8WL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C1 | C2 | sing | 1.53Å | 1.53Å | |
| C2 | C4 | sing | 1.51Å | 1.52Å | |
| C2 | C3 | sing | 1.53Å | 1.52Å | |
| N35 | C4 | sing | 1.35Å | 1.32Å | Aromatic |
| N35 | C7 | doub | 1.31Å | 1.32Å | Aromatic |
| C4 | N5 | doub | 1.30Å | 1.32Å | Aromatic |
| C34 | C8 | sing | 1.53Å | 1.45Å | |
| C34 | C33 | sing | 1.53Å | 1.52Å | |
| C7 | C8 | sing | 1.51Å | 1.52Å | |
| C7 | O6 | sing | 1.34Å | 1.34Å | Aromatic |
| C8 | C9 | sing | 1.53Å | 1.45Å | |
| N5 | O6 | sing | 1.21Å | 1.36Å | Aromatic |
| C33 | N11 | sing | 1.47Å | 1.52Å | |
| O32 | N30 | doub | 1.22Å | 1.17Å | |
| C9 | C10 | sing | 1.53Å | 1.53Å | |
| O31 | N30 | sing | 1.22Å | 1.17Å | |
| N30 | C29 | sing | 1.48Å | 1.44Å | |
| N11 | C10 | sing | 1.47Å | 1.53Å | |
| N11 | C12 | sing | 1.39Å | 1.46Å | |
| C29 | C12 | doub | 1.39Å | 1.39Å | Aromatic |
| C29 | C16 | sing | 1.39Å | 1.38Å | Aromatic |
| C12 | N13 | sing | 1.33Å | 1.32Å | Aromatic |
| N17 | C16 | sing | 1.39Å | 1.45Å | |
| N17 | C18 | sing | 1.40Å | 1.46Å | |
| C16 | N15 | doub | 1.33Å | 1.32Å | Aromatic |
| N13 | C14 | doub | 1.32Å | 1.32Å | Aromatic |
| C19 | C18 | doub | 1.39Å | 1.38Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
| C18 | C27 | sing | 1.39Å | 1.39Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.38Å | Aromatic |
| N15 | C14 | sing | 1.32Å | 1.32Å | Aromatic |
| C27 | F28 | sing | 1.35Å | 1.36Å | |
| C27 | C26 | doub | 1.38Å | 1.39Å | Aromatic |
| C21 | C26 | sing | 1.38Å | 1.38Å | Aromatic |
| C21 | S22 | sing | 1.76Å | 1.82Å | |
| C23 | S22 | sing | 1.81Å | 1.81Å | |
| O24 | S22 | doub | 1.42Å | 1.46Å | |
| S22 | O25 | doub | 1.42Å | 1.46Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C1 | H3 | sing | 1.09Å | 1.10Å | |
| C2 | H4 | sing | 1.09Å | 1.10Å | |
| C3 | H5 | sing | 1.09Å | 1.10Å | |
| C3 | H6 | sing | 1.09Å | 1.10Å | |
| C3 | H7 | sing | 1.09Å | 1.10Å | |
| C8 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H10 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C14 | H13 | sing | 1.08Å | 1.08Å | |
| C19 | H14 | sing | 1.08Å | 1.08Å | |
| C20 | H15 | sing | 1.08Å | 1.08Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.09Å | 1.10Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H19 | sing | 1.08Å | 1.08Å | |
| C33 | H20 | sing | 1.09Å | 1.10Å | |
| C33 | H21 | sing | 1.09Å | 1.10Å | |
| C34 | H22 | sing | 1.09Å | 1.10Å | |
| C34 | H23 | sing | 1.09Å | 1.10Å | |
| N17 | H24 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C1 | C2 | C4 | 110.8° | 109.5° |
| C1 | C2 | C3 | 110.9° | 109.5° |
