WRL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL1 | C1 | sing | 1.74Å | 1.74Å | |
| C1 | C22 | doub | 1.38Å | 1.38Å | Aromatic |
| C1 | C2 | sing | 1.38Å | 1.38Å | Aromatic |
| C22 | C21 | sing | 1.38Å | 1.38Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.38Å | Aromatic |
| C21 | CL2 | sing | 1.74Å | 1.74Å | |
| C21 | C20 | doub | 1.38Å | 1.38Å | Aromatic |
| O4 | S1 | doub | 1.42Å | 1.43Å | |
| C3 | C20 | sing | 1.38Å | 1.38Å | Aromatic |
| C3 | S1 | sing | 1.76Å | 1.77Å | |
| S1 | O1 | doub | 1.42Å | 1.43Å | |
| S1 | N1 | sing | 1.66Å | 1.61Å | |
| C17 | C16 | doub | 1.39Å | 1.37Å | Aromatic |
| C17 | C18 | sing | 1.39Å | 1.38Å | Aromatic |
| C16 | C15 | sing | 1.38Å | 1.37Å | Aromatic |
| C18 | C14 | doub | 1.38Å | 1.37Å | Aromatic |
| N1 | C4 | sing | 1.46Å | 1.46Å | |
| N1 | C8 | sing | 1.46Å | 1.48Å | |
| C4 | C19 | sing | 1.51Å | 1.52Å | |
| C4 | C5 | sing | 1.53Å | 1.53Å | |
| C15 | N3 | doub | 1.32Å | 1.35Å | Aromatic |
| C14 | N3 | sing | 1.32Å | 1.34Å | Aromatic |
| C14 | C12 | sing | 1.51Å | 1.51Å | |
| C19 | O3 | doub | 1.22Å | 1.23Å | |
| C19 | N2 | sing | 1.34Å | 1.36Å | |
| C11 | N2 | sing | 1.46Å | 1.47Å | |
| C11 | C9 | sing | 1.52Å | 1.53Å | |
| N2 | C12 | sing | 1.48Å | 1.49Å | |
| C8 | C9 | sing | 1.52Å | 1.54Å | |
| C8 | C7 | sing | 1.52Å | 1.52Å | |
| C5 | C6 | sing | 1.52Å | 1.53Å | |
| C12 | C13 | sing | 1.53Å | 1.52Å | |
| C9 | C10 | sing | 1.53Å | 1.52Å | |
| C7 | C6 | sing | 1.52Å | 1.52Å | |
| C10 | O2 | sing | 1.43Å | 1.42Å | |
| C4 | H2 | sing | 1.10Å | 1.10Å | |
| C5 | H3 | sing | 1.08Å | 1.10Å | |
| C5 | H4 | sing | 1.10Å | 1.10Å | |
| C6 | H5 | sing | 1.09Å | 1.10Å | |
| C6 | H6 | sing | 1.09Å | 1.10Å | |
| C7 | H7 | sing | 1.09Å | 1.10Å | |
| C7 | H8 | sing | 1.09Å | 1.10Å | |
| C8 | H9 | sing | 1.10Å | 1.10Å | |
| C10 | H12 | sing | 1.09Å | 1.10Å | |
| C10 | H11 | sing | 1.09Å | 1.10Å | |
| C13 | H18 | sing | 1.09Å | 1.10Å | |
| C13 | H17 | sing | 1.09Å | 1.10Å | |
| C13 | H19 | sing | 1.09Å | 1.10Å | |
| C15 | H20 | sing | 1.08Å | 1.08Å | |
| C17 | H22 | sing | 1.08Å | 1.08Å | |
| C20 | H24 | sing | 1.08Å | 1.08Å | |
| C22 | H25 | sing | 1.08Å | 1.08Å | |
| C11 | H15 | sing | 1.09Å | 1.10Å | |
| C11 | H14 | sing | 1.10Å | 1.10Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.08Å | 1.08Å | |
