X7R
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C04 | C03 | sing | 1.53Å | 1.52Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| C03 | N01 | sing | 1.47Å | 1.51Å | |
| C01 | C02 | sing | 1.53Å | 1.53Å | |
| F01 | C13 | sing | 1.35Å | 1.34Å | |
| C06 | C05 | sing | 1.53Å | 1.53Å | |
| C06 | O01 | sing | 1.43Å | 1.43Å | |
| C05 | C18 | sing | 1.53Å | 1.53Å | |
| C14 | C13 | doub | 1.38Å | 1.40Å | Aromatic |
| C14 | C07 | sing | 1.39Å | 1.39Å | Aromatic |
| C13 | C10 | sing | 1.40Å | 1.39Å | Aromatic |
| N01 | C02 | sing | 1.47Å | 1.53Å | |
| N01 | C19 | sing | 1.47Å | 1.52Å | |
| C02 | C20 | sing | 1.51Å | 1.53Å | |
| O02 | C11 | doub | 1.22Å | 1.22Å | |
| C07 | O01 | sing | 1.36Å | 1.37Å | |
| C07 | C08 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | C18 | sing | 1.53Å | 1.51Å | |
| C10 | C11 | sing | 1.47Å | 1.48Å | |
| C10 | C09 | doub | 1.40Å | 1.39Å | Aromatic |
| C11 | N02 | sing | 1.35Å | 1.40Å | |
| C20 | C25 | doub | 1.38Å | 1.40Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.40Å | Aromatic |
| O04 | S01 | doub | 1.42Å | 1.45Å | |
| C25 | C24 | sing | 1.38Å | 1.39Å | Aromatic |
| C08 | C09 | sing | 1.38Å | 1.41Å | Aromatic |
| C08 | C15 | sing | 1.51Å | 1.51Å | |
| C21 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| N02 | S01 | sing | 1.66Å | 1.65Å | |
| C12 | S01 | sing | 1.81Å | 1.79Å | |
| S01 | O03 | doub | 1.42Å | 1.44Å | |
| C24 | CL02 | sing | 1.74Å | 1.72Å | |
| C24 | C23 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | C16 | sing | 1.53Å | 1.51Å | |
| C15 | C17 | sing | 1.53Å | 1.50Å | |
| C22 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C22 | CL01 | sing | 1.74Å | 1.72Å | |
| C16 | C17 | sing | 1.53Å | 1.49Å | |
| C14 | H1 | sing | 1.08Å | 1.08Å | |
| C12 | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C12 | H4 | sing | 1.09Å | 1.10Å | |
| C01 | H5 | sing | 1.09Å | 1.10Å | |
| C01 | H6 | sing | 1.09Å | 1.10Å | |
| C01 | H7 | sing | 1.09Å | 1.10Å | |
| C02 | H8 | sing | 1.09Å | 1.10Å | |
| C03 | H9 | sing | 1.09Å | 1.10Å | |
| C03 | H10 | sing | 1.09Å | 1.10Å | |
| C04 | H11 | sing | 1.09Å | 1.10Å | |
| C04 | H12 | sing | 1.09Å | 1.10Å | |
| C05 | H13 | sing | 1.09Å | 1.10Å | |
| C06 | H14 | sing | 1.09Å | 1.10Å | |
| C06 | H15 | sing | 1.09Å | 1.10Å | |
| C09 | H16 | sing | 1.08Å | 1.08Å | |
| C15 | H17 | sing | 1.09Å | 1.10Å | |
| C16 | H18 | sing | 1.09Å | 1.10Å | |
| C16 | H19 | sing | 1.09Å | 1.10Å | |
| C17 | H20 | sing | 1.09Å | 1.10Å | |
