QH2
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | S1 | doub | 1.42Å | 1.43Å | |
| O2 | S1 | doub | 1.42Å | 1.43Å | |
| S1 | N1 | sing | 1.66Å | 1.71Å | |
| S1 | C3 | sing | 1.76Å | 1.76Å | |
| C27 | C26 | doub | 1.38Å | 1.38Å | Aromatic |
| C27 | C9 | sing | 1.39Å | 1.38Å | Aromatic |
| C26 | C25 | sing | 1.38Å | 1.38Å | Aromatic |
| N1 | C9 | sing | 1.40Å | 1.39Å | |
| N1 | C2 | sing | 1.47Å | 1.45Å | |
| C3 | C4 | doub | 1.38Å | 1.38Å | Aromatic |
| C3 | C8 | sing | 1.38Å | 1.38Å | Aromatic |
| C9 | C10 | doub | 1.39Å | 1.38Å | Aromatic |
| C25 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
| C4 | C5 | sing | 1.38Å | 1.38Å | Aromatic |
| O6 | C1 | doub | 1.21Å | 1.26Å | |
| C8 | C7 | doub | 1.38Å | 1.38Å | Aromatic |
| C2 | C1 | sing | 1.51Å | 1.52Å | |
| C10 | C11 | sing | 1.39Å | 1.38Å | Aromatic |
| C5 | C6 | doub | 1.38Å | 1.37Å | Aromatic |
| C1 | O1 | sing | 1.34Å | 1.26Å | |
| C7 | C6 | sing | 1.38Å | 1.37Å | Aromatic |
| C11 | N2 | sing | 1.40Å | 1.43Å | |
| N2 | N3 | sing | 1.40Å | 1.38Å | Aromatic |
| N2 | C15 | sing | 1.35Å | 1.36Å | Aromatic |
| N3 | C12 | doub | 1.31Å | 1.32Å | Aromatic |
| C24 | C16 | sing | 1.53Å | 1.49Å | |
| C24 | C17 | sing | 1.53Å | 1.51Å | |
| C15 | C16 | sing | 1.51Å | 1.46Å | |
| C15 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.41Å | 1.39Å | Aromatic |
| C16 | C17 | sing | 1.53Å | 1.51Å | |
| C13 | C14 | sing | 1.47Å | 1.45Å | |
| C17 | C18 | sing | 1.51Å | 1.49Å | |
| C23 | C18 | doub | 1.38Å | 1.38Å | Aromatic |
| C23 | C22 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | O5 | doub | 1.22Å | 1.23Å | |
| C14 | O4 | sing | 1.35Å | 1.32Å | |
| C18 | C19 | sing | 1.38Å | 1.38Å | Aromatic |
| C22 | C21 | doub | 1.38Å | 1.37Å | Aromatic |
| C19 | C20 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
| C10 | H8 | sing | 1.08Å | 1.08Å | |
| C12 | H9 | sing | 1.08Å | 1.08Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C19 | H13 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C20 | H14 | sing | 1.08Å | 1.08Å | |
| C21 | H15 | sing | 1.08Å | 1.08Å | |
| C22 | H16 | sing | 1.08Å | 1.08Å | |
| C23 | H17 | sing | 1.08Å | 1.08Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C25 | H20 | sing | 1.08Å | 1.08Å | |
| C26 | H21 | sing | 1.08Å | 1.08Å | |
| C27 | H22 | sing | 1.08Å | 1.08Å | |
| C4 | H3 | sing | 1.08Å | 1.08Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C6 | H5 | sing | 1.08Å | 1.08Å | |