| C18 | H23 | sing | 1.08Å | 1.08Å | |
| C2 | H1 | sing | 1.08Å | 1.08Å | |
| C9 | H10 | sing | 1.10Å | 1.10Å | |
| O2 | H13 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL1 | C1 | C22 | 119.0° | 120.0° |
| CL1 | C1 | C2 | 119.0° | 120.0° |
| C22 | C1 | C2 | 122.0° | 120.0° |
| C1 | C22 | C21 | 117.2° | 119.9° |
| C1 | C22 | H25 | 121.4° | 120.0° |
| C1 | C2 | C3 | 119.4° | 120.0° |
| C1 | C2 | H1 | 120.3° | 120.0° |
| C22 | C21 | CL2 | 118.5° | 120.0° |
| C22 | C21 | C20 | 122.6° | 120.0° |
| C21 | C22 | H25 | 121.4° | 120.0° |
| C2 | C3 | C20 | 120.0° | 120.0° |
| C2 | C3 | S1 | 120.0° | 120.0° |
| C3 | C2 | H1 | 120.3° | 120.0° |
| CL2 | C21 | C20 | 118.9° | 120.0° |
| C21 | C20 | C3 | 118.7° | 120.0° |
| C21 | C20 | H24 | 120.6° | 120.0° |
| O4 | S1 | C3 | 108.4° | 106.4° |
| O4 | S1 | O1 | 120.1° | 123.2° |
| O4 | S1 | N1 | 107.0° | 106.4° |
| C20 | C3 | S1 | 120.0° | 120.0° |
| C3 | C20 | H24 | 120.6° | 120.0° |
| C3 | S1 | O1 | 105.4° | 106.4° |
| C3 | S1 | N1 | 108.5° | 107.2° |
| O1 | S1 | N1 | 107.1° | 106.4° |
| S1 | N1 | C4 | 123.5° | 120.1° |
| S1 | N1 | C8 | 117.4° | 120.2° |
| C16 | C17 | C18 | 118.9° | 118.4° |
| C17 | C16 | C15 | 118.2° | 119.2° |
| C16 | C17 | H22 | 120.6° | 120.8° |
| C17 | C16 | H21 | 120.9° | 120.4° |
| C17 | C18 | C14 | 120.1° | 119.2° |
| C18 | C17 | H22 | 120.5° | 120.8° |
| C17 | C18 | H23 | 119.9° | 120.4° |
| C16 | C15 | N3 | 123.7° | 120.7° |
| C16 | C15 | H20 | 118.2° | 119.6° |
| C15 | C16 | H21 | 120.9° | 120.4° |
| C18 | C14 | N3 | 121.5° | 120.7° |
| C18 | C14 | C12 | 120.6° | 119.6° |
| C14 | C18 | H23 | 120.0° | 120.4° |
| C4 | N1 | C8 | 118.4° | 119.7° |
| N1 | C4 | C19 | 121.1° | 109.0° |
| N1 | C4 | C5 | 104.4° | 109.8° |
| N1 | C4 | H2 | 107.9° | 109.6° |
| N1 | C8 | C9 | 114.3° | 112.6° |
| N1 | C8 | C7 | 106.4° | 110.6° |
| N1 | C8 | H9 | 107.7° | 106.6° |
| C19 | C4 | C5 | 108.4° | 108.6° |
| C4 | C19 | O3 | 117.5° | 119.1° |
| C4 | C19 | N2 | 120.8° | 122.1° |
| C19 | C4 | H2 | 107.2° | 109.9° |
| C4 | C5 | C6 | 112.2° | 111.7° |
| C5 | C4 | H2 | 107.1° | 109.8° |
| C4 | C5 | H3 | 108.8° | 110.8° |
| C4 | C5 | H4 | 108.8° | 108.1° |
| C15 | N3 | C14 | 117.6° | 121.8° |
| N3 | C15 | H20 | 118.2° | 119.7° |
| N3 | C14 | C12 | 117.9° | 119.7° |