| C17 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C18 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C21 | H26 | sing | 1.08Å | 1.08Å | |
| C23 | H27 | sing | 1.08Å | 1.08Å | |
| C25 | H28 | sing | 1.08Å | 1.08Å | |
| N02 | H30 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C03 | C04 | C05 | 113.2° | 109.3° |
| C04 | C03 | N01 | 110.3° | 109.5° |
| C04 | C03 | H9 | 109.3° | 109.5° |
| C04 | C03 | H10 | 109.3° | 109.5° |
| C03 | C04 | H11 | 108.5° | 109.5° |
| C03 | C04 | H12 | 108.5° | 109.4° |
| C04 | C05 | C06 | 109.1° | 109.5° |
| C04 | C05 | C18 | 110.3° | 109.1° |
| C05 | C04 | H11 | 108.5° | 109.5° |
| C05 | C04 | H12 | 108.5° | 109.5° |
| C04 | C05 | H13 | 108.5° | 109.5° |
| C03 | N01 | C02 | 114.3° | 110.9° |
| C03 | N01 | C19 | 109.8° | 111.2° |
| N01 | C03 | H9 | 109.3° | 109.5° |
| N01 | C03 | H10 | 109.3° | 109.4° |
| C01 | C02 | N01 | 111.7° | 109.5° |
| C01 | C02 | C20 | 108.5° | 109.5° |
| C02 | C01 | H5 | 109.5° | 109.5° |
| C02 | C01 | H6 | 109.5° | 109.5° |
| C02 | C01 | H7 | 109.5° | 109.5° |
| C01 | C02 | H8 | 108.0° | 109.5° |
| F01 | C13 | C14 | 117.9° | 120.1° |
| F01 | C13 | C10 | 120.4° | 120.1° |
| C05 | C06 | O01 | 111.2° | 109.4° |
| C06 | C05 | C18 | 112.2° | 109.5° |
| C06 | C05 | H13 | 108.3° | 109.6° |
| C05 | C06 | H14 | 109.1° | 109.5° |
| C05 | C06 | H15 | 109.0° | 109.5° |
| C06 | O01 | C07 | 124.3° | 117.0° |
| O01 | C06 | H14 | 109.0° | 109.5° |
| O01 | C06 | H15 | 109.1° | 109.5° |
| C05 | C18 | C19 | 112.0° | 109.3° |
| C18 | C05 | H13 | 108.4° | 109.5° |
| C05 | C18 | H22 | 108.8° | 109.5° |
| C05 | C18 | H23 | 108.8° | 109.5° |
| C13 | C14 | C07 | 119.8° | 120.1° |
| C14 | C13 | C10 | 121.7° | 119.8° |
| C13 | C14 | H1 | 120.1° | 120.0° |
| C14 | C07 | O01 | 127.6° | 119.9° |
| C14 | C07 | C08 | 119.9° | 120.2° |
| C07 | C14 | H1 | 120.1° | 120.0° |
| C13 | C10 | C11 | 118.3° | 120.1° |
| C13 | C10 | C09 | 118.1° | 119.8° |
| C02 | N01 | C19 | 112.6° | 111.0° |
| N01 | C02 | C20 | 112.4° | 109.5° |
| N01 | C02 | H8 | 108.0° | 109.5° |
| N01 | C19 | C18 | 109.8° | 109.5° |
| N01 | C19 | H24 | 109.4° | 109.4° |
| N01 | C19 | H25 | 109.4° | 109.4° |
| C02 | C20 | C25 | 121.1° | 120.0° |
| C02 | C20 | C21 | 120.2° | 120.0° |
| C20 | C02 | H8 | 108.1° | 109.4° |
| O02 | C11 | C10 | 122.0° | 120.0° |
| O02 | C11 | N02 | 120.6° | 120.0° |
| O01 | C07 | C08 | 112.5° | 119.9° |
| C07 | C08 | C09 | 118.9° | 120.2° |
| C07 | C08 | C15 | 120.8° | 119.9° |