| C7 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.08Å | 1.08Å | |
| O1 | H23 | sing | 0.97Å | 0.95Å | |
| O4 | H10 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | S1 | O2 | 120.3° | 123.2° |
| O3 | S1 | N1 | 109.8° | 106.4° |
| O3 | S1 | C3 | 108.4° | 106.4° |
| O2 | S1 | N1 | 106.4° | 106.4° |
| O2 | S1 | C3 | 108.0° | 106.4° |
| N1 | S1 | C3 | 102.4° | 107.2° |
| S1 | N1 | C9 | 122.3° | 120.0° |
| S1 | N1 | C2 | 113.2° | 120.0° |
| S1 | C3 | C4 | 119.6° | 120.0° |
| S1 | C3 | C8 | 119.8° | 120.0° |
| C26 | C27 | C9 | 119.7° | 120.1° |
| C27 | C26 | C25 | 120.9° | 120.1° |
| C27 | C26 | H21 | 119.5° | 119.9° |
| C26 | C27 | H22 | 120.1° | 119.9° |
| C27 | C9 | N1 | 121.7° | 120.0° |
| C27 | C9 | C10 | 119.9° | 119.9° |
| C9 | C27 | H22 | 120.1° | 120.0° |
| C26 | C25 | C11 | 119.0° | 120.1° |
| C26 | C25 | H20 | 120.5° | 119.9° |
| C25 | C26 | H21 | 119.6° | 120.0° |
| C9 | N1 | C2 | 120.9° | 120.0° |
| N1 | C9 | C10 | 118.4° | 120.1° |
| N1 | C2 | C1 | 116.5° | 109.5° |
| N1 | C2 | H2 | 107.7° | 109.5° |
| N1 | C2 | H1 | 107.7° | 109.5° |
| C4 | C3 | C8 | 120.6° | 120.0° |
| C3 | C4 | C5 | 119.3° | 120.0° |
| C3 | C4 | H3 | 120.4° | 120.0° |
| C3 | C8 | C7 | 119.2° | 120.0° |
| C3 | C8 | H7 | 120.4° | 120.0° |
| C9 | C10 | C11 | 120.0° | 119.9° |
| C9 | C10 | H8 | 120.0° | 120.1° |
| C25 | C11 | C10 | 120.5° | 119.9° |
| C25 | C11 | N2 | 120.9° | 120.1° |
| C11 | C25 | H20 | 120.5° | 120.0° |
| C4 | C5 | C6 | 120.4° | 120.0° |
| C5 | C4 | H3 | 120.4° | 120.0° |
| C4 | C5 | H4 | 119.8° | 120.0° |
| O6 | C1 | C2 | 117.6° | 120.0° |
| O6 | C1 | O1 | 126.7° | 120.0° |
| C8 | C7 | C6 | 120.6° | 120.0° |
| C8 | C7 | H6 | 119.7° | 120.0° |
| C7 | C8 | H7 | 120.4° | 120.0° |
| C2 | C1 | O1 | 115.7° | 120.0° |
| C1 | C2 | H2 | 107.7° | 109.5° |
| C1 | C2 | H1 | 107.7° | 109.4° |
| C10 | C11 | N2 | 118.6° | 120.0° |
| C11 | C10 | H8 | 120.0° | 120.1° |
| C5 | C6 | C7 | 119.9° | 120.0° |
| C6 | C5 | H4 | 119.8° | 120.0° |
| C5 | C6 | H5 | 120.1° | 120.0° |
| C1 | O1 | H23 | 109.5° | 117.0° |
| C7 | C6 | H5 | 120.0° | 120.0° |
| C6 | C7 | H6 | 119.7° | 120.0° |
| C11 | N2 | N3 | 119.4° | 125.8° |
| C11 | N2 | C15 | 130.5° | 125.7° |
| N3 | N2 | C15 | 110.1° | 108.5° |
| N2 | N3 | C12 | 106.0° | 108.9° |
| N2 | C15 | C16 | 124.1° | 126.3° |
| N2 | C15 | C13 | 106.9° | 107.4° |
| N3 | C12 | C13 | 111.5° | 108.1° |
| N3 | C12 | H9 | 124.2° | 125.9° |
| C16 | C24 | C17 | 60.5° | 60.0° |
| C24 | C16 | C15 | 119.3° | 117.5° |