| C14 | C12 | N2 | 111.0° | 109.5° |
| C14 | C12 | C13 | 112.1° | 109.5° |
| C14 | C12 | H16 | 107.1° | 109.5° |
| O3 | C19 | N2 | 121.6° | 118.8° |
| C19 | N2 | C11 | 126.7° | 124.3° |
| C19 | N2 | C12 | 117.1° | 117.4° |
| N2 | C11 | C9 | 112.2° | 112.3° |
| C11 | N2 | C12 | 116.2° | 118.2° |
| N2 | C11 | H15 | 108.8° | 111.1° |
| N2 | C11 | H14 | 108.8° | 108.2° |
| C11 | C9 | C8 | 112.0° | 111.9° |
| C11 | C9 | C10 | 111.6° | 110.5° |
| C9 | C11 | H15 | 108.8° | 110.0° |
| C9 | C11 | H14 | 108.8° | 108.2° |
| C11 | C9 | H10 | 107.9° | 108.4° |
| N2 | C12 | C13 | 111.9° | 109.5° |
| N2 | C12 | H16 | 107.4° | 109.4° |
| C9 | C8 | C7 | 113.9° | 113.0° |
| C8 | C9 | C10 | 109.3° | 109.8° |
| C9 | C8 | H9 | 107.0° | 106.9° |
| C8 | C9 | H10 | 107.9° | 108.3° |
| C8 | C7 | C6 | 111.2° | 112.2° |
| C8 | C7 | H7 | 109.0° | 109.1° |
| C8 | C7 | H8 | 109.1° | 108.9° |
| C7 | C8 | H9 | 107.1° | 106.7° |
| C5 | C6 | C7 | 110.1° | 113.4° |
| C6 | C5 | H3 | 108.8° | 110.8° |
| C6 | C5 | H4 | 108.8° | 108.1° |
| C5 | C6 | H5 | 109.3° | 108.8° |
| C5 | C6 | H6 | 109.3° | 109.0° |
| C12 | C13 | H18 | 109.5° | 109.5° |
| C12 | C13 | H17 | 109.4° | 109.5° |
| C12 | C13 | H19 | 109.5° | 109.4° |
| C13 | C12 | H16 | 107.0° | 109.4° |
| C9 | C10 | O2 | 108.7° | 109.5° |
| C9 | C10 | H12 | 109.6° | 109.4° |
| C9 | C10 | H11 | 109.6° | 109.5° |
| C10 | C9 | H10 | 108.1° | 107.9° |
| C7 | C6 | H5 | 109.3° | 108.7° |
| C7 | C6 | H6 | 109.3° | 108.8° |
| C6 | C7 | H7 | 109.1° | 109.1° |
| C6 | C7 | H8 | 109.0° | 109.0° |
| O2 | C10 | H12 | 109.6° | 109.5° |
| O2 | C10 | H11 | 109.7° | 109.4° |
| C10 | O2 | H13 | 109.5° | 114.0° |
| H3 | C5 | H4 | 109.5° | 107.2° |
| H5 | C6 | H6 | 109.5° | 108.0° |
| H7 | C7 | H8 | 109.4° | 108.4° |
| H12 | C10 | H11 | 109.5° | 109.5° |
| H18 | C13 | H17 | 109.5° | 109.5° |
| H18 | C13 | H19 | 109.5° | 109.5° |
| H17 | C13 | H19 | 109.5° | 109.4° |
| H15 | C11 | H14 | 109.4° | 106.8° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL1 | C1 | C22 | C2 | 179.2° | 179.9° |
| CL1 | C1 | C22 | C21 | 179.9° | 180.0° |
| CL1 | C1 | C2 | C3 | 179.5° | 179.7° |
| CL1 | C1 | C22 | H25 | 0.1° | 0.0° |
| CL1 | C1 | C2 | H1 | 0.5° | 0.1° |
| C1 | C22 | C21 | H25 | 180.0° | 180.0° |
| C22 | C1 | C2 | C3 | 1.4° | 0.3° |
