33H
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O3 | C16 | doub | 1.22Å | 1.23Å | |
| O4 | C16 | sing | 1.35Å | 1.36Å | |
| C16 | C15 | sing | 1.41Å | 1.47Å | |
| C15 | S1 | sing | 1.76Å | 1.75Å | Aromatic |
| C15 | C1 | doub | 1.38Å | 1.38Å | Aromatic |
| O2 | C2 | doub | 1.21Å | 1.25Å | |
| C3 | C2 | sing | 1.50Å | 1.57Å | |
| C3 | C12 | sing | 1.53Å | 1.55Å | |
| C3 | O1 | sing | 1.43Å | 1.45Å | |
| S1 | C14 | sing | 1.76Å | 1.72Å | Aromatic |
| C2 | N1 | sing | 1.34Å | 1.37Å | |
| C4 | O1 | sing | 1.43Å | 1.43Å | |
| C4 | C5 | sing | 1.53Å | 1.56Å | |
| N1 | C1 | sing | 1.40Å | 1.42Å | |
| N1 | C5 | sing | 1.46Å | 1.51Å | |
| C1 | C13 | sing | 1.37Å | 1.43Å | Aromatic |
| C12 | C23 | sing | 1.53Å | 1.53Å | |
| C5 | C6 | sing | 1.53Å | 1.56Å | |
| C14 | C13 | doub | 1.37Å | 1.36Å | Aromatic |
| C14 | C17 | sing | 1.43Å | 1.40Å | |
| C23 | O5 | sing | 1.43Å | 1.41Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C6 | C7 | sing | 1.53Å | 1.57Å | |
| C6 | C11 | sing | 1.53Å | 1.56Å | |
| C17 | C18 | trip | 1.17Å | 1.21Å | |
| C7 | C8 | sing | 1.53Å | 1.55Å | |
| C18 | C19 | sing | 1.47Å | 1.47Å | |
| C11 | C10 | sing | 1.53Å | 1.55Å | |
| C22 | C19 | sing | 1.53Å | 1.54Å | |
| C8 | C9 | sing | 1.53Å | 1.56Å | |
| C19 | C20 | sing | 1.53Å | 1.55Å | |
| C19 | C21 | sing | 1.53Å | 1.54Å | |
| C10 | C9 | sing | 1.53Å | 1.56Å | |
| C3 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C12 | H5 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.08Å | 1.08Å | |
| C20 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.09Å | 1.10Å | |
| C20 | H9 | sing | 1.09Å | 1.10Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C22 | H15 | sing | 1.09Å | 1.10Å | |
| C23 | H16 | sing | 1.09Å | 1.10Å | |
| C24 | H17 | sing | 1.09Å | 1.10Å | |
| C24 | H18 | sing | 1.09Å | 1.10Å | |
| C24 | H19 | sing | 1.09Å | 1.10Å | |
| C4 | H20 | sing | 1.09Å | 1.10Å | |
| C4 | H21 | sing | 1.09Å | 1.10Å | |
| C5 | H22 | sing | 1.09Å | 1.10Å | |
| C6 | H23 | sing | 1.09Å | 1.10Å | |
| C7 | H24 | sing | 1.09Å | 1.10Å | |
| C7 | H25 | sing | 1.09Å | 1.10Å | |
| C8 | H26 | sing | 1.09Å | 1.10Å | |
| C8 | H27 | sing | 1.09Å | 1.10Å | |
| C9 | H28 | sing | 1.09Å | 1.10Å | |