| C24 | C16 | C17 | 60.2° | 60.0° |
| C24 | C16 | H11 | 115.7° | 117.6° |
| C16 | C24 | H18 | 119.9° | 117.4° |
| C16 | C24 | H19 | 119.9° | 117.6° |
| C24 | C17 | C16 | 59.3° | 60.0° |
| C24 | C17 | C18 | 123.5° | 117.5° |
| C24 | C17 | H12 | 114.7° | 117.5° |
| C17 | C24 | H18 | 119.9° | 117.5° |
| C17 | C24 | H19 | 119.9° | 117.6° |
| C16 | C15 | C13 | 128.9° | 126.3° |
| C15 | C16 | C17 | 118.1° | 117.5° |
| C15 | C16 | H11 | 116.3° | 115.5° |
| C15 | C13 | C12 | 105.4° | 107.1° |
| C15 | C13 | C14 | 128.6° | 126.4° |
| C12 | C13 | C14 | 126.0° | 126.5° |
| C13 | C12 | H9 | 124.3° | 126.0° |
| C16 | C17 | C18 | 118.2° | 117.5° |
| C17 | C16 | H11 | 115.4° | 117.5° |
| C16 | C17 | H12 | 114.7° | 117.5° |
| C13 | C14 | O5 | 123.7° | 120.1° |
| C13 | C14 | O4 | 114.3° | 120.0° |
| C17 | C18 | C23 | 121.1° | 120.0° |
| C17 | C18 | C19 | 120.8° | 120.0° |
| C18 | C17 | H12 | 115.0° | 115.5° |
| C18 | C23 | C22 | 121.0° | 120.0° |
| C23 | C18 | C19 | 118.1° | 120.0° |
| C18 | C23 | H17 | 119.5° | 120.0° |
| C23 | C22 | C21 | 120.2° | 120.0° |
| C23 | C22 | H16 | 119.9° | 120.1° |
| C22 | C23 | H17 | 119.5° | 120.0° |
| O5 | C14 | O4 | 121.9° | 120.0° |
| C14 | O4 | H10 | 109.5° | 117.0° |
| C18 | C19 | C20 | 121.0° | 120.0° |
| C18 | C19 | H13 | 119.5° | 120.0° |
| C22 | C21 | C20 | 119.6° | 120.0° |
| C22 | C21 | H15 | 120.2° | 120.0° |
| C21 | C22 | H16 | 119.9° | 120.0° |
| C19 | C20 | C21 | 120.1° | 120.0° |
| C20 | C19 | H13 | 119.5° | 120.1° |
| C19 | C20 | H14 | 119.9° | 120.0° |
| C21 | C20 | H14 | 119.9° | 120.0° |
| C20 | C21 | H15 | 120.2° | 120.0° |
| H2 | C2 | H1 | 109.5° | 109.4° |
| H18 | C24 | H19 | 109.5° | 115.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | S1 | O2 | N1 | 125.6° | 123.0° |
| O3 | S1 | O2 | C3 | 125.1° | 122.9° |
| O3 | S1 | N1 | C3 | 115.0° | 113.6° |
| O3 | S1 | N1 | C9 | 21.7° | 160.7° |
| O3 | S1 | N1 | C2 | 179.6° | 19.3° |
| O3 | S1 | C3 | C4 | 41.3° | 29.3° |
| O3 | S1 | C3 | C8 | 142.3° | 150.4° |
| O2 | S1 | N1 | C3 | 113.2° | 113.5° |
| O2 | S1 | N1 | C9 | 153.5° | 27.7° |
| O2 | S1 | N1 | C2 | 47.9° | 152.2° |
| O2 | S1 | C3 | C4 | 173.2° | 162.2° |
| O2 | S1 | C3 | C8 | 10.4° | 17.5° |
| S1 | N1 | C9 | C27 | 67.4° | 58.3° |
| S1 | N1 | C9 | C2 | 157.0° | 179.9° |
| N1 | S1 | C3 | C4 | 74.8° | 84.3° |
| N1 | S1 | C3 | C8 | 101.7° | 96.0° |
| S1 | N1 | C9 | C10 | 112.6° | 121.2° |
| S1 | N1 | C2 | C1 | 145.7° | 95.0° |
| S1 | N1 | C2 | H2 | 93.3° | 145.0° |