| C1 | C22 | C21 | CL2 | 179.5° | 180.0° |
| C1 | C22 | C21 | C20 | 0.6° | 0.0° |
| C22 | C1 | C2 | H1 | 178.7° | 180.0° |
| C2 | C1 | C22 | C21 | 0.7° | 0.0° |
| C1 | C2 | C3 | H1 | 180.0° | 179.7° |
| C1 | C2 | C3 | C20 | 1.8° | 0.6° |
| C1 | C2 | C3 | S1 | 179.8° | 180.0° |
| C2 | C1 | C22 | H25 | 179.3° | 180.0° |
| C22 | C21 | CL2 | C20 | 178.9° | 180.0° |
| C22 | C21 | C20 | C3 | 1.1° | 0.3° |
| C22 | C21 | C20 | H24 | 178.8° | 180.0° |
| C2 | C3 | C20 | C21 | 1.7° | 0.6° |
| C2 | C3 | S1 | O4 | 35.4° | 156.4° |
| C2 | C3 | C20 | S1 | 177.9° | 179.4° |
| C2 | C3 | S1 | O1 | 165.2° | 23.5° |
| C2 | C3 | S1 | N1 | 80.4° | 90.0° |
| C2 | C3 | C20 | H24 | 178.2° | 179.7° |
| CL2 | C21 | C20 | C3 | 180.0° | 179.7° |
| CL2 | C21 | C20 | H24 | 0.0° | 0.0° |
| CL2 | C21 | C22 | H25 | 0.5° | 0.0° |
| C21 | C20 | C3 | H24 | 180.0° | 179.7° |
| C21 | C20 | C3 | S1 | 179.7° | 180.0° |
| C20 | C21 | C22 | H25 | 179.4° | 180.0° |
| O4 | S1 | C3 | C20 | 142.5° | 23.0° |
| O4 | S1 | C3 | O1 | 129.8° | 132.9° |
| O4 | S1 | C3 | N1 | 115.8° | 113.6° |
| O4 | S1 | O1 | N1 | 122.1° | 123.0° |
| O4 | S1 | N1 | C4 | 2.1° | 23.5° |
| O4 | S1 | N1 | C8 | 172.0° | 156.2° |
| C20 | C3 | S1 | O1 | 12.8° | 155.9° |
| C20 | C3 | S1 | N1 | 101.7° | 90.6° |
| C20 | C3 | C2 | H1 | 178.2° | 179.7° |
| C3 | S1 | O1 | N1 | 115.4° | 114.0° |
| C3 | S1 | N1 | C4 | 118.8° | 90.0° |
| C3 | S1 | N1 | C8 | 71.3° | 90.3° |
| S1 | C3 | C20 | H24 | 0.3° | 0.3° |
| S1 | C3 | C2 | H1 | 0.2° | 0.3° |
| O1 | S1 | N1 | C4 | 127.8° | 156.5° |
| O1 | S1 | N1 | C8 | 42.0° | 23.2° |
| S1 | N1 | C4 | C8 | 169.8° | 179.7° |
| S1 | N1 | C4 | C19 | 129.0° | 99.7° |
| S1 | N1 | C4 | C5 | 108.6° | 141.4° |
| S1 | N1 | C8 | C9 | 124.4° | 111.4° |
| S1 | N1 | C8 | C7 | 109.0° | 121.1° |
| S1 | N1 | C4 | H2 | 5.1° | 20.6° |
| S1 | N1 | C8 | H9 | 5.6° | 5.5° |
| C16 | C17 | C18 | H22 | 180.0° | 179.9° |
| C17 | C16 | C15 | H21 | 180.0° | 180.0° |
| C16 | C17 | C18 | C14 | 0.6° | 0.0° |
| C17 | C16 | C15 | N3 | 0.5° | 0.0° |
| C17 | C16 | C15 | H20 | 179.5° | 180.0° |
| C16 | C17 | C18 | H23 | 179.3° | 179.9° |
| C18 | C17 | C16 | C15 | 0.3° | 0.0° |
| C17 | C18 | C14 | H23 | 180.0° | 179.9° |
| C17 | C18 | C14 | N3 | 0.2° | 0.0° |
| C17 | C18 | C14 | C12 | 179.8° | 179.9° |