| C19 | C18 | H22 | 108.9° | 109.5° |
| C19 | C18 | H23 | 108.8° | 109.5° |
| C18 | C19 | H24 | 109.4° | 109.5° |
| C18 | C19 | H25 | 109.4° | 109.5° |
| C11 | C10 | C09 | 123.4° | 120.1° |
| C10 | C11 | N02 | 117.4° | 120.0° |
| C10 | C09 | C08 | 121.5° | 119.9° |
| C10 | C09 | H16 | 119.2° | 120.1° |
| C11 | N02 | S01 | 122.6° | 120.0° |
| C11 | N02 | H30 | 118.7° | 120.0° |
| C25 | C20 | C21 | 118.7° | 120.0° |
| C20 | C25 | C24 | 120.5° | 120.0° |
| C20 | C25 | H28 | 119.8° | 120.0° |
| C20 | C21 | C22 | 120.3° | 120.0° |
| C20 | C21 | H26 | 119.9° | 120.0° |
| O04 | S01 | N02 | 108.1° | 104.3° |
| O04 | S01 | C12 | 109.6° | 110.5° |
| O04 | S01 | O03 | 118.6° | 121.0° |
| C25 | C24 | CL02 | 119.3° | 120.0° |
| C25 | C24 | C23 | 120.6° | 120.0° |
| C24 | C25 | H28 | 119.8° | 120.0° |
| C09 | C08 | C15 | 120.3° | 119.9° |
| C08 | C09 | H16 | 119.3° | 120.0° |
| C08 | C15 | C16 | 119.0° | 117.4° |
| C08 | C15 | C17 | 119.6° | 117.5° |
| C08 | C15 | H17 | 115.6° | 115.6° |
| C21 | C22 | C23 | 120.7° | 120.0° |
| C21 | C22 | CL01 | 119.6° | 120.0° |
| C22 | C21 | H26 | 119.9° | 120.0° |
| N02 | S01 | C12 | 102.7° | 104.5° |
| N02 | S01 | O03 | 106.3° | 104.3° |
| S01 | N02 | H30 | 118.7° | 120.0° |
| C12 | S01 | O03 | 110.3° | 110.6° |
| S01 | C12 | H2 | 109.5° | 109.5° |
| S01 | C12 | H3 | 109.4° | 109.5° |
| S01 | C12 | H4 | 109.5° | 109.4° |
| CL02 | C24 | C23 | 120.1° | 120.0° |
| C24 | C23 | C22 | 119.3° | 120.0° |
| C24 | C23 | H27 | 120.4° | 120.0° |
| C16 | C15 | C17 | 59.6° | 60.0° |
| C15 | C16 | C17 | 60.2° | 60.0° |
| C16 | C15 | H17 | 115.7° | 117.5° |
| C15 | C16 | H18 | 120.0° | 117.6° |
| C15 | C16 | H19 | 120.0° | 117.5° |
| C15 | C17 | C16 | 60.3° | 60.0° |
| C17 | C15 | H17 | 115.8° | 117.6° |
| C15 | C17 | H20 | 119.9° | 117.5° |
| C15 | C17 | H21 | 120.0° | 117.5° |
| C23 | C22 | CL01 | 119.7° | 120.0° |
| C22 | C23 | H27 | 120.4° | 120.0° |
| C17 | C16 | H18 | 120.0° | 117.5° |
| C17 | C16 | H19 | 119.9° | 117.5° |
| C16 | C17 | H20 | 119.9° | 117.5° |
| C16 | C17 | H21 | 120.0° | 117.5° |
| H2 | C12 | H3 | 109.5° | 109.5° |
| H2 | C12 | H4 | 109.4° | 109.5° |
| H3 | C12 | H4 | 109.4° | 109.5° |
| H5 | C01 | H6 | 109.5° | 109.4° |
| H5 | C01 | H7 | 109.5° | 109.4° |
| H6 | C01 | H7 | 109.5° | 109.5° |
| H9 | C03 | H10 | 109.4° | 109.5° |
| H11 | C04 | H12 | 109.5° | 109.5° |
| H14 | C06 | H15 | 109.5° | 109.5° |
| H18 | C16 | H19 | 109.5° | 115.5° |
| H20 | C17 | H21 | 109.5° | 115.5° |