| C2 | C1 | H1 | 109.5° | 109.5° |
| C2 | C1 | H2 | 109.5° | 109.5° |
| C2 | C1 | H3 | 109.4° | 109.5° |
| C1 | C2 | H4 | 108.1° | 109.5° |
| C4 | C2 | C3 | 110.7° | 109.4° |
| C2 | C4 | N35 | 125.8° | 126.3° |
| C2 | C4 | N5 | 125.1° | 126.3° |
| C4 | C2 | H4 | 108.1° | 109.5° |
| C3 | C2 | H4 | 108.1° | 109.5° |
| C2 | C3 | H5 | 109.5° | 109.5° |
| C2 | C3 | H6 | 109.5° | 109.5° |
| C2 | C3 | H7 | 109.5° | 109.4° |
| C4 | N35 | C7 | 108.4° | 105.6° |
| N35 | C4 | N5 | 109.2° | 107.4° |
| N35 | C7 | C8 | 126.2° | 126.5° |
| N35 | C7 | O6 | 108.1° | 106.9° |
| C4 | N5 | O6 | 107.2° | 110.3° |
| C8 | C34 | C33 | 110.5° | 109.3° |
| C34 | C8 | C7 | 118.8° | 109.5° |
| C34 | C8 | C9 | 112.7° | 109.2° |
| C34 | C8 | H8 | 109.6° | 109.6° |
| C8 | C34 | H22 | 109.2° | 109.5° |
| C8 | C34 | H23 | 109.2° | 109.5° |
| C34 | C33 | N11 | 111.8° | 109.5° |
| C34 | C33 | H20 | 108.9° | 109.4° |
| C34 | C33 | H21 | 108.9° | 109.5° |
| C33 | C34 | H22 | 109.2° | 109.5° |
| C33 | C34 | H23 | 109.2° | 109.4° |
| C8 | C7 | O6 | 125.6° | 126.6° |
| C7 | C8 | C9 | 96.9° | 109.5° |
| C7 | C8 | H8 | 108.5° | 109.6° |
| C7 | O6 | N5 | 107.0° | 109.8° |
| C8 | C9 | C10 | 115.2° | 109.3° |
| C9 | C8 | H8 | 109.5° | 109.5° |
| C8 | C9 | H9 | 108.0° | 109.5° |
| C8 | C9 | H10 | 108.0° | 109.5° |
| C33 | N11 | C10 | 106.8° | 111.2° |
| C33 | N11 | C12 | 123.1° | 111.0° |
| N11 | C33 | H20 | 108.9° | 109.5° |
| N11 | C33 | H21 | 108.9° | 109.5° |
| O32 | N30 | O31 | 120.3° | 120.0° |
| O32 | N30 | C29 | 120.2° | 120.0° |
| C9 | C10 | N11 | 114.9° | 109.5° |
| C10 | C9 | H9 | 108.0° | 109.5° |
| C10 | C9 | H10 | 108.0° | 109.5° |
| C9 | C10 | H11 | 108.1° | 109.5° |
| C9 | C10 | H12 | 108.1° | 109.5° |
| O31 | N30 | C29 | 119.5° | 120.0° |
| N30 | C29 | C12 | 123.9° | 120.9° |
| N30 | C29 | C16 | 116.8° | 120.9° |
| C10 | N11 | C12 | 119.8° | 111.0° |
| N11 | C10 | H11 | 108.1° | 109.5° |
| N11 | C10 | H12 | 108.1° | 109.4° |
| N11 | C12 | C29 | 123.2° | 120.5° |
| N11 | C12 | N13 | 118.7° | 120.5° |
| C12 | C29 | C16 | 119.3° | 118.3° |
| C29 | C12 | N13 | 118.1° | 119.0° |
| C29 | C16 | N17 | 116.4° | 120.5° |
| C29 | C16 | N15 | 119.2° | 119.0° |
| C12 | N13 | C14 | 121.1° | 120.9° |
| C16 | N17 | C18 | 129.7° | 120.0° |
| N17 | C16 | N15 | 124.4° | 120.5° |
| C16 | N17 | H24 | 115.2° | 120.0° |
| N17 | C18 | C19 | 116.3° | 120.1° |
| N17 | C18 | C27 | 124.4° | 120.1° |
| C18 | N17 | H24 | 115.2° | 120.0° |
| C16 | N15 | C14 | 120.4° | 120.9° |
| N13 | C14 | N15 | 121.9° | 121.9° |
| N13 | C14 | H13 | 119.1° | 119.0° |
| C18 | C19 | C20 | 121.1° | 120.0° |
