I7J
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O4 | S1 | doub | 1.42Å | 1.42Å | |
| C21 | S1 | sing | 1.81Å | 1.76Å | |
| S1 | O5 | doub | 1.42Å | 1.42Å | |
| S1 | C18 | sing | 1.76Å | 1.87Å | |
| C19 | C18 | doub | 1.38Å | 1.41Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.41Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.41Å | Aromatic |
| C20 | C15 | doub | 1.39Å | 1.40Å | Aromatic |
| C17 | C16 | doub | 1.38Å | 1.42Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.44Å | Aromatic |
| C15 | N5 | sing | 1.40Å | 1.46Å | |
| C16 | F1 | sing | 1.35Å | 1.30Å | |
| N4 | N5 | sing | 1.40Å | 1.40Å | Aromatic |
| N4 | C14 | doub | 1.30Å | 1.35Å | Aromatic |
| N5 | C12 | sing | 1.37Å | 1.42Å | Aromatic |
| C14 | C13 | sing | 1.41Å | 1.44Å | Aromatic |
| C12 | N3 | doub | 1.33Å | 1.37Å | Aromatic |
| C12 | C13 | sing | 1.41Å | 1.44Å | Aromatic |
| N3 | C11 | sing | 1.32Å | 1.36Å | Aromatic |
| C13 | C10 | doub | 1.41Å | 1.42Å | Aromatic |
| C11 | N2 | doub | 1.32Å | 1.37Å | Aromatic |
| C10 | N2 | sing | 1.33Å | 1.36Å | Aromatic |
| C10 | O3 | sing | 1.35Å | 1.37Å | |
| O3 | C7 | sing | 1.43Å | 1.46Å | |
| C7 | C8 | sing | 1.53Å | 1.56Å | |
| C7 | C6 | sing | 1.53Å | 1.54Å | |
| C8 | C9 | sing | 1.53Å | 1.58Å | |
| C6 | C5 | sing | 1.53Å | 1.56Å | |
| C9 | N1 | sing | 1.47Å | 1.47Å | |
| C5 | N1 | sing | 1.47Å | 1.50Å | |
| N1 | C4 | sing | 1.35Å | 1.43Å | |
| C4 | O2 | doub | 1.22Å | 1.23Å | |
| C4 | O1 | sing | 1.35Å | 1.39Å | |
| C3 | C2 | sing | 1.53Å | 1.53Å | |
| O1 | C2 | sing | 1.45Å | 1.46Å | |
| C2 | C1 | sing | 1.53Å | 1.55Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C17 | H8 | sing | 1.08Å | 1.08Å | |
| C20 | H9 | sing | 1.08Å | 1.08Å | |
| C21 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H16 | sing | 1.08Å | 1.08Å | |
| C14 | H17 | sing | 1.08Å | 1.08Å | |
| C19 | H18 | sing | 1.08Å | 1.08Å | |
| C2 | H19 | sing | 1.09Å | 1.10Å | |
| C3 | H20 | sing | 1.09Å | 1.10Å | |
| C3 | H21 | sing | 1.09Å | 1.10Å | |
| C3 | H22 | sing | 1.09Å | 1.10Å | |
| C9 | H23 | sing | 1.09Å | 1.10Å | |
| C9 | H24 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O4 | S1 | C21 | 107.7° | 110.5° |
| O4 | S1 | O5 | 111.2° | 121.1° |
| O4 | S1 | C18 | 112.7° | 104.3° |
| C21 | S1 | O5 | 107.3° | 110.5° |
| C21 | S1 | C18 | 107.6° | 104.4° |
| S1 | C21 | H10 | 109.5° | 109.5° |
| S1 | C21 | H11 | 109.5° | 109.5° |