| C9 | H29 | sing | 1.09Å | 1.10Å | |
| C10 | H30 | sing | 1.09Å | 1.10Å | |
| C10 | H31 | sing | 1.09Å | 1.10Å | |
| O4 | H32 | sing | 0.97Å | 0.95Å | |
| O5 | H33 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O3 | C16 | O4 | 122.6° | 119.9° |
| O3 | C16 | C15 | 123.1° | 120.0° |
| O4 | C16 | C15 | 114.3° | 120.0° |
| C16 | O4 | H32 | 109.5° | 114.0° |
| C16 | C15 | S1 | 114.9° | 125.2° |
| C16 | C15 | C1 | 134.8° | 125.1° |
| S1 | C15 | C1 | 110.3° | 109.6° |
| C15 | S1 | C14 | 90.1° | 91.3° |
| C15 | C1 | N1 | 125.0° | 122.8° |
| C15 | C1 | C13 | 114.9° | 114.4° |
| O2 | C2 | C3 | 119.8° | 118.9° |
| O2 | C2 | N1 | 122.0° | 118.8° |
| C2 | C3 | C12 | 114.3° | 109.4° |
| C2 | C3 | O1 | 111.8° | 109.8° |
| C3 | C2 | N1 | 118.3° | 122.3° |
| C2 | C3 | H1 | 106.5° | 109.4° |
| C12 | C3 | O1 | 109.4° | 109.4° |
| C3 | C12 | C23 | 115.9° | 109.5° |
| C12 | C3 | H1 | 106.7° | 109.5° |
| C3 | C12 | H4 | 107.9° | 109.4° |
| C3 | C12 | H5 | 107.9° | 109.5° |
| C3 | O1 | C4 | 113.8° | 113.0° |
| O1 | C3 | H1 | 107.9° | 109.3° |
| S1 | C14 | C13 | 115.4° | 109.9° |
| S1 | C14 | C17 | 120.1° | 125.1° |
| C2 | N1 | C1 | 117.8° | 118.7° |
| C2 | N1 | C5 | 124.4° | 122.5° |
| O1 | C4 | C5 | 109.9° | 108.7° |
| O1 | C4 | H20 | 109.4° | 109.6° |
| O1 | C4 | H21 | 109.4° | 109.6° |
| C4 | C5 | N1 | 111.0° | 109.9° |
| C4 | C5 | C6 | 114.4° | 109.4° |
| C5 | C4 | H20 | 109.3° | 109.6° |
| C5 | C4 | H21 | 109.4° | 109.6° |
| C4 | C5 | H22 | 106.4° | 109.5° |
| C1 | N1 | C5 | 117.7° | 118.8° |
| N1 | C1 | C13 | 119.8° | 122.8° |
| N1 | C5 | C6 | 111.2° | 109.4° |
| N1 | C5 | H22 | 107.0° | 109.4° |
| C1 | C13 | C14 | 109.2° | 114.8° |
| C1 | C13 | H6 | 125.4° | 122.6° |
| C12 | C23 | O5 | 108.2° | 109.5° |
| C12 | C23 | C24 | 113.9° | 109.5° |
| C23 | C12 | H4 | 107.8° | 109.5° |
| C23 | C12 | H5 | 107.8° | 109.5° |
| C12 | C23 | H16 | 107.9° | 109.6° |
| C5 | C6 | C7 | 114.6° | 109.5° |
| C5 | C6 | C11 | 115.9° | 109.5° |
| C6 | C5 | H22 | 106.4° | 109.3° |
| C5 | C6 | H23 | 104.9° | 109.5° |
| C13 | C14 | C17 | 124.4° | 125.0° |
| C14 | C13 | H6 | 125.4° | 122.7° |
| C14 | C17 | C18 | 178.0° | 180.0° |
| O5 | C23 | C24 | 109.4° | 109.4° |
