26 | C27 | H27B | 150.0° | 150.3° |
| C27 | C26 | C25 | H25 | 1.1° | 0.1° |
| C26 | C27 | H27 | H27A | 120.0° | 120.0° |
| C26 | C27 | H27 | H27B | 120.0° | 120.0° |
| C26 | C27 | H27A | H27B | 120.0° | 120.0° |
| N32 | S31 | O33 | O34 | 123.5° | 122.9° |
| S31 | N32 | HN32 | HN3A | 120.0° | 179.9° |
| O33 | S31 | N32 | HN32 | 66.7° | 113.6° |
| O33 | S31 | N32 | HN3A | 173.3° | 66.5° |
| O34 | S31 | N32 | HN32 | 66.8° | 113.6° |
| O34 | S31 | N32 | HN3A | 53.2° | 66.4° |
| H2 | C2 | C3 | H3 | 0.1° | 0.0° |
| HN9 | N9 | C10 | H10 | 91.5° | 145.1° |
| H10 | C10 | C11 | H11 | 43.9° | 57.7° |
| H10 | C10 | C11 | H11A | 163.8° | 177.8° |
| H10 | C10 | C15 | H15 | 171.4° | 177.7° |
| H10 | C10 | C15 | H15A | 51.4° | 57.6° |
| H11 | C11 | C12 | H12 | 56.3° | 59.1° |
| H11 | C11 | C12 | H12A | 63.7° | 60.8° |
| H11A | C11 | C12 | H12 | 176.2° | 179.2° |
| H11A | C11 | C12 | H12A | 56.2° | 59.3° |
| H14 | C14 | C15 | H15 | 179.8° | 179.2° |
| H14 | C14 | C15 | H15A | 60.2° | 59.1° |
| H14A | C14 | C15 | H15 | 60.2° | 59.3° |
| H14A | C14 | C15 | H15A | 59.8° | 60.8° |
| H17 | C17 | C18 | H18 | 0.9° | 0.0° |
| H20 | C20 | C21 | H21 | 0.4° | 0.1° |
| H27 | C27 | H27A | H27B | 120.0° | 119.9° |
| H28 | C28 | H28A | H28B | 120.0° | 120.0° |