| S1 | C21 | H12 | 109.4° | 109.5° |
| O5 | S1 | C18 | 110.1° | 104.3° |
| S1 | C18 | C19 | 123.0° | 119.9° |
| S1 | C18 | C17 | 123.2° | 119.9° |
| C18 | C19 | C20 | 124.8° | 120.1° |
| C19 | C18 | C17 | 113.8° | 120.2° |
| C18 | C19 | H18 | 117.6° | 120.0° |
| C19 | C20 | C15 | 120.6° | 119.9° |
| C19 | C20 | H9 | 119.7° | 120.0° |
| C20 | C19 | H18 | 117.6° | 120.0° |
| C18 | C17 | C16 | 123.9° | 120.0° |
| C18 | C17 | H8 | 118.1° | 120.0° |
| C20 | C15 | C16 | 116.8° | 119.8° |
| C20 | C15 | N5 | 122.7° | 120.1° |
| C15 | C20 | H9 | 119.7° | 120.0° |
| C17 | C16 | C15 | 120.2° | 119.9° |
| C17 | C16 | F1 | 120.6° | 120.1° |
| C16 | C17 | H8 | 118.1° | 120.0° |
| C16 | C15 | N5 | 120.6° | 120.1° |
| C15 | C16 | F1 | 119.2° | 120.0° |
| C15 | N5 | N4 | 120.9° | 125.9° |
| C15 | N5 | C12 | 130.3° | 125.9° |
| N5 | N4 | C14 | 107.7° | 109.8° |
| N4 | N5 | C12 | 108.8° | 108.2° |
| N4 | C14 | C13 | 111.8° | 108.5° |
| N4 | C14 | H17 | 124.1° | 125.8° |
| N5 | C12 | N3 | 128.7° | 134.6° |
| N5 | C12 | C13 | 107.8° | 106.5° |
| C14 | C13 | C12 | 104.0° | 107.0° |
| C14 | C13 | C10 | 137.4° | 134.7° |
| C13 | C14 | H17 | 124.1° | 125.8° |
| N3 | C12 | C13 | 123.5° | 118.9° |
| C12 | N3 | C11 | 112.5° | 120.6° |
| C12 | C13 | C10 | 118.6° | 118.3° |
| N3 | C11 | N2 | 128.9° | 122.7° |
| N3 | C11 | H16 | 115.6° | 118.7° |
| C13 | C10 | N2 | 118.0° | 118.4° |
| C13 | C10 | O3 | 122.6° | 120.8° |
| C11 | N2 | C10 | 118.5° | 121.2° |
| N2 | C11 | H16 | 115.5° | 118.7° |
| N2 | C10 | O3 | 119.4° | 120.8° |
| C10 | O3 | C7 | 120.4° | 117.0° |
| O3 | C7 | C8 | 114.1° | 109.5° |
| O3 | C7 | C6 | 111.3° | 109.6° |
| O3 | C7 | H5 | 108.8° | 109.4° |
| C8 | C7 | C6 | 107.0° | 109.6° |
| C7 | C8 | C9 | 114.6° | 109.4° |
| C8 | C7 | H5 | 107.6° | 109.4° |
| C7 | C8 | H6 | 108.2° | 109.5° |
| C7 | C8 | H7 | 108.2° | 109.5° |
| C7 | C6 | C5 | 112.2° | 109.3° |
| C7 | C6 | H3 | 108.8° | 109.5° |
| C7 | C6 | H4 | 108.8° | 109.5° |
| C6 | C7 | H5 | 107.8° | 109.3° |
| C8 | C9 | N1 | 112.7° | 109.0° |
| C9 | C8 | H6 | 108.2° | 109.6° |
| C9 | C8 | H7 | 108.1° | 109.4° |
| C8 | C9 | H23 | 108.6° | 109.5° |
| C8 | C9 | H24 | 108.6° | 109.6° |
| C6 | C5 | N1 | 114.3° | 108.8° |
| C6 | C5 | H1 | 108.2° | 109.6° |
| C6 | C5 | H2 | 108.2° | 109.7° |
| C5 | C6 | H3 | 108.8° | 109.5° |
| C5 | C6 | H4 | 108.8° | 109.5° |
| C9 | N1 | C5 | 112.7° | 118.7° |
| C9 | N1 | C4 | 128.2° | 120.6° |