| C18 | C17 | C16 | H21 | 179.7° | 180.0° |
| C16 | C15 | N3 | H20 | 180.0° | 180.0° |
| C16 | C15 | N3 | C14 | 0.9° | 0.0° |
| C15 | C16 | C17 | H22 | 179.7° | 180.0° |
| C18 | C14 | N3 | C15 | 0.5° | 0.1° |
| C18 | C14 | N3 | C12 | 180.0° | 180.0° |
| C18 | C14 | C12 | N2 | 48.3° | 155.0° |
| C18 | C14 | C12 | C13 | 174.3° | 85.0° |
| C14 | C18 | C17 | H22 | 179.3° | 179.9° |
| C18 | C14 | C12 | H16 | 68.6° | 35.0° |
| N1 | C4 | C19 | C5 | 120.5° | 119.7° |
| N1 | C4 | C19 | H2 | 124.3° | 120.2° |
| N1 | C4 | C5 | H2 | 114.3° | 120.6° |
| N1 | C4 | C19 | O3 | 179.3° | 117.8° |
| N1 | C4 | C19 | N2 | 2.3° | 62.1° |
| C4 | N1 | C8 | C9 | 65.2° | 68.9° |
| C4 | N1 | C8 | C7 | 61.4° | 58.6° |
| N1 | C4 | C5 | C6 | 55.8° | 20.2° |
| N1 | C4 | C5 | H3 | 176.2° | 103.8° |
| N1 | C4 | C5 | H4 | 64.6° | 139.0° |
| C4 | N1 | C8 | H9 | 176.0° | 174.2° |
| C8 | N1 | C4 | C19 | 61.2° | 80.6° |
| C8 | N1 | C4 | C5 | 61.1° | 38.3° |
| N1 | C8 | C9 | C11 | 12.9° | 64.5° |
| N1 | C8 | C9 | C7 | 122.6° | 126.2° |
| N1 | C8 | C9 | H9 | 119.2° | 116.7° |
| N1 | C8 | C7 | H9 | 115.0° | 115.5° |
| N1 | C8 | C9 | C10 | 137.0° | 58.5° |
| N1 | C8 | C7 | C6 | 54.6° | 15.9° |
| C8 | N1 | C4 | H2 | 174.8° | 159.1° |
| N1 | C8 | C7 | H7 | 65.7° | 136.9° |
| N1 | C8 | C7 | H8 | 174.9° | 104.9° |
| N1 | C8 | C9 | H10 | 105.7° | 176.2° |
| C19 | C4 | C5 | H2 | 115.4° | 120.2° |
| C4 | C19 | O3 | N2 | 178.4° | 179.9° |
| C4 | C19 | N2 | C11 | 4.9° | 2.1° |
| C4 | C19 | N2 | C12 | 176.0° | 176.9° |
| C19 | C4 | C5 | C6 | 74.6° | 139.3° |
| C19 | C4 | C5 | H3 | 45.8° | 15.4° |
| C19 | C4 | C5 | H4 | 165.0° | 101.8° |
| C5 | C4 | C19 | O3 | 58.8° | 122.5° |
| C5 | C4 | C19 | N2 | 122.8° | 57.5° |
| C4 | C5 | C6 | H3 | 120.4° | 124.0° |
| C4 | C5 | C6 | H4 | 120.4° | 118.8° |
| C4 | C5 | C6 | C7 | 57.0° | 58.8° |
| C4 | C5 | H3 | H4 | 118.7° | 117.7° |
| C4 | C5 | C6 | H5 | 63.1° | 179.9° |
| C4 | C5 | C6 | H6 | 177.2° | 62.6° |
| C15 | N3 | C14 | C12 | 179.4° | 179.9° |
| N3 | C15 | C16 | H21 | 179.5° | 180.0° |
| N3 | C14 | C12 | N2 | 131.7° | 25.0° |
| N3 | C14 | C12 | C13 | 5.7° | 95.0° |
| C14 | N3 | C15 | H20 | 179.1° | 180.0° |
| N3 | C14 | C12 | H16 | 111.4° | 145.0° |
| N3 | C14 | C18 | H23 | 179.8° | 180.0° |