| C19 | C18 | C27 | 119.3° | 119.8° |
| C18 | C19 | H14 | 119.4° | 120.0° |
| C19 | C20 | C21 | 119.6° | 120.1° |
| C20 | C19 | H14 | 119.4° | 120.0° |
| C19 | C20 | H15 | 120.2° | 120.0° |
| C18 | C27 | F28 | 121.4° | 120.1° |
| C18 | C27 | C26 | 119.6° | 119.9° |
| C20 | C21 | C26 | 119.7° | 120.2° |
| C20 | C21 | S22 | 119.1° | 119.9° |
| C21 | C20 | H15 | 120.2° | 119.9° |
| N15 | C14 | H13 | 119.0° | 119.1° |
| F28 | C27 | C26 | 119.0° | 120.0° |
| C27 | C26 | C21 | 120.7° | 120.0° |
| C27 | C26 | H19 | 119.7° | 120.0° |
| C26 | C21 | S22 | 121.2° | 119.9° |
| C21 | C26 | H19 | 119.6° | 120.0° |
| C21 | S22 | C23 | 110.0° | 104.4° |
| C21 | S22 | O24 | 111.4° | 104.3° |
| C21 | S22 | O25 | 111.1° | 104.3° |
| C23 | S22 | O24 | 111.1° | 110.5° |
| C23 | S22 | O25 | 111.1° | 110.5° |
| S22 | C23 | H16 | 109.5° | 109.5° |
| S22 | C23 | H17 | 109.4° | 109.5° |
| S22 | C23 | H18 | 109.4° | 109.5° |
| O24 | S22 | O25 | 101.8° | 121.1° |
| H1 | C1 | H2 | 109.5° | 109.4° |
| H1 | C1 | H3 | 109.5° | 109.5° |
| H2 | C1 | H3 | 109.5° | 109.4° |
| H5 | C3 | H6 | 109.5° | 109.5° |
| H5 | C3 | H7 | 109.5° | 109.5° |
| H6 | C3 | H7 | 109.5° | 109.5° |
| H9 | C9 | H10 | 109.5° | 109.5° |
| H11 | C10 | H12 | 109.5° | 109.5° |
| H16 | C23 | H17 | 109.5° | 109.5° |
| H16 | C23 | H18 | 109.5° | 109.5° |
| H17 | C23 | H18 | 109.5° | 109.4° |
| H20 | C33 | H21 | 109.5° | 109.5° |
| H22 | C34 | H23 | 109.5° | 109.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C1 | C2 | C4 | C3 | 123.5° | 120.0° |
| C1 | C2 | C4 | H4 | 118.3° | 120.1° |
| C1 | C2 | C3 | H4 | 118.3° | 120.1° |
| C1 | C2 | C4 | N35 | 93.4° | 119.7° |
| C1 | C2 | C4 | N5 | 86.9° | 60.0° |
| C2 | C1 | H1 | H2 | 120.0° | 120.0° |
| C2 | C1 | H1 | H3 | 120.0° | 120.0° |
| C2 | C1 | H2 | H3 | 119.9° | 120.0° |
| C1 | C2 | C3 | H5 | 180.0° | 59.9° |
| C1 | C2 | C3 | H6 | 60.0° | 180.0° |
| C1 | C2 | C3 | H7 | 60.0° | 60.0° |
| C4 | C2 | C3 | H4 | 118.2° | 120.0° |
| C2 | C4 | N35 | N5 | 179.7° | 179.8° |
| C2 | C4 | N35 | C7 | 179.8° | 180.0° |
| C2 | C4 | N5 | O6 | 180.0° | 180.0° |
| C4 | C2 | C1 | H1 | 180.0° | 60.0° |
| C4 | C2 | C1 | H2 | 60.0° | 180.0° |
| C4 | C2 | C1 | H3 | 60.0° | 60.0° |
| C4 | C2 | C3 | H5 | 56.5° | 60.0° |
| C4 | C2 | C3 | H6 | 176.5° | 60.0° |
| C4 | C2 | C3 | H7 | 63.5° | 180.0° |
| C3 | C2 | C4 | N35 | 143.0° | 120.3° |
| C3 | C2 | C4 | N5 | 36.6° | 60.0° |
| C3 | C2 | C1 | H1 | 56.6° | 60.0° |
| C3 | C2 | C1 | H2 | 176.6° | 60.0° |
| C3 | C2 | C1 | H3 | 63.4° | 180.0° |
| C2 | C3 | H5 | H6 | 120.0° | 120.0° |
| C2 | C3 | H5 | H7 | 120.0° | 119.9° |