| H22 | C18 | H23 | 109.5° | 109.5° |
| H24 | C19 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C03 | C04 | C05 | H11 | 120.5° | 120.0° |
| C03 | C04 | C05 | H12 | 120.5° | 119.9° |
| C04 | C03 | N01 | H9 | 120.2° | 120.0° |
| C04 | C03 | N01 | H10 | 120.1° | 120.0° |
| C03 | C04 | C05 | C06 | 174.7° | 177.6° |
| C03 | C04 | C05 | C18 | 51.1° | 57.7° |
| C04 | C03 | N01 | C02 | 173.2° | 174.2° |
| C04 | C03 | N01 | C19 | 59.2° | 61.7° |
| C04 | C03 | H9 | H10 | 119.6° | 120.0° |
| C03 | C04 | H11 | H12 | 118.3° | 120.0° |
| C03 | C04 | C05 | H13 | 67.5° | 62.2° |
| C05 | C04 | C03 | N01 | 55.1° | 59.2° |
| C04 | C05 | C06 | C18 | 122.4° | 119.7° |
| C04 | C05 | C06 | H13 | 117.9° | 120.2° |
| C04 | C05 | C06 | O01 | 171.5° | 175.0° |
| C04 | C05 | C18 | H13 | 118.6° | 119.9° |
| C04 | C05 | C18 | C19 | 52.5° | 57.7° |
| C05 | C04 | C03 | H9 | 65.0° | 60.8° |
| C05 | C04 | C03 | H10 | 175.2° | 179.2° |
| C05 | C04 | H11 | H12 | 118.3° | 120.2° |
| C04 | C05 | C06 | H14 | 51.2° | 65.0° |
| C04 | C05 | C06 | H15 | 68.3° | 55.0° |
| C04 | C05 | C18 | H22 | 67.9° | 62.3° |
| C04 | C05 | C18 | H23 | 172.9° | 177.6° |
| C03 | N01 | C02 | C01 | 54.2° | 60.0° |
| C03 | N01 | C02 | C19 | 126.1° | 124.2° |
| C03 | N01 | C02 | C20 | 176.4° | 180.0° |
| C03 | N01 | C19 | C18 | 61.0° | 61.8° |
| C03 | N01 | C02 | H8 | 64.4° | 60.0° |
| N01 | C03 | H9 | H10 | 119.6° | 120.0° |
| N01 | C03 | C04 | H11 | 65.4° | 60.8° |
| N01 | C03 | C04 | H12 | 175.7° | 179.2° |
| C03 | N01 | C19 | H24 | 59.0° | 178.2° |
| C03 | N01 | C19 | H25 | 178.9° | 58.2° |
| C01 | C02 | N01 | C20 | 122.2° | 120.0° |
| C01 | C02 | N01 | H8 | 118.6° | 120.0° |
| C01 | C02 | N01 | C19 | 179.7° | 175.8° |
| C01 | C02 | C20 | H8 | 116.8° | 119.9° |
| C01 | C02 | C20 | C25 | 70.8° | 100.0° |
| C01 | C02 | C20 | C21 | 109.8° | 80.3° |
| C02 | C01 | H5 | H6 | 120.0° | 120.0° |
| C02 | C01 | H5 | H7 | 120.0° | 120.0° |
| C02 | C01 | H6 | H7 | 120.0° | 120.0° |
| F01 | C13 | C14 | C10 | 178.8° | 180.0° |
| F01 | C13 | C14 | C07 | 179.9° | 180.0° |
| F01 | C13 | C10 | C11 | 2.3° | 0.0° |
| F01 | C13 | C10 | C09 | 178.7° | 180.0° |
| F01 | C13 | C14 | H1 | 0.1° | 0.3° |
| C05 | C06 | O01 | H14 | 120.3° | 120.0° |
| C05 | C06 | O01 | H15 | 120.2° | 120.0° |
| C06 | C05 | C18 | H13 | 119.6° | 120.2° |
| C05 | C06 | O01 | C07 | 110.1° | 180.0° |
| C06 | C05 | C18 | C19 | 174.3° | 177.6° |
| C06 | C05 | C04 | H11 | 54.2° | 57.6° |
| C06 | C05 | C04 | H12 | 64.7° | 62.5° |