| S1 | N1 | C2 | H1 | 24.7° | 25.0° |
| C3 | S1 | N1 | C9 | 93.3° | 85.7° |
| C3 | S1 | N1 | C2 | 65.3° | 94.3° |
| S1 | C3 | C4 | C8 | 176.5° | 179.7° |
| S1 | C3 | C4 | C5 | 178.3° | 179.7° |
| S1 | C3 | C8 | C7 | 178.0° | 179.7° |
| S1 | C3 | C4 | H3 | 1.7° | 0.3° |
| S1 | C3 | C8 | H7 | 2.0° | 0.3° |
| C26 | C27 | C9 | H22 | 180.0° | 179.7° |
| C27 | C26 | C25 | H21 | 180.0° | 179.9° |
| C26 | C27 | C9 | N1 | 178.4° | 180.0° |
| C26 | C27 | C9 | C10 | 1.6° | 0.6° |
| C27 | C26 | C25 | C11 | 0.7° | 0.1° |
| C27 | C26 | C25 | H20 | 179.3° | 179.9° |
| C9 | C27 | C26 | C25 | 0.0° | 0.4° |
| C27 | C9 | N1 | C10 | 180.0° | 179.5° |
| C27 | C9 | N1 | C2 | 135.6° | 121.8° |
| C27 | C9 | C10 | C11 | 2.4° | 0.6° |
| C27 | C9 | C10 | H8 | 177.6° | 179.8° |
| C9 | C27 | C26 | H21 | 180.0° | 179.8° |
| C26 | C25 | C11 | H20 | 180.0° | 180.0° |
| C26 | C25 | C11 | C10 | 0.1° | 0.1° |
| C26 | C25 | C11 | N2 | 178.3° | 180.0° |
| C25 | C26 | C27 | H22 | 180.0° | 179.9° |
| C9 | N1 | C2 | C1 | 55.3° | 85.0° |
| N1 | C9 | C10 | C11 | 177.6° | 180.0° |
| N1 | C9 | C10 | H8 | 2.4° | 0.3° |
| C9 | N1 | C2 | H2 | 65.7° | 35.1° |
| C9 | N1 | C2 | H1 | 176.4° | 155.0° |
| N1 | C9 | C27 | H22 | 1.6° | 0.2° |
| C2 | N1 | C9 | C10 | 44.5° | 58.7° |
| N1 | C2 | C1 | O6 | 32.3° | 0.3° |
| N1 | C2 | C1 | H2 | 121.0° | 120.0° |
| N1 | C2 | C1 | H1 | 121.0° | 120.0° |
| N1 | C2 | C1 | O1 | 147.4° | 180.0° |
| N1 | C2 | H2 | H1 | 116.8° | 120.0° |
| C3 | C4 | C5 | H3 | 180.0° | 180.0° |
| C4 | C3 | C8 | C7 | 1.5° | 0.0° |
| C3 | C4 | C5 | C6 | 1.1° | 0.1° |
| C3 | C4 | C5 | H4 | 178.9° | 180.0° |
| C4 | C3 | C8 | H7 | 178.4° | 180.0° |
| C8 | C3 | C4 | C5 | 1.9° | 0.0° |
| C3 | C8 | C7 | H7 | 180.0° | 180.0° |
| C3 | C8 | C7 | C6 | 0.5° | 0.0° |
| C8 | C3 | C4 | H3 | 178.2° | 180.0° |
| C3 | C8 | C7 | H6 | 179.6° | 180.0° |
| C9 | C10 | C11 | C25 | 1.6° | 0.3° |
| C9 | C10 | C11 | H8 | 180.0° | 179.7° |
| C9 | C10 | C11 | N2 | 176.8° | 179.8° |
| C10 | C9 | C27 | H22 | 178.4° | 179.7° |
| C25 | C11 | C10 | N2 | 178.4° | 179.9° |
| C25 | C11 | N2 | N3 | 55.1° | 138.1° |
| C25 | C11 | N2 | C15 | 127.3° | 42.3° |
| C25 | C11 | C10 | H8 | 178.4° | 180.0° |
| C11 | C25 | C26 | H21 | 179.3° | 180.0° |
| C4 | C5 | C6 | H4 | 180.0° | 179.9° |
| C4 | C5 | C6 | C7 | 0.1° | 0.1° |
| C4 | C5 | C6 | H5 | 179.9° | 180.0° |
| O6 | C1 | C2 | O1 | 179.7° | 179.6° |
| O6 | C1 | C2 | H2 | 153.4° | 119.7° |
| O6 | C1 | C2 | H1 | 88.7° | 120.3° |