| C14 | C12 | N2 | C19 | 129.4° | 59.1° |
| C14 | C12 | N2 | C11 | 51.4° | 120.0° |
| C14 | C12 | N2 | C13 | 126.1° | 120.0° |
| C14 | C12 | N2 | H16 | 116.7° | 120.0° |
| C14 | C12 | C13 | H16 | 117.1° | 120.0° |
| C14 | C12 | C13 | H18 | 180.0° | 60.0° |
| C14 | C12 | C13 | H17 | 60.0° | 180.0° |
| C14 | C12 | C13 | H19 | 60.0° | 60.0° |
| C12 | C14 | C18 | H23 | 0.2° | 0.0° |
| O3 | C19 | N2 | C11 | 176.8° | 177.8° |
| O3 | C19 | N2 | C12 | 2.3° | 3.2° |
| O3 | C19 | C4 | H2 | 56.5° | 2.4° |
| C19 | N2 | C11 | C12 | 179.1° | 179.0° |
| C19 | N2 | C11 | C9 | 57.5° | 63.5° |
| C19 | N2 | C12 | C13 | 104.5° | 60.9° |
| N2 | C19 | C4 | H2 | 122.0° | 177.7° |
| C19 | N2 | C11 | H15 | 62.9° | 60.2° |
| C19 | N2 | C11 | H14 | 178.0° | 177.2° |
| C19 | N2 | C12 | H16 | 12.7° | 179.1° |
| N2 | C11 | C9 | H15 | 120.4° | 124.4° |
| N2 | C11 | C9 | H14 | 120.4° | 119.3° |
| N2 | C11 | C9 | C8 | 79.6° | 79.7° |
| C11 | N2 | C12 | C13 | 74.7° | 120.0° |
| N2 | C11 | C9 | C10 | 157.5° | 43.0° |
| N2 | C11 | H15 | H14 | 118.7° | 117.8° |
| C11 | N2 | C12 | H16 | 168.1° | 0.0° |
| N2 | C11 | C9 | H10 | 39.0° | 161.0° |
| C9 | C11 | N2 | C12 | 121.6° | 117.5° |
| C11 | C9 | C8 | C10 | 124.2° | 123.0° |
| C11 | C9 | C8 | H10 | 118.5° | 119.3° |
| C11 | C9 | C8 | C7 | 135.5° | 61.7° |
| C11 | C9 | C10 | H10 | 118.4° | 118.3° |
| C11 | C9 | C10 | O2 | 70.4° | 61.1° |
| C11 | C9 | C8 | H9 | 106.3° | 178.8° |
| C11 | C9 | C10 | H12 | 169.7° | 178.9° |
| C11 | C9 | C10 | H11 | 49.5° | 58.9° |
| C9 | C11 | H15 | H14 | 118.7° | 117.2° |
| N2 | C12 | C13 | H16 | 117.3° | 119.9° |
| N2 | C12 | C13 | H18 | 54.5° | 180.0° |
| N2 | C12 | C13 | H17 | 65.5° | 59.9° |
| N2 | C12 | C13 | H19 | 174.5° | 60.0° |
| C12 | N2 | C11 | H15 | 118.0° | 118.8° |
| C12 | N2 | C11 | H14 | 1.1° | 1.8° |
| C9 | C8 | C7 | H9 | 118.1° | 117.2° |
| C8 | C9 | C10 | H10 | 117.2° | 117.8° |
| C9 | C8 | C7 | C6 | 72.3° | 111.5° |
| C8 | C9 | C10 | O2 | 165.2° | 175.0° |
| C9 | C8 | C7 | H7 | 167.4° | 9.6° |
| C9 | C8 | C7 | H8 | 48.0° | 127.8° |
| C8 | C9 | C10 | H12 | 45.4° | 55.0° |
| C8 | C9 | C10 | H11 | 74.9° | 65.0° |
| C8 | C9 | C11 | H15 | 40.9° | 44.6° |
| C8 | C9 | C11 | H14 | 160.0° | 161.0° |
| C8 | C7 | C6 | C5 | 55.7° | 38.6° |
| C7 | C8 | C9 | C10 | 100.4° | 175.2° |