| N1 | C9 | H23 | 108.7° | 109.7° |
| N1 | C9 | H24 | 108.6° | 109.3° |
| C5 | N1 | C4 | 119.1° | 120.6° |
| N1 | C5 | H1 | 108.3° | 109.6° |
| N1 | C5 | H2 | 108.3° | 109.6° |
| N1 | C4 | O2 | 120.8° | 120.0° |
| N1 | C4 | O1 | 120.8° | 120.0° |
| O2 | C4 | O1 | 118.5° | 120.0° |
| C4 | O1 | C2 | 118.6° | 117.0° |
| C3 | C2 | O1 | 106.9° | 109.5° |
| C3 | C2 | C1 | 109.5° | 109.4° |
| C3 | C2 | H19 | 110.2° | 109.5° |
| C2 | C3 | H20 | 109.5° | 109.5° |
| C2 | C3 | H21 | 109.5° | 109.4° |
| C2 | C3 | H22 | 109.5° | 109.5° |
| O1 | C2 | C1 | 108.8° | 109.4° |
| O1 | C2 | H19 | 111.3° | 109.5° |
| C2 | C1 | H13 | 109.5° | 109.4° |
| C2 | C1 | H14 | 109.5° | 109.5° |
| C2 | C1 | H15 | 109.4° | 109.5° |
| C1 | C2 | H19 | 110.0° | 109.5° |
| H1 | C5 | H2 | 109.5° | 109.6° |
| H3 | C6 | H4 | 109.5° | 109.5° |
| H6 | C8 | H7 | 109.5° | 109.6° |
| H10 | C21 | H11 | 109.5° | 109.5° |
| H10 | C21 | H12 | 109.5° | 109.5° |
| H11 | C21 | H12 | 109.5° | 109.5° |
| H13 | C1 | H14 | 109.5° | 109.4° |
| H13 | C1 | H15 | 109.5° | 109.5° |
| H14 | C1 | H15 | 109.5° | 109.5° |
| H20 | C3 | H21 | 109.5° | 109.5° |
| H20 | C3 | H22 | 109.5° | 109.5° |
| H21 | C3 | H22 | 109.5° | 109.5° |
| H23 | C9 | H24 | 109.5° | 109.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O4 | S1 | C21 | O5 | 119.8° | 136.7° |
| O4 | S1 | C21 | C18 | 121.8° | 111.6° |
| O4 | S1 | O5 | C18 | 125.6° | 116.8° |
| O4 | S1 | C18 | C19 | 67.3° | 154.4° |
| O4 | S1 | C18 | C17 | 112.6° | 26.0° |
| O4 | S1 | C21 | H10 | 180.0° | 51.6° |
| O4 | S1 | C21 | H11 | 60.0° | 171.6° |
| O4 | S1 | C21 | H12 | 60.0° | 68.4° |
| C21 | S1 | O5 | C18 | 116.8° | 111.7° |
| C21 | S1 | C18 | C19 | 51.3° | 89.6° |
| C21 | S1 | C18 | C17 | 128.8° | 90.0° |
| S1 | C21 | H10 | H11 | 120.0° | 120.0° |
| S1 | C21 | H10 | H12 | 120.0° | 120.0° |
| S1 | C21 | H11 | H12 | 120.0° | 120.0° |
| O5 | S1 | C18 | C19 | 167.9° | 26.5° |
| O5 | S1 | C18 | C17 | 12.1° | 153.9° |
| O5 | S1 | C21 | H10 | 60.2° | 171.6° |
| O5 | S1 | C21 | H11 | 59.8° | 51.6° |
| O5 | S1 | C21 | H12 | 179.8° | 68.4° |
| S1 | C18 | C19 | C17 | 179.9° | 179.6° |
| S1 | C18 | C19 | C20 | 179.9° | 179.8° |
| S1 | C18 | C17 | C16 | 179.8° | 180.0° |
| S1 | C18 | C17 | H8 | 0.2° | 0.5° |
| C18 | S1 | C21 | H10 | 58.3° | 60.0° |
| C18 | S1 | C21 | H11 | 178.2° | 60.0° |
| C18 | S1 | C21 | H12 | 61.8° | 180.0° |
| S1 | C18 | C19 | H18 | 0.1° | 0.4° |