| O5 | C23 | H16 | 109.5° | 109.4° |
| C23 | O5 | H33 | 109.5° | 114.0° |
| C24 | C23 | H16 | 107.8° | 109.5° |
| C23 | C24 | H17 | 109.5° | 109.4° |
| C23 | C24 | H18 | 109.5° | 109.5° |
| C23 | C24 | H19 | 109.5° | 109.4° |
| C7 | C6 | C11 | 110.4° | 109.5° |
| C6 | C7 | C8 | 112.5° | 109.5° |
| C7 | C6 | H23 | 104.8° | 109.4° |
| C6 | C7 | H24 | 108.7° | 109.5° |
| C6 | C7 | H25 | 108.7° | 109.5° |
| C6 | C11 | C10 | 112.0° | 109.5° |
| C6 | C11 | H2 | 108.8° | 109.5° |
| C6 | C11 | H3 | 108.8° | 109.5° |
| C11 | C6 | H23 | 104.9° | 109.4° |
| C17 | C18 | C19 | 177.9° | 180.0° |
| C7 | C8 | C9 | 111.8° | 109.5° |
| C8 | C7 | H24 | 108.7° | 109.5° |
| C8 | C7 | H25 | 108.7° | 109.5° |
| C7 | C8 | H26 | 108.9° | 109.5° |
| C7 | C8 | H27 | 108.9° | 109.5° |
| C18 | C19 | C22 | 109.4° | 109.5° |
| C18 | C19 | C20 | 109.7° | 109.5° |
| C18 | C19 | C21 | 106.4° | 109.5° |
| C11 | C10 | C9 | 111.9° | 109.5° |
| C10 | C11 | H2 | 108.8° | 109.5° |
| C10 | C11 | H3 | 108.8° | 109.5° |
| C11 | C10 | H30 | 108.8° | 109.5° |
| C11 | C10 | H31 | 108.8° | 109.5° |
| C22 | C19 | C20 | 110.6° | 109.5° |
| C22 | C19 | C21 | 110.3° | 109.5° |
| C19 | C22 | H13 | 109.5° | 109.5° |
| C19 | C22 | H14 | 109.5° | 109.5° |
| C19 | C22 | H15 | 109.4° | 109.5° |
| C8 | C9 | C10 | 112.9° | 109.4° |
| C9 | C8 | H26 | 108.9° | 109.5° |
| C9 | C8 | H27 | 108.9° | 109.4° |
| C8 | C9 | H28 | 108.6° | 109.5° |
| C8 | C9 | H29 | 108.6° | 109.5° |
| C20 | C19 | C21 | 110.3° | 109.5° |
| C19 | C20 | H7 | 109.5° | 109.4° |
| C19 | C20 | H8 | 109.5° | 109.5° |
| C19 | C20 | H9 | 109.5° | 109.5° |
| C19 | C21 | H10 | 109.5° | 109.5° |
| C19 | C21 | H11 | 109.5° | 109.5° |
| C19 | C21 | H12 | 109.5° | 109.5° |
| C10 | C9 | H28 | 108.6° | 109.5° |
| C10 | C9 | H29 | 108.6° | 109.5° |
| C9 | C10 | H30 | 108.9° | 109.4° |
| C9 | C10 | H31 | 108.8° | 109.5° |
| H2 | C11 | H3 | 109.5° | 109.5° |
| H4 | C12 | H5 | 109.4° | 109.5° |
| H7 | C20 | H8 | 109.5° | 109.5° |
| H7 | C20 | H9 | 109.5° | 109.5° |
| H8 | C20 | H9 | 109.5° | 109.5° |
| H10 | C21 | H11 | 109.5° | 109.4° |
| H10 | C21 | H12 | 109.5° | 109.5° |
| H11 | C21 | H12 | 109.5° | 109.5° |
| H13 | C22 | H14 | 109.5° | 109.5° |