| C2 | C3 | H6 | H7 | 120.0° | 119.9° |
| C4 | N35 | C7 | C8 | 179.8° | 179.9° |
| C4 | N35 | C7 | O6 | 0.2° | 0.1° |
| N35 | C4 | N5 | O6 | 0.3° | 0.2° |
| N35 | C4 | C2 | H4 | 24.8° | 0.3° |
| C7 | N35 | C4 | N5 | 0.1° | 0.2° |
| N35 | C7 | C8 | C34 | 44.2° | 120.3° |
| N35 | C7 | C8 | O6 | 179.5° | 180.0° |
| N35 | C7 | C8 | C9 | 164.9° | 120.0° |
| N35 | C7 | O6 | N5 | 0.4° | 0.0° |
| N35 | C7 | C8 | H8 | 81.8° | 0.2° |
| C4 | N5 | O6 | C7 | 0.4° | 0.1° |
| N5 | C4 | C2 | H4 | 154.8° | 179.9° |
| C8 | C34 | C33 | H22 | 120.2° | 120.0° |
| C8 | C34 | C33 | H23 | 120.1° | 119.9° |
| C34 | C8 | C7 | C9 | 120.7° | 119.7° |
| C34 | C8 | C7 | H8 | 126.0° | 120.2° |
| C34 | C8 | C7 | O6 | 136.3° | 59.7° |
| C34 | C8 | C9 | H8 | 122.3° | 119.9° |
| C8 | C34 | C33 | N11 | 70.5° | 59.2° |
| C34 | C8 | C9 | C10 | 28.8° | 57.7° |
| C34 | C8 | C9 | H9 | 149.6° | 62.3° |
| C34 | C8 | C9 | H10 | 92.1° | 177.6° |
| C8 | C34 | C33 | H20 | 49.9° | 60.8° |
| C8 | C34 | C33 | H21 | 169.2° | 179.2° |
| C8 | C34 | H22 | H23 | 119.5° | 120.1° |
| C33 | C34 | C8 | C7 | 141.3° | 177.5° |
| C33 | C34 | C8 | C9 | 29.1° | 57.6° |
| C34 | C33 | N11 | H20 | 120.3° | 120.0° |
| C34 | C33 | N11 | H21 | 120.4° | 120.0° |
| C34 | C33 | N11 | C10 | 43.7° | 61.7° |
| C34 | C33 | N11 | C12 | 171.7° | 174.2° |
| C33 | C34 | C8 | H8 | 93.2° | 62.3° |
| C34 | C33 | H20 | H21 | 119.0° | 120.0° |
| C33 | C34 | H22 | H23 | 119.5° | 120.0° |
| C7 | C8 | C9 | H8 | 112.5° | 120.2° |
| C8 | C7 | O6 | N5 | 180.0° | 180.0° |
| C7 | C8 | C9 | C10 | 96.4° | 177.6° |
| C7 | C8 | C9 | H9 | 24.4° | 57.6° |
| C7 | C8 | C9 | H10 | 142.7° | 62.5° |
| C7 | C8 | C34 | H22 | 98.5° | 62.5° |
| C7 | C8 | C34 | H23 | 21.2° | 57.7° |
| O6 | C7 | C8 | C9 | 15.6° | 60.0° |
| O6 | C7 | C8 | H8 | 97.7° | 179.9° |
| C8 | C9 | C10 | H9 | 120.8° | 120.0° |
| C8 | C9 | C10 | H10 | 120.8° | 119.9° |
| C8 | C9 | C10 | N11 | 53.7° | 59.2° |
| C8 | C9 | H9 | H10 | 117.4° | 120.1° |
| C8 | C9 | C10 | H11 | 67.1° | 179.2° |
| C8 | C9 | C10 | H12 | 174.6° | 60.8° |
| C9 | C8 | C34 | H22 | 149.2° | 177.6° |
| C9 | C8 | C34 | H23 | 91.1° | 62.2° |
| C33 | N11 | C10 | C9 | 13.6° | 61.7° |
| C33 | N11 | C10 | C12 | 146.1° | 124.1° |
| C33 | N11 | C12 | C29 | 23.7° | 114.9° |
| C33 | N11 | C12 | N13 | 156.7° | 64.8° |
| C33 | N11 | C10 | H11 | 107.1° | 178.2° |
| C33 | N11 | C10 | H12 | 134.5° | 58.3° |
| N11 | C33 | H20 | H21 | 118.9° | 120.0° |
| N11 | C33 | C34 | H22 | 169.4° | 179.1° |
| N11 | C33 | C34 | H23 | 49.7° | 60.8° |
| O32 | N30 | O31 | C29 | 178.9° | 180.0° |
| O32 | N30 | C29 | C12 | 96.7° | 94.8° |