| C18 | C19 | C20 | H18 | 180.0° | 179.8° |
| C18 | C19 | C20 | C15 | 0.1° | 0.0° |
| C19 | C18 | C17 | C16 | 0.1° | 0.5° |
| C19 | C18 | C17 | H8 | 179.9° | 179.9° |
| C18 | C19 | C20 | H9 | 179.9° | 179.9° |
| C20 | C19 | C18 | C17 | 0.0° | 0.2° |
| C19 | C20 | C15 | H9 | 180.0° | 179.9° |
| C19 | C20 | C15 | C16 | 0.2° | 0.0° |
| C19 | C20 | C15 | N5 | 179.8° | 179.7° |
| C18 | C17 | C16 | H8 | 180.0° | 179.5° |
| C18 | C17 | C16 | C15 | 0.0° | 0.5° |
| C18 | C17 | C16 | F1 | 179.9° | 179.4° |
| C17 | C18 | C19 | H18 | 180.0° | 180.0° |
| C20 | C15 | C16 | C17 | 0.1° | 0.2° |
| C20 | C15 | C16 | N5 | 179.6° | 179.7° |
| C20 | C15 | C16 | F1 | 180.0° | 179.7° |
| C20 | C15 | N5 | N4 | 42.4° | 179.8° |
| C20 | C15 | N5 | C12 | 137.1° | 0.4° |
| C15 | C20 | C19 | H18 | 179.9° | 179.8° |
| C17 | C16 | C15 | F1 | 179.9° | 179.9° |
| C17 | C16 | C15 | N5 | 179.8° | 179.9° |
| C16 | C15 | N5 | N4 | 138.0° | 0.0° |
| C16 | C15 | N5 | C12 | 42.5° | 179.9° |
| C15 | C16 | C17 | H8 | 180.0° | 179.9° |
| C16 | C15 | C20 | H9 | 179.8° | 179.9° |
| N5 | C15 | C16 | F1 | 0.3° | 0.0° |
| C15 | N5 | N4 | C12 | 179.6° | 179.9° |
| C15 | N5 | N4 | C14 | 179.8° | 179.9° |
| C15 | N5 | C12 | N3 | 0.4° | 0.1° |
| C15 | N5 | C12 | C13 | 179.7° | 179.9° |
| N5 | C15 | C20 | H9 | 0.2° | 0.4° |
| F1 | C16 | C17 | H8 | 0.2° | 0.0° |
| N5 | N4 | C14 | C13 | 0.1° | 0.0° |
| N4 | N5 | C12 | N3 | 180.0° | 180.0° |
| N4 | N5 | C12 | C13 | 0.1° | 0.0° |
| N5 | N4 | C14 | H17 | 179.9° | 179.9° |
| C14 | N4 | N5 | C12 | 0.2° | 0.0° |
| N4 | C14 | C13 | H17 | 180.0° | 179.9° |
| N4 | C14 | C13 | C12 | 0.1° | 0.0° |
| N4 | C14 | C13 | C10 | 179.9° | 179.9° |
| N5 | C12 | C13 | C14 | 0.0° | 0.0° |
| N5 | C12 | N3 | C13 | 179.8° | 179.9° |
| N5 | C12 | N3 | C11 | 179.9° | 179.9° |
| N5 | C12 | C13 | C10 | 179.9° | 179.9° |
| C14 | C13 | C12 | N3 | 179.9° | 180.0° |
| C14 | C13 | C12 | C10 | 180.0° | 179.9° |
| C14 | C13 | C10 | N2 | 179.9° | 180.0° |
| C14 | C13 | C10 | O3 | 0.1° | 0.1° |
| N3 | C12 | C13 | C10 | 0.1° | 0.1° |
| C12 | N3 | C11 | N2 | 0.1° | 0.1° |
| C12 | N3 | C11 | H16 | 179.9° | 180.0° |
| C13 | C12 | N3 | C11 | 0.1° | 0.1° |
| C12 | C13 | C10 | N2 | 0.1° | 0.1° |
| C12 | C13 | C10 | O3 | 179.9° | 180.0° |
| C12 | C13 | C14 | H17 | 180.0° | 179.9° |
| N3 | C11 | N2 | H16 | 180.0° | 179.9° |
| N3 | C11 | N2 | C10 | 0.2° | 0.1° |
| C13 | C10 | N2 | C11 | 0.1° | 0.1° |