| H13 | C22 | H15 | 109.5° | 109.5° |
| H14 | C22 | H15 | 109.5° | 109.4° |
| H17 | C24 | H18 | 109.4° | 109.5° |
| H17 | C24 | H19 | 109.5° | 109.5° |
| H18 | C24 | H19 | 109.5° | 109.5° |
| H20 | C4 | H21 | 109.4° | 109.7° |
| H24 | C7 | H25 | 109.5° | 109.5° |
| H26 | C8 | H27 | 109.5° | 109.5° |
| H28 | C9 | H29 | 109.5° | 109.5° |
| H30 | C10 | H31 | 109.5° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O3 | C16 | O4 | C15 | 179.2° | 179.9° |
| O3 | C16 | C15 | S1 | 0.4° | 174.1° |
| O3 | C16 | C15 | C1 | 177.8° | 5.9° |
| O3 | C16 | O4 | H32 | 0.0° | 0.0° |
| O4 | C16 | C15 | S1 | 179.5° | 5.8° |
| O4 | C16 | C15 | C1 | 3.0° | 174.1° |
| C16 | C15 | S1 | C1 | 178.1° | 179.9° |
| C16 | C15 | S1 | C14 | 179.9° | 180.0° |
| C16 | C15 | C1 | N1 | 5.6° | 0.2° |
| C16 | C15 | C1 | C13 | 179.2° | 180.0° |
| C15 | C16 | O4 | H32 | 179.2° | 179.9° |
| S1 | C15 | C1 | N1 | 176.8° | 179.7° |
| S1 | C15 | C1 | C13 | 3.2° | 0.0° |
| C15 | S1 | C14 | C13 | 0.0° | 0.0° |
| C15 | S1 | C14 | C17 | 178.3° | 180.0° |
| C1 | C15 | S1 | C14 | 1.8° | 0.0° |
| C15 | C1 | N1 | C2 | 99.0° | 89.5° |
| C15 | C1 | N1 | C13 | 173.3° | 179.8° |
| C15 | C1 | N1 | C5 | 79.6° | 90.5° |
| C15 | C1 | C13 | C14 | 3.2° | 0.0° |
| C15 | C1 | C13 | H6 | 176.9° | 180.0° |
| O2 | C2 | C3 | N1 | 179.5° | 179.7° |
| O2 | C2 | C3 | C12 | 38.5° | 44.3° |
| O2 | C2 | C3 | O1 | 163.4° | 164.4° |
| O2 | C2 | N1 | C1 | 0.2° | 1.6° |
| O2 | C2 | N1 | C5 | 178.6° | 178.4° |
| O2 | C2 | C3 | H1 | 79.0° | 75.6° |
| C2 | C3 | C12 | O1 | 126.2° | 120.3° |
| C2 | C3 | C12 | H1 | 117.4° | 119.9° |
| C2 | C3 | O1 | H1 | 116.8° | 120.1° |
| C2 | C3 | O1 | C4 | 51.2° | 49.6° |
| C3 | C2 | N1 | C1 | 179.7° | 178.2° |
| C3 | C2 | N1 | C5 | 1.9° | 1.9° |
| C2 | C3 | C12 | C23 | 57.1° | 175.0° |
| C2 | C3 | C12 | H4 | 178.0° | 55.0° |
| C2 | C3 | C12 | H5 | 63.9° | 65.0° |
| C12 | C3 | O1 | H1 | 115.6° | 119.8° |
| C12 | C3 | C2 | N1 | 141.0° | 136.0° |
| C12 | C3 | O1 | C4 | 178.8° | 169.7° |
| C3 | C12 | C23 | H4 | 120.9° | 119.9° |
| C3 | C12 | C23 | H5 | 121.0° | 120.0° |
| C3 | C12 | C23 | O5 | 152.5° | 65.0° |
| C3 | C12 | C23 | C24 | 85.6° | 175.0° |