| C8 | C7 | C6 | H7 | 120.3° | 121.1° |
| C8 | C7 | C6 | H8 | 120.3° | 120.7° |
| C8 | C7 | C6 | H5 | 64.4° | 159.8° |
| C8 | C7 | C6 | H6 | 175.8° | 82.9° |
| C8 | C7 | H7 | H8 | 119.2° | 118.5° |
| C7 | C8 | C9 | H10 | 16.9° | 57.6° |
| C5 | C6 | C7 | H5 | 120.1° | 121.2° |
| C5 | C6 | C7 | H6 | 120.1° | 121.5° |
| C6 | C5 | C4 | H2 | 170.1° | 100.5° |
| C6 | C5 | H3 | H4 | 118.8° | 117.8° |
| C5 | C6 | H5 | H6 | 119.7° | 118.1° |
| C5 | C6 | C7 | H7 | 64.6° | 82.5° |
| C5 | C6 | C7 | H8 | 176.0° | 159.3° |
| C12 | C13 | H18 | H17 | 120.0° | 120.0° |
| C12 | C13 | H18 | H19 | 120.0° | 120.0° |
| C12 | C13 | H17 | H19 | 120.0° | 119.9° |
| C9 | C10 | O2 | H12 | 119.9° | 120.0° |
| C9 | C10 | O2 | H11 | 119.9° | 120.0° |
| C10 | C9 | C8 | H9 | 17.8° | 58.2° |
| C9 | C10 | H12 | H11 | 120.3° | 120.0° |
| C10 | C9 | C11 | H15 | 82.1° | 167.3° |
| C10 | C9 | C11 | H14 | 37.1° | 76.3° |
| C9 | C10 | O2 | H13 | 180.0° | 180.0° |
| C7 | C6 | C5 | H3 | 177.5° | 65.2° |
| C7 | C6 | C5 | H4 | 63.3° | 177.6° |
| C7 | C6 | H5 | H6 | 119.7° | 117.9° |
| C6 | C7 | H7 | H8 | 119.2° | 118.6° |
| C6 | C7 | C8 | H9 | 169.6° | 131.3° |
| O2 | C10 | H12 | H11 | 120.4° | 120.0° |
| O2 | C10 | C9 | H10 | 48.1° | 57.2° |
| H2 | C4 | C5 | H3 | 69.5° | 135.6° |
| H2 | C4 | C5 | H4 | 49.7° | 18.4° |
| H3 | C5 | C6 | H5 | 57.3° | 55.9° |
| H3 | C5 | C6 | H6 | 62.4° | 173.4° |
| H4 | C5 | C6 | H5 | 176.5° | 61.3° |
| H4 | C5 | C6 | H6 | 56.8° | 56.2° |
| H5 | C6 | C7 | H7 | 175.3° | 38.7° |
| H5 | C6 | C7 | H8 | 55.9° | 79.5° |
| H6 | C6 | C7 | H7 | 55.5° | 156.0° |
| H6 | C6 | C7 | H8 | 63.9° | 37.8° |
| H7 | C7 | C8 | H9 | 49.3° | 107.6° |
| H8 | C7 | C8 | H9 | 70.1° | 10.6° |
| H9 | C8 | C9 | H10 | 135.1° | 59.5° |
| H12 | C10 | C9 | H10 | 71.8° | 62.8° |
| H12 | C10 | O2 | H13 | 60.1° | 60.0° |
| H11 | C10 | C9 | H10 | 168.0° | 177.2° |
| H11 | C10 | O2 | H13 | 60.1° | 60.0° |
| H18 | C13 | H17 | H19 | 120.0° | 120.0° |
| H18 | C13 | C12 | H16 | 62.9° | 60.0° |
| H17 | C13 | C12 | H16 | 177.1° | 60.0° |
| H19 | C13 | C12 | H16 | 57.2° | 179.9° |
| H20 | C15 | C16 | H21 | 0.5° | 0.0° |
| H22 | C17 | C16 | H21 | 0.3° | 0.1° |
| H22 | C17 | C18 | H23 | 0.7° | 0.0° |
| H15 | C11 | C9 | H10 | 159.4° | 74.7° |
| H14 | C11 | C9 | H10 | 81.5° | 41.7° |