| C13 | C10 | N2 | O3 | 180.0° | 179.9° |
| C13 | C10 | O3 | C7 | 157.1° | 180.0° |
| C10 | C13 | C14 | H17 | 0.0° | 0.0° |
| C11 | N2 | C10 | O3 | 179.9° | 180.0° |
| N2 | C10 | O3 | C7 | 22.9° | 0.1° |
| C10 | N2 | C11 | H16 | 179.9° | 180.0° |
| C10 | O3 | C7 | C8 | 139.4° | 150.0° |
| C10 | O3 | C7 | C6 | 99.4° | 89.8° |
| C10 | O3 | C7 | H5 | 19.3° | 30.1° |
| O3 | C7 | C8 | C6 | 123.6° | 120.2° |
| O3 | C7 | C8 | H5 | 120.8° | 119.9° |
| O3 | C7 | C6 | H5 | 119.2° | 119.9° |
| O3 | C7 | C8 | C9 | 176.3° | 178.6° |
| O3 | C7 | C6 | C5 | 178.7° | 178.5° |
| O3 | C7 | C6 | H3 | 58.3° | 58.5° |
| O3 | C7 | C6 | H4 | 60.9° | 61.6° |
| O3 | C7 | C8 | H6 | 62.9° | 58.5° |
| O3 | C7 | C8 | H7 | 55.6° | 61.6° |
| C8 | C7 | C6 | H5 | 115.5° | 119.9° |
| C7 | C8 | C9 | H6 | 120.7° | 120.0° |
| C7 | C8 | C9 | H7 | 120.8° | 119.9° |
| C8 | C7 | C6 | C5 | 53.4° | 61.4° |
| C7 | C8 | C9 | N1 | 52.0° | 54.4° |
| C8 | C7 | C6 | H3 | 67.0° | 178.7° |
| C8 | C7 | C6 | H4 | 173.8° | 58.6° |
| C7 | C8 | H6 | H7 | 117.7° | 120.1° |
| C7 | C8 | C9 | H23 | 68.5° | 174.4° |
| C7 | C8 | C9 | H24 | 172.5° | 65.2° |
| C6 | C7 | C8 | C9 | 52.8° | 61.2° |
| C7 | C6 | C5 | H3 | 120.4° | 120.0° |
| C7 | C6 | C5 | H4 | 120.4° | 119.9° |
| C7 | C6 | C5 | N1 | 55.3° | 54.6° |
| C7 | C6 | C5 | H1 | 176.1° | 65.2° |
| C7 | C6 | C5 | H2 | 65.4° | 174.4° |
| C7 | C6 | H3 | H4 | 118.8° | 120.1° |
| C6 | C7 | C8 | H6 | 173.5° | 178.7° |
| C6 | C7 | C8 | H7 | 68.0° | 58.6° |
| C8 | C9 | N1 | H23 | 120.5° | 119.9° |
| C8 | C9 | N1 | H24 | 120.5° | 119.8° |
| C8 | C9 | N1 | C5 | 48.9° | 53.3° |
| C8 | C9 | N1 | C4 | 131.0° | 126.4° |
| C9 | C8 | C7 | H5 | 62.9° | 58.7° |
| C9 | C8 | H6 | H7 | 117.6° | 120.0° |
| C8 | C9 | H23 | H24 | 118.5° | 120.3° |
| C6 | C5 | N1 | C9 | 51.8° | 53.4° |
| C6 | C5 | N1 | H1 | 120.7° | 119.8° |
| C6 | C5 | N1 | H2 | 120.7° | 119.9° |
| C6 | C5 | N1 | C4 | 128.2° | 126.4° |
| C6 | C5 | H1 | H2 | 117.8° | 120.4° |
| C5 | C6 | H3 | H4 | 118.7° | 120.1° |
| C5 | C6 | C7 | H5 | 62.0° | 58.6° |
| C9 | N1 | C5 | C4 | 179.9° | 179.8° |
| C9 | N1 | C4 | O2 | 2.3° | 179.7° |
| C9 | N1 | C4 | O1 | 177.5° | 0.3° |
| C9 | N1 | C5 | H1 | 172.5° | 66.4° |
| C9 | N1 | C5 | H2 | 68.9° | 173.3° |
| N1 | C9 | C8 | H6 | 172.7° | 174.4° |
| N1 | C9 | C8 | H7 | 68.8° | 65.5° |
| N1 | C9 | H23 | H24 | 118.5° | 120.1° |
| C5 | N1 | C4 | O2 | 177.7° | 0.0° |