| C3 | C12 | H4 | H5 | 117.1° | 120.0° |
| C3 | C12 | C23 | H16 | 34.1° | 54.9° |
| O1 | C3 | C2 | N1 | 16.1° | 15.9° |
| C3 | O1 | C4 | C5 | 66.1° | 68.3° |
| O1 | C3 | C12 | C23 | 69.1° | 64.7° |
| O1 | C3 | C12 | H4 | 51.9° | 175.4° |
| O1 | C3 | C12 | H5 | 170.0° | 55.4° |
| C3 | O1 | C4 | H20 | 54.0° | 51.4° |
| C3 | O1 | C4 | H21 | 173.8° | 171.9° |
| S1 | C14 | C13 | C1 | 1.7° | 0.0° |
| S1 | C14 | C13 | C17 | 178.2° | 180.0° |
| S1 | C14 | C17 | C18 | 31.3° | 67.0° |
| S1 | C14 | C13 | H6 | 178.3° | 180.0° |
| C2 | N1 | C5 | C4 | 11.5° | 18.3° |
| C2 | N1 | C1 | C5 | 178.5° | 180.0° |
| C2 | N1 | C1 | C13 | 74.4° | 90.3° |
| C2 | N1 | C5 | C6 | 117.0° | 101.8° |
| N1 | C2 | C3 | H1 | 101.5° | 104.1° |
| C2 | N1 | C5 | H22 | 127.2° | 138.5° |
| O1 | C4 | C5 | H20 | 120.1° | 119.8° |
| O1 | C4 | C5 | H21 | 120.1° | 119.8° |
| O1 | C4 | C5 | N1 | 43.4° | 49.1° |
| O1 | C4 | C5 | C6 | 83.4° | 71.0° |
| C4 | O1 | C3 | H1 | 65.6° | 70.5° |
| O1 | C4 | H20 | H21 | 119.8° | 120.4° |
| O1 | C4 | C5 | H22 | 159.5° | 169.3° |
| C4 | C5 | N1 | C1 | 166.9° | 161.7° |
| C4 | C5 | N1 | C6 | 128.5° | 120.1° |
| C4 | C5 | N1 | H22 | 115.7° | 120.2° |
| C4 | C5 | C6 | H22 | 117.2° | 119.8° |
| C4 | C5 | C6 | C7 | 60.6° | 60.4° |
| C4 | C5 | C6 | C11 | 69.8° | 59.7° |
| C5 | C4 | H20 | H21 | 119.8° | 120.4° |
| C4 | C5 | C6 | H23 | 175.0° | 179.6° |
| C1 | N1 | C5 | C6 | 64.5° | 78.2° |
| N1 | C1 | C13 | C14 | 177.2° | 179.8° |
| N1 | C1 | C13 | H6 | 2.9° | 0.2° |
| C1 | N1 | C5 | H22 | 51.2° | 41.5° |
| C5 | N1 | C1 | C13 | 107.1° | 89.7° |
| N1 | C5 | C6 | H22 | 116.1° | 119.7° |
| N1 | C5 | C6 | C7 | 172.7° | 179.2° |
| N1 | C5 | C6 | C11 | 56.9° | 60.8° |
| N1 | C5 | C4 | H20 | 76.7° | 70.6° |
| N1 | C5 | C4 | H21 | 163.5° | 168.9° |
| N1 | C5 | C6 | H23 | 58.3° | 59.2° |
| C1 | C13 | C14 | H6 | 180.0° | 180.0° |
| C1 | C13 | C14 | C17 | 179.9° | 180.0° |
| C12 | C23 | O5 | C24 | 124.6° | 120.0° |
| C12 | C23 | O5 | H16 | 117.4° | 120.1° |
| C12 | C23 | C24 | H16 | 119.7° | 120.1° |
| C23 | C12 | C3 | H1 | 174.5° | 55.1° |
| C23 | C12 | H4 | H5 | 117.1° | 120.1° |
| C12 | C23 | C24 | H17 | 180.0° | 60.0° |
| C12 | C23 | C24 | H18 | 60.0° | 180.0° |