| O6 | C1 | O1 | H23 | 0.0° | 0.3° |
| C8 | C7 | C6 | C5 | 0.3° | 0.0° |
| C8 | C7 | C6 | H6 | 180.0° | 180.0° |
| C8 | C7 | C6 | H5 | 179.7° | 179.9° |
| C1 | C2 | H2 | H1 | 116.8° | 120.0° |
| C2 | C1 | O1 | H23 | 179.6° | 180.0° |
| C10 | C11 | N2 | N3 | 123.3° | 41.9° |
| C10 | C11 | N2 | C15 | 54.3° | 137.7° |
| C10 | C11 | C25 | H20 | 179.9° | 180.0° |
| C5 | C6 | C7 | H5 | 180.0° | 179.9° |
| C6 | C5 | C4 | H3 | 178.9° | 179.9° |
| C5 | C6 | C7 | H6 | 179.7° | 179.9° |
| O1 | C1 | C2 | H2 | 26.3° | 59.9° |
| O1 | C1 | C2 | H1 | 91.6° | 60.0° |
| C7 | C6 | C5 | H4 | 179.9° | 180.0° |
| C6 | C7 | C8 | H7 | 179.5° | 180.0° |
| C11 | N2 | N3 | C15 | 178.1° | 179.7° |
| C11 | N2 | N3 | C12 | 179.2° | 180.0° |
| C11 | N2 | C15 | C16 | 4.3° | 0.1° |
| C11 | N2 | C15 | C13 | 178.9° | 179.9° |
| N2 | C11 | C10 | H8 | 3.2° | 0.1° |
| N2 | C11 | C25 | H20 | 1.7° | 0.0° |
| N3 | N2 | C15 | C16 | 177.9° | 179.7° |
| N3 | N2 | C15 | C13 | 1.1° | 0.2° |
| N2 | N3 | C12 | C13 | 0.6° | 0.3° |
| N2 | N3 | C12 | H9 | 179.3° | 179.8° |
| C15 | N2 | N3 | C12 | 1.1° | 0.3° |
| N2 | C15 | C16 | C24 | 68.4° | 129.3° |
| N2 | C15 | C16 | C13 | 176.0° | 179.9° |
| N2 | C15 | C13 | C12 | 0.7° | 0.0° |
| N2 | C15 | C16 | C17 | 138.2° | 60.7° |
| N2 | C15 | C13 | C14 | 179.1° | 179.9° |
| N2 | C15 | C16 | H11 | 78.0° | 85.0° |
| N3 | C12 | C13 | C15 | 0.0° | 0.2° |
| N3 | C12 | C13 | H9 | 180.0° | 179.8° |
| N3 | C12 | C13 | C14 | 179.8° | 179.7° |
| C16 | C24 | C17 | H18 | 109.6° | 107.4° |
| C16 | C24 | C17 | H19 | 109.6° | 107.5° |
| C24 | C16 | C15 | C17 | 69.8° | 68.6° |
| C24 | C16 | C15 | H11 | 146.4° | 145.7° |
| C24 | C16 | C15 | C13 | 107.7° | 50.6° |
| C24 | C16 | C17 | H11 | 106.3° | 107.6° |
| C16 | C24 | C17 | C18 | 105.4° | 107.5° |
| C16 | C24 | C17 | H12 | 105.1° | 107.5° |
| C16 | C24 | H18 | H19 | 144.5° | 145.6° |
| C24 | C17 | C18 | H12 | 149.4° | 145.7° |
| C24 | C17 | C18 | C23 | 23.4° | 8.9° |
| C24 | C17 | C18 | C19 | 157.5° | 171.4° |
| C17 | C24 | H18 | H19 | 144.5° | 145.8° |
| C16 | C15 | C13 | C12 | 177.2° | 179.9° |
| C15 | C16 | C17 | H11 | 144.1° | 145.0° |
| C16 | C15 | C13 | C14 | 2.5° | 0.0° |
| C15 | C16 | C17 | C18 | 136.2° | 145.0° |
| C15 | C16 | C17 | H12 | 4.4° | 0.1° |
| C15 | C16 | C24 | H18 | 142.8° | 145.0° |
| C15 | C16 | C24 | H19 | 2.0° | 0.0° |
| C15 | C13 | C12 | C14 | 179.8° | 179.9° |
| C13 | C15 | C16 | C17 | 37.8° | 119.2° |
| C15 | C13 | C14 | O5 | 132.6° | 3.7° |