| C5 | N1 | C4 | O1 | 2.4° | 180.0° |
| N1 | C5 | H1 | H2 | 117.8° | 120.3° |
| N1 | C5 | C6 | H3 | 65.1° | 174.6° |
| N1 | C5 | C6 | H4 | 175.8° | 65.3° |
| C5 | N1 | C9 | H23 | 71.5° | 173.3° |
| C5 | N1 | C9 | H24 | 169.4° | 66.4° |
| N1 | C4 | O2 | O1 | 179.9° | 180.0° |
| N1 | C4 | O1 | C2 | 137.6° | 180.0° |
| C4 | N1 | C5 | H1 | 7.5° | 113.8° |
| C4 | N1 | C5 | H2 | 111.1° | 6.5° |
| C4 | N1 | C9 | H23 | 108.5° | 6.5° |
| C4 | N1 | C9 | H24 | 10.5° | 113.8° |
| O2 | C4 | O1 | C2 | 42.3° | 0.0° |
| C4 | O1 | C2 | C3 | 83.7° | 150.0° |
| C4 | O1 | C2 | C1 | 158.2° | 90.0° |
| C4 | O1 | C2 | H19 | 36.8° | 29.9° |
| C3 | C2 | O1 | C1 | 118.1° | 119.9° |
| C3 | C2 | O1 | H19 | 120.5° | 120.1° |
| C3 | C2 | C1 | H19 | 121.3° | 120.0° |
| C3 | C2 | C1 | H13 | 180.0° | 60.0° |
| C3 | C2 | C1 | H14 | 60.0° | 180.0° |
| C3 | C2 | C1 | H15 | 60.0° | 60.0° |
| C2 | C3 | H20 | H21 | 120.0° | 119.9° |
| C2 | C3 | H20 | H22 | 120.0° | 120.0° |
| C2 | C3 | H21 | H22 | 120.0° | 120.0° |
| O1 | C2 | C1 | H19 | 122.2° | 120.0° |
| O1 | C2 | C1 | H13 | 63.5° | 180.0° |
| O1 | C2 | C1 | H14 | 176.5° | 60.0° |
| O1 | C2 | C1 | H15 | 56.5° | 60.0° |
| O1 | C2 | C3 | H20 | 180.0° | 60.0° |
| O1 | C2 | C3 | H21 | 60.0° | 60.0° |
| O1 | C2 | C3 | H22 | 60.0° | 180.0° |
| C2 | C1 | H13 | H14 | 120.0° | 120.0° |
| C2 | C1 | H13 | H15 | 120.0° | 120.0° |
| C2 | C1 | H14 | H15 | 120.0° | 120.1° |
| C1 | C2 | C3 | H20 | 62.3° | 60.0° |
| C1 | C2 | C3 | H21 | 177.7° | 180.0° |
| C1 | C2 | C3 | H22 | 57.7° | 60.0° |
| H1 | C5 | C6 | H3 | 55.6° | 54.8° |
| H1 | C5 | C6 | H4 | 63.5° | 174.9° |
| H2 | C5 | C6 | H3 | 174.2° | 65.6° |
| H2 | C5 | C6 | H4 | 55.0° | 54.5° |
| H3 | C6 | C7 | H5 | 177.5° | 61.4° |
| H4 | C6 | C7 | H5 | 58.4° | 178.5° |
| H5 | C7 | C8 | H6 | 57.9° | 61.4° |
| H5 | C7 | C8 | H7 | 176.4° | 178.5° |
| H6 | C8 | C9 | H23 | 52.2° | 65.5° |
| H6 | C8 | C9 | H24 | 66.8° | 54.8° |
| H7 | C8 | C9 | H23 | 170.7° | 54.6° |
| H7 | C8 | C9 | H24 | 51.7° | 174.9° |
| H9 | C20 | C19 | H18 | 0.1° | 0.3° |
| H10 | C21 | H11 | H12 | 120.0° | 120.0° |
| H13 | C1 | H14 | H15 | 120.0° | 120.0° |
| H13 | C1 | C2 | H19 | 58.7° | 60.0° |
| H14 | C1 | C2 | H19 | 61.3° | 59.9° |
| H15 | C1 | C2 | H19 | 178.7° | 180.0° |
| H19 | C2 | C3 | H20 | 58.8° | 180.0° |
| H19 | C2 | C3 | H21 | 61.2° | 60.0° |
| H19 | C2 | C3 | H22 | 178.8° | 60.0° |
| H20 | C3 | H21 | H22 | 120.0° | 120.0° |