| C12 | C23 | C24 | H19 | 60.0° | 60.0° |
| C12 | C23 | O5 | H33 | 180.0° | 59.9° |
| C5 | C6 | C7 | C11 | 133.1° | 120.0° |
| C5 | C6 | C7 | H23 | 114.4° | 120.0° |
| C5 | C6 | C11 | H23 | 115.1° | 120.0° |
| C5 | C6 | C7 | C8 | 172.4° | 180.0° |
| C5 | C6 | C11 | C10 | 172.3° | 180.0° |
| C5 | C6 | C11 | H2 | 67.3° | 60.0° |
| C5 | C6 | C11 | H3 | 51.9° | 60.0° |
| C6 | C5 | C4 | H20 | 156.5° | 169.3° |
| C6 | C5 | C4 | H21 | 36.7° | 48.8° |
| C5 | C6 | C7 | H24 | 52.0° | 59.9° |
| C5 | C6 | C7 | H25 | 67.1° | 60.0° |
| C13 | C14 | C17 | C18 | 146.8° | 113.0° |
| C14 | C17 | C18 | C19 | 151.4° | 128.8° |
| C17 | C14 | C13 | H6 | 0.1° | 0.0° |
| O5 | C23 | C24 | H16 | 119.0° | 119.9° |
| O5 | C23 | C12 | H4 | 86.6° | 175.0° |
| O5 | C23 | C12 | H5 | 31.5° | 55.0° |
| O5 | C23 | C24 | H17 | 58.8° | 60.0° |
| O5 | C23 | C24 | H18 | 178.7° | 60.0° |
| O5 | C23 | C24 | H19 | 61.2° | 180.0° |
| C24 | C23 | C12 | H4 | 35.3° | 55.1° |
| C24 | C23 | C12 | H5 | 153.4° | 65.0° |
| C23 | C24 | H17 | H18 | 120.0° | 120.0° |
| C23 | C24 | H17 | H19 | 120.0° | 120.0° |
| C23 | C24 | H18 | H19 | 120.0° | 120.0° |
| C24 | C23 | O5 | H33 | 55.4° | 60.1° |
| C7 | C6 | C11 | H23 | 112.5° | 119.9° |
| C6 | C7 | C8 | H24 | 120.4° | 120.0° |
| C6 | C7 | C8 | H25 | 120.5° | 120.0° |
| C7 | C6 | C11 | C10 | 55.3° | 59.9° |
| C6 | C7 | C8 | C9 | 52.6° | 60.0° |
| C7 | C6 | C11 | H2 | 65.1° | 60.0° |
| C7 | C6 | C11 | H3 | 175.6° | 180.0° |
| C7 | C6 | C5 | H22 | 56.6° | 59.4° |
| C6 | C7 | H24 | H25 | 118.6° | 120.0° |
| C6 | C7 | C8 | H26 | 67.7° | 60.0° |
| C6 | C7 | C8 | H27 | 173.0° | 180.0° |
| C11 | C6 | C7 | C8 | 54.5° | 60.0° |
| C6 | C11 | C10 | H2 | 120.4° | 120.0° |
| C6 | C11 | C10 | H3 | 120.4° | 120.1° |
| C6 | C11 | C10 | C9 | 54.4° | 60.0° |
| C6 | C11 | H2 | H3 | 118.9° | 120.1° |
| C11 | C6 | C5 | H22 | 173.0° | 179.5° |
| C11 | C6 | C7 | H24 | 175.0° | 180.0° |
| C11 | C6 | C7 | H25 | 65.9° | 60.0° |
| C6 | C11 | C10 | H30 | 174.8° | 180.0° |
| C6 | C11 | C10 | H31 | 65.9° | 60.0° |
| C17 | C18 | C19 | C22 | 119.4° | 58.2° |
| C17 | C18 | C19 | C20 | 119.1° | 61.8° |
| C17 | C18 | C19 | C21 | 0.2° | 178.2° |
| C7 | C8 | C9 | H26 | 120.3° | 120.0° |