| C05 | C06 | H14 | H15 | 119.2° | 120.0° |
| C06 | C05 | C18 | H22 | 53.9° | 57.6° |
| C06 | C05 | C18 | H23 | 65.4° | 62.5° |
| O01 | C06 | C05 | C18 | 49.0° | 65.3° |
| C06 | O01 | C07 | C14 | 10.4° | 0.1° |
| C06 | O01 | C07 | C08 | 169.6° | 180.0° |
| O01 | C06 | C05 | H13 | 70.6° | 54.8° |
| O01 | C06 | H14 | H15 | 119.2° | 120.0° |
| C05 | C18 | C19 | N01 | 58.1° | 59.2° |
| C05 | C18 | C19 | H22 | 120.4° | 120.0° |
| C05 | C18 | C19 | H23 | 120.4° | 119.9° |
| C18 | C05 | C04 | H11 | 69.4° | 62.3° |
| C18 | C05 | C04 | H12 | 171.7° | 177.6° |
| C18 | C05 | C06 | H14 | 71.2° | 54.6° |
| C18 | C05 | C06 | H15 | 169.3° | 174.7° |
| C05 | C18 | H22 | H23 | 118.8° | 120.1° |
| C05 | C18 | C19 | H24 | 62.0° | 179.2° |
| C05 | C18 | C19 | H25 | 178.2° | 60.8° |
| C13 | C14 | C07 | H1 | 180.0° | 179.7° |
| C13 | C14 | C07 | O01 | 179.8° | 180.0° |
| C13 | C14 | C07 | C08 | 0.1° | 0.0° |
| C14 | C13 | C10 | C11 | 178.9° | 180.0° |
| C14 | C13 | C10 | C09 | 2.5° | 0.0° |
| C07 | C14 | C13 | C10 | 1.2° | 0.0° |
| C14 | C07 | O01 | C08 | 179.9° | 179.9° |
| C14 | C07 | C08 | C09 | 0.4° | 0.0° |
| C14 | C07 | C08 | C15 | 179.9° | 180.0° |
| C13 | C10 | C11 | O02 | 2.9° | 0.0° |
| C13 | C10 | C11 | C09 | 176.1° | 180.0° |
| C13 | C10 | C11 | N02 | 177.1° | 180.0° |
| C13 | C10 | C09 | C08 | 2.8° | 0.0° |
| C10 | C13 | C14 | H1 | 178.8° | 179.7° |
| C13 | C10 | C09 | H16 | 177.2° | 179.9° |
| N01 | C02 | C20 | H8 | 119.1° | 120.1° |
| C02 | N01 | C19 | C18 | 170.5° | 174.2° |
| N01 | C02 | C20 | C25 | 53.3° | 140.0° |
| N01 | C02 | C20 | C21 | 126.1° | 39.7° |
| N01 | C02 | C01 | H5 | 180.0° | 60.0° |
| N01 | C02 | C01 | H6 | 60.0° | 60.0° |
| N01 | C02 | C01 | H7 | 60.0° | 180.0° |
| C02 | N01 | C03 | H9 | 66.6° | 65.8° |
| C02 | N01 | C03 | H10 | 53.1° | 54.2° |
| C02 | N01 | C19 | H24 | 69.4° | 54.2° |
| C02 | N01 | C19 | H25 | 50.4° | 65.8° |
| C19 | N01 | C02 | C20 | 57.4° | 55.8° |
| N01 | C19 | C18 | H24 | 120.0° | 120.0° |
| N01 | C19 | C18 | H25 | 120.1° | 120.0° |
| C19 | N01 | C02 | H8 | 61.7° | 64.2° |
| C19 | N01 | C03 | H9 | 61.0° | 58.3° |
| C19 | N01 | C03 | H10 | 179.3° | 178.2° |
| N01 | C19 | C18 | H22 | 62.3° | 60.8° |
| N01 | C19 | C18 | H23 | 178.5° | 179.1° |
| N01 | C19 | H24 | H25 | 119.8° | 120.0° |
| C02 | C20 | C25 | C21 | 179.4° | 179.7° |
| C02 | C20 | C25 | C24 | 179.7° | 179.7° |
| C02 | C20 | C21 | C22 | 179.7° | 180.0° |
| C20 | C02 | C01 | H5 | 55.5° | 180.0° |