| O32 | N30 | C29 | C16 | 83.4° | 85.2° |
| C9 | C10 | N11 | H11 | 120.8° | 120.0° |
| C9 | C10 | N11 | H12 | 120.8° | 120.0° |
| C9 | C10 | N11 | C12 | 132.4° | 174.2° |
| C10 | C9 | C8 | H8 | 151.1° | 62.3° |
| C10 | C9 | H9 | H10 | 117.4° | 120.0° |
| C9 | C10 | H11 | H12 | 117.5° | 120.0° |
| O31 | N30 | C29 | C12 | 84.4° | 85.2° |
| O31 | N30 | C29 | C16 | 95.5° | 94.8° |
| N30 | C29 | C12 | N11 | 0.0° | 0.2° |
| N30 | C29 | C12 | C16 | 179.9° | 180.0° |
| N30 | C29 | C12 | N13 | 179.6° | 179.9° |
| N30 | C29 | C16 | N17 | 0.1° | 0.0° |
| N30 | C29 | C16 | N15 | 179.6° | 180.0° |
| C10 | N11 | C12 | C29 | 164.1° | 120.9° |
| C10 | N11 | C12 | N13 | 16.3° | 59.4° |
| N11 | C10 | C9 | H9 | 174.6° | 60.8° |
| N11 | C10 | C9 | H10 | 67.1° | 179.1° |
| N11 | C10 | H11 | H12 | 117.5° | 119.9° |
| C10 | N11 | C33 | H20 | 76.7° | 58.2° |
| C10 | N11 | C33 | H21 | 164.0° | 178.2° |
| N11 | C12 | C29 | N13 | 179.6° | 179.7° |
| N11 | C12 | C29 | C16 | 180.0° | 179.7° |
| N11 | C12 | N13 | C14 | 179.9° | 179.8° |
| C12 | N11 | C10 | H11 | 106.8° | 54.1° |
| C12 | N11 | C10 | H12 | 11.6° | 65.8° |
| C12 | N11 | C33 | H20 | 68.0° | 65.8° |
| C12 | N11 | C33 | H21 | 51.3° | 54.1° |
| C12 | C29 | C16 | N17 | 179.9° | 180.0° |
| C12 | C29 | C16 | N15 | 0.4° | 0.0° |
| C29 | C12 | N13 | C14 | 0.3° | 0.1° |
| C16 | C29 | C12 | N13 | 0.3° | 0.0° |
| C29 | C16 | N17 | N15 | 179.5° | 180.0° |
| C29 | C16 | N17 | C18 | 165.2° | 174.1° |
| C29 | C16 | N15 | C14 | 0.4° | 0.0° |
| C29 | C16 | N17 | H24 | 14.7° | 5.9° |
| C12 | N13 | C14 | N15 | 0.3° | 0.1° |
| C12 | N13 | C14 | H13 | 179.8° | 180.0° |
| C16 | N17 | C18 | H24 | 180.0° | 180.0° |
| C16 | N17 | C18 | C19 | 153.5° | 30.2° |
| C16 | N17 | C18 | C27 | 28.5° | 149.5° |
| N17 | C16 | N15 | C14 | 179.8° | 180.0° |
| C18 | N17 | C16 | N15 | 15.3° | 5.9° |
| N17 | C18 | C19 | C27 | 178.1° | 179.7° |
| N17 | C18 | C19 | C20 | 179.1° | 179.7° |
| N17 | C18 | C27 | F28 | 1.4° | 0.3° |
| N17 | C18 | C27 | C26 | 178.9° | 179.8° |
| N17 | C18 | C19 | H14 | 0.9° | 0.3° |
| C16 | N15 | C14 | N13 | 0.3° | 0.1° |
| C16 | N15 | C14 | H13 | 179.7° | 180.0° |
| N15 | C16 | N17 | H24 | 164.7° | 174.1° |
| N13 | C14 | N15 | H13 | 180.0° | 179.9° |
| C18 | C19 | C20 | H14 | 180.0° | 179.9° |
| C18 | C19 | C20 | C21 | 0.2° | 0.0° |
| C19 | C18 | C27 | F28 | 179.4° | 180.0° |
| C19 | C18 | C27 | C26 | 1.0° | 0.1° |
| C18 | C19 | C20 | H15 | 179.8° | 180.0° |
| C19 | C18 | N17 | H24 | 26.6° | 149.8° |
| C20 | C19 | C18 | C27 | 0.9° | 0.0° |
| C19 | C20 | C21 | H15 | 180.0° | 180.0° |
| C19 | C20 | C21 | C26 | 0.4° | 0.0° |