| C7 | C8 | C9 | H27 | 120.3° | 120.0° |
| C7 | C8 | C9 | C10 | 51.2° | 60.0° |
| C8 | C7 | C6 | H23 | 58.0° | 60.0° |
| C8 | C7 | H24 | H25 | 118.6° | 120.0° |
| C7 | C8 | H26 | H27 | 118.9° | 120.0° |
| C7 | C8 | C9 | H28 | 171.7° | 180.0° |
| C7 | C8 | C9 | H29 | 69.3° | 59.9° |
| C18 | C19 | C22 | C20 | 120.9° | 120.0° |
| C18 | C19 | C22 | C21 | 116.7° | 120.0° |
| C18 | C19 | C20 | C21 | 116.9° | 120.0° |
| C18 | C19 | C20 | H7 | 180.0° | 60.0° |
| C18 | C19 | C20 | H8 | 60.0° | 180.0° |
| C18 | C19 | C20 | H9 | 60.0° | 60.0° |
| C18 | C19 | C21 | H10 | 180.0° | 60.0° |
| C18 | C19 | C21 | H11 | 60.0° | 180.0° |
| C18 | C19 | C21 | H12 | 60.0° | 60.0° |
| C18 | C19 | C22 | H13 | 180.0° | 60.0° |
| C18 | C19 | C22 | H14 | 60.0° | 180.0° |
| C18 | C19 | C22 | H15 | 60.0° | 60.0° |
| C11 | C10 | C9 | C8 | 52.2° | 60.0° |
| C11 | C10 | C9 | H30 | 120.4° | 120.0° |
| C11 | C10 | C9 | H31 | 120.3° | 120.1° |
| C10 | C11 | H2 | H3 | 118.8° | 120.0° |
| C10 | C11 | C6 | H23 | 57.2° | 60.0° |
| C11 | C10 | C9 | H28 | 172.7° | 180.0° |
| C11 | C10 | C9 | H29 | 68.3° | 59.9° |
| C11 | C10 | H30 | H31 | 118.9° | 120.0° |
| C22 | C19 | C20 | C21 | 122.4° | 120.0° |
| C22 | C19 | C20 | H7 | 59.3° | 180.0° |
| C22 | C19 | C20 | H8 | 60.7° | 60.0° |
| C22 | C19 | C20 | H9 | 179.2° | 60.0° |
| C22 | C19 | C21 | H10 | 61.5° | 60.0° |
| C22 | C19 | C21 | H11 | 178.5° | 60.0° |
| C22 | C19 | C21 | H12 | 58.5° | 180.0° |
| C19 | C22 | H13 | H14 | 120.0° | 120.0° |
| C19 | C22 | H13 | H15 | 120.0° | 120.0° |
| C19 | C22 | H14 | H15 | 120.0° | 120.0° |
| C8 | C9 | C10 | H28 | 120.5° | 120.0° |
| C8 | C9 | C10 | H29 | 120.5° | 120.0° |
| C9 | C8 | C7 | H24 | 173.1° | 180.0° |
| C9 | C8 | C7 | H25 | 67.8° | 60.0° |
| C9 | C8 | H26 | H27 | 118.9° | 120.0° |
| C8 | C9 | H28 | H29 | 118.5° | 120.0° |
| C8 | C9 | C10 | H30 | 172.6° | 180.0° |
| C8 | C9 | C10 | H31 | 68.1° | 60.0° |
| C19 | C20 | H7 | H8 | 120.0° | 120.0° |
| C19 | C20 | H7 | H9 | 120.0° | 120.0° |
| C19 | C20 | H8 | H9 | 120.0° | 120.1° |
| C20 | C19 | C21 | H10 | 61.0° | 180.0° |
| C20 | C19 | C21 | H11 | 58.9° | 60.0° |
| C20 | C19 | C21 | H12 | 179.0° | 60.0° |
| C20 | C19 | C22 | H13 | 59.0° | 60.0° |