| C15 | C13 | C14 | O4 | 47.3° | 176.2° |
| C15 | C13 | C12 | H9 | 180.0° | 180.0° |
| C13 | C15 | C16 | H11 | 106.0° | 95.1° |
| C12 | C13 | C14 | O5 | 47.2° | 176.4° |
| C12 | C13 | C14 | O4 | 133.0° | 3.7° |
| C16 | C17 | C18 | H12 | 140.5° | 145.7° |
| C16 | C17 | C18 | C23 | 46.7° | 59.7° |
| C16 | C17 | C18 | C19 | 132.4° | 120.0° |
| C13 | C14 | O5 | O4 | 179.8° | 179.9° |
| C14 | C13 | C12 | H9 | 0.2° | 0.1° |
| C13 | C14 | O4 | H10 | 179.8° | 180.0° |
| C17 | C18 | C23 | C19 | 179.1° | 179.7° |
| C17 | C18 | C23 | C22 | 179.7° | 179.8° |
| C17 | C18 | C19 | C20 | 179.9° | 180.0° |
| C18 | C17 | C16 | H11 | 7.9° | 0.1° |
| C17 | C18 | C19 | H13 | 0.1° | 0.0° |
| C17 | C18 | C23 | H17 | 0.3° | 0.0° |
| C18 | C17 | C24 | H18 | 4.2° | 0.1° |
| C18 | C17 | C24 | H19 | 145.0° | 145.0° |
| C18 | C23 | C22 | H17 | 180.0° | 179.8° |
| C18 | C23 | C22 | C21 | 1.0° | 0.5° |
| C23 | C18 | C19 | C20 | 0.7° | 0.3° |
| C23 | C18 | C17 | H12 | 172.8° | 154.6° |
| C23 | C18 | C19 | H13 | 179.3° | 179.7° |
| C18 | C23 | C22 | H16 | 179.0° | 179.7° |
| C22 | C23 | C18 | C19 | 1.1° | 0.5° |
| C23 | C22 | C21 | H16 | 180.0° | 179.8° |
| C23 | C22 | C21 | C20 | 0.5° | 0.2° |
| C23 | C22 | C21 | H15 | 179.5° | 179.7° |
| O5 | C14 | O4 | H10 | 0.0° | 0.1° |
| C18 | C19 | C20 | H13 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.2° | 0.0° |
| C19 | C18 | C17 | H12 | 8.1° | 25.7° |
| C18 | C19 | C20 | H14 | 179.8° | 180.0° |
| C19 | C18 | C23 | H17 | 178.9° | 179.7° |
| C22 | C21 | C20 | C19 | 0.1° | 0.0° |
| C22 | C21 | C20 | H15 | 180.0° | 179.9° |
| C22 | C21 | C20 | H14 | 179.9° | 179.9° |
| C21 | C22 | C23 | H17 | 179.0° | 179.7° |
| C19 | C20 | C21 | H14 | 180.0° | 180.0° |
| C19 | C20 | C21 | H15 | 179.9° | 180.0° |
| C21 | C20 | C19 | H13 | 179.8° | 180.0° |
| C20 | C21 | C22 | H16 | 179.6° | 180.0° |
| H11 | C16 | C17 | H12 | 148.5° | 144.9° |
| H11 | C16 | C24 | H18 | 3.7° | 0.0° |
| H11 | C16 | C24 | H19 | 144.6° | 145.0° |
| H12 | C17 | C24 | H18 | 145.3° | 145.1° |
| H12 | C17 | C24 | H19 | 4.4° | 0.0° |
| H13 | C19 | C20 | H14 | 0.2° | 0.0° |
| H14 | C20 | C21 | H15 | 0.1° | 0.0° |
| H15 | C21 | C22 | H16 | 0.5° | 0.1° |
| H16 | C22 | C23 | H17 | 1.0° | 0.1° |
| H20 | C25 | C26 | H21 | 0.7° | 0.1° |
| H21 | C26 | C27 | H22 | 0.0° | 0.0° |
| H3 | C4 | C5 | H4 | 1.1° | 0.0° |
| H4 | C5 | C6 | H5 | 0.1° | 0.1° |
| H5 | C6 | C7 | H6 | 0.3° | 0.1° |
| H6 | C7 | C8 | H7 | 0.5° | 0.0° |