| C19 | C20 | C21 | S22 | 179.9° | 180.0° |
| C18 | C27 | F28 | C26 | 179.7° | 179.9° |
| C18 | C27 | C26 | C21 | 0.3° | 0.1° |
| C27 | C18 | C19 | H14 | 179.0° | 180.0° |
| C18 | C27 | C26 | H19 | 179.7° | 180.0° |
| C27 | C18 | N17 | H24 | 151.5° | 30.5° |
| C20 | C21 | C26 | C27 | 0.4° | 0.1° |
| C20 | C21 | C26 | S22 | 179.5° | 180.0° |
| C20 | C21 | S22 | C23 | 4.9° | 90.0° |
| C20 | C21 | S22 | O24 | 118.8° | 154.0° |
| C20 | C21 | S22 | O25 | 128.4° | 26.1° |
| C21 | C20 | C19 | H14 | 179.8° | 179.9° |
| C20 | C21 | C26 | H19 | 179.6° | 180.0° |
| F28 | C27 | C26 | C21 | 180.0° | 179.9° |
| F28 | C27 | C26 | H19 | 0.0° | 0.1° |
| C27 | C26 | C21 | H19 | 180.0° | 179.9° |
| C27 | C26 | C21 | S22 | 179.9° | 179.9° |
| C26 | C21 | S22 | C23 | 175.6° | 90.0° |
| C26 | C21 | S22 | O24 | 60.7° | 26.0° |
| C26 | C21 | S22 | O25 | 52.1° | 153.9° |
| C26 | C21 | C20 | H15 | 179.6° | 179.9° |
| C21 | S22 | C23 | O24 | 123.9° | 111.6° |
| C21 | S22 | C23 | O25 | 123.5° | 111.6° |
| C21 | S22 | O24 | O25 | 118.5° | 116.8° |
| S22 | C21 | C20 | H15 | 0.1° | 0.0° |
| C21 | S22 | C23 | H16 | 180.0° | 60.0° |
| C21 | S22 | C23 | H17 | 60.0° | 180.0° |
| C21 | S22 | C23 | H18 | 60.0° | 60.1° |
| S22 | C21 | C26 | H19 | 0.1° | 0.1° |
| C23 | S22 | O24 | O25 | 118.4° | 131.5° |
| S22 | C23 | H16 | H17 | 120.0° | 120.0° |
| S22 | C23 | H16 | H18 | 120.0° | 120.0° |
| S22 | C23 | H17 | H18 | 120.0° | 120.0° |
| O24 | S22 | C23 | H16 | 56.1° | 51.6° |
| O24 | S22 | C23 | H17 | 63.9° | 68.4° |
| O24 | S22 | C23 | H18 | 176.1° | 171.7° |
| O25 | S22 | C23 | H16 | 56.5° | 171.6° |
| O25 | S22 | C23 | H17 | 176.5° | 68.3° |
| O25 | S22 | C23 | H18 | 63.5° | 51.6° |
| H1 | C1 | H2 | H3 | 120.0° | 119.9° |
| H1 | C1 | C2 | H4 | 61.7° | 180.0° |
| H2 | C1 | C2 | H4 | 58.3° | 60.0° |
| H3 | C1 | C2 | H4 | 178.3° | 60.0° |
| H4 | C2 | C3 | H5 | 61.7° | 180.0° |
| H4 | C2 | C3 | H6 | 58.3° | 59.9° |
| H4 | C2 | C3 | H7 | 178.3° | 60.0° |
| H5 | C3 | H6 | H7 | 120.0° | 120.1° |
| H8 | C8 | C9 | H9 | 88.1° | 177.8° |
| H8 | C8 | C9 | H10 | 30.2° | 57.6° |
| H8 | C8 | C34 | H22 | 27.0° | 57.6° |
| H8 | C8 | C34 | H23 | 146.7° | 177.8° |
| H9 | C9 | C10 | H11 | 53.8° | 59.2° |
| H9 | C9 | C10 | H12 | 64.6° | 179.2° |
| H10 | C9 | C10 | H11 | 172.1° | 60.8° |
| H10 | C9 | C10 | H12 | 53.7° | 59.2° |
| H14 | C19 | C20 | H15 | 0.3° | 0.0° |
| H16 | C23 | H17 | H18 | 120.0° | 120.0° |
| H20 | C33 | C34 | H22 | 70.3° | 59.1° |
| H20 | C33 | C34 | H23 | 170.0° | 179.3° |
| H21 | C33 | C34 | H22 | 49.1° | 60.8° |
| H21 | C33 | C34 | H23 | 70.7° | 59.3° |