| C20 | C19 | C22 | H14 | 179.1° | 60.0° |
| C20 | C19 | C22 | H15 | 60.9° | 180.0° |
| C21 | C19 | C20 | H7 | 63.1° | 60.0° |
| C21 | C19 | C20 | H8 | 176.9° | 60.0° |
| C21 | C19 | C20 | H9 | 56.9° | 180.0° |
| C19 | C21 | H10 | H11 | 120.0° | 120.0° |
| C19 | C21 | H10 | H12 | 120.0° | 120.0° |
| C19 | C21 | H11 | H12 | 120.0° | 120.0° |
| C21 | C19 | C22 | H13 | 63.3° | 180.0° |
| C21 | C19 | C22 | H14 | 56.7° | 60.0° |
| C21 | C19 | C22 | H15 | 176.7° | 60.0° |
| C9 | C10 | C11 | H2 | 65.9° | 60.0° |
| C9 | C10 | C11 | H3 | 174.8° | 180.0° |
| C10 | C9 | C8 | H26 | 69.2° | 60.0° |
| C10 | C9 | C8 | H27 | 171.5° | 180.0° |
| C10 | C9 | H28 | H29 | 118.4° | 120.0° |
| C9 | C10 | H30 | H31 | 118.9° | 120.0° |
| H1 | C3 | C12 | H4 | 64.6° | 64.9° |
| H1 | C3 | C12 | H5 | 53.5° | 175.1° |
| H2 | C11 | C6 | H23 | 177.6° | 180.0° |
| H2 | C11 | C10 | H30 | 54.4° | 60.0° |
| H2 | C11 | C10 | H31 | 173.7° | 180.0° |
| H3 | C11 | C6 | H23 | 63.2° | 60.0° |
| H3 | C11 | C10 | H30 | 64.8° | 60.0° |
| H3 | C11 | C10 | H31 | 54.5° | 60.0° |
| H4 | C12 | C23 | H16 | 155.0° | 65.0° |
| H5 | C12 | C23 | H16 | 86.9° | 174.9° |
| H7 | C20 | H8 | H9 | 120.0° | 120.0° |
| H10 | C21 | H11 | H12 | 120.0° | 120.0° |
| H13 | C22 | H14 | H15 | 120.0° | 120.0° |
| H16 | C23 | C24 | H17 | 60.2° | 179.9° |
| H16 | C23 | C24 | H18 | 59.7° | 59.9° |
| H16 | C23 | C24 | H19 | 179.8° | 60.1° |
| H16 | C23 | O5 | H33 | 62.6° | 180.0° |
| H17 | C24 | H18 | H19 | 120.0° | 120.1° |
| H20 | C4 | C5 | H22 | 39.4° | 49.5° |
| H21 | C4 | C5 | H22 | 80.4° | 70.9° |
| H22 | C5 | C6 | H23 | 57.8° | 60.6° |
| H23 | C6 | C7 | H24 | 62.4° | 60.1° |
| H23 | C6 | C7 | H25 | 178.4° | 179.9° |
| H24 | C7 | C8 | H26 | 52.7° | 60.0° |
| H24 | C7 | C8 | H27 | 66.6° | 60.0° |
| H25 | C7 | C8 | H26 | 171.8° | NaN° |
| H25 | C7 | C8 | H27 | 52.5° | 60.0° |
| H26 | C8 | C9 | H28 | 51.3° | 60.0° |
| H26 | C8 | C9 | H29 | 170.3° | 179.9° |
| H27 | C8 | C9 | H28 | 68.0° | 60.0° |
| H27 | C8 | C9 | H29 | 51.0° | 60.1° |
| H28 | C9 | C10 | H30 | 66.9° | 60.0° |
| H28 | C9 | C10 | H31 | 52.3° | 59.9° |
| H29 | C9 | C10 | H30 | 52.1° | 60.1° |
| H29 | C9 | C10 | H31 | 171.3° | 180.0° |