| C20 | C02 | C01 | H6 | 175.5° | 60.0° |
| C20 | C02 | C01 | H7 | 64.5° | 60.0° |
| C02 | C20 | C21 | H26 | 0.3° | 0.0° |
| C02 | C20 | C25 | H28 | 0.3° | 0.0° |
| O02 | C11 | C10 | N02 | 180.0° | 179.9° |
| O02 | C11 | C10 | C09 | 173.2° | 180.0° |
| O02 | C11 | N02 | S01 | 0.6° | 0.0° |
| O02 | C11 | N02 | H30 | 179.4° | 180.0° |
| O01 | C07 | C08 | C09 | 179.6° | 179.9° |
| O01 | C07 | C08 | C15 | 0.1° | 0.0° |
| O01 | C07 | C14 | H1 | 0.2° | 0.3° |
| C07 | O01 | C06 | H14 | 129.7° | 60.1° |
| C07 | O01 | C06 | H15 | 10.2° | 60.0° |
| C07 | C08 | C09 | C10 | 1.7° | 0.0° |
| C07 | C08 | C09 | C15 | 179.7° | 180.0° |
| C07 | C08 | C15 | C16 | 66.3° | 120.0° |
| C07 | C08 | C15 | C17 | 135.8° | 171.4° |
| C08 | C07 | C14 | H1 | 179.9° | 179.7° |
| C07 | C08 | C09 | H16 | 178.3° | 180.0° |
| C07 | C08 | C15 | H17 | 78.5° | 25.6° |
| C19 | C18 | C05 | H13 | 66.2° | 62.3° |
| C19 | C18 | H22 | H23 | 118.8° | 120.1° |
| C18 | C19 | H24 | H25 | 119.8° | 120.0° |
| C11 | C10 | C09 | C08 | 178.9° | 180.0° |
| C10 | C11 | N02 | S01 | 179.4° | 180.0° |
| C11 | C10 | C09 | H16 | 1.1° | 0.0° |
| C10 | C11 | N02 | H30 | 0.6° | 0.0° |
| C09 | C10 | C11 | N02 | 6.7° | 0.0° |
| C10 | C09 | C08 | H16 | 180.0° | 180.0° |
| C10 | C09 | C08 | C15 | 178.5° | 180.0° |
| C11 | N02 | S01 | O04 | 42.4° | 178.9° |
| C11 | N02 | S01 | H30 | 180.0° | 180.0° |
| C11 | N02 | S01 | C12 | 73.4° | 65.0° |
| C11 | N02 | S01 | O03 | 170.8° | 51.1° |
| C20 | C25 | C24 | H28 | 180.0° | 179.7° |
| C25 | C20 | C21 | C22 | 0.3° | 0.3° |
| C20 | C25 | C24 | CL02 | 179.8° | 179.7° |
| C20 | C25 | C24 | C23 | 0.2° | 0.6° |
| C25 | C20 | C02 | H8 | 172.4° | 19.9° |
| C25 | C20 | C21 | H26 | 179.7° | 179.7° |
| C21 | C20 | C25 | C24 | 0.4° | 0.5° |
| C20 | C21 | C22 | H26 | 180.0° | 180.0° |
| C20 | C21 | C22 | C23 | 0.1° | 0.0° |
| C20 | C21 | C22 | CL01 | 179.9° | 180.0° |
| C21 | C20 | C02 | H8 | 7.0° | 159.8° |
| C21 | C20 | C25 | H28 | 179.6° | 179.7° |
| O04 | S01 | N02 | C12 | 115.8° | 116.0° |
| O04 | S01 | N02 | O03 | 128.4° | 127.8° |
| O04 | S01 | C12 | O03 | 132.3° | 136.7° |
| O04 | S01 | C12 | H2 | 180.0° | 51.6° |
| O04 | S01 | C12 | H3 | 60.0° | 68.4° |
| O04 | S01 | C12 | H4 | 60.0° | 171.6° |
| O04 | S01 | N02 | H30 | 137.6° | 1.0° |
| C25 | C24 | CL02 | C23 | 179.9° | 179.7° |
| C25 | C24 | C23 | C22 | 0.0° | 0.3° |
| C25 | C24 | C23 | H27 | 179.9° | 179.8° |
| C09 | C08 | C15 | C16 | 113.9° | 60.0° |
| C09 | C08 | C15 | C17 | 44.5° | 8.6° |
| C09 | C08 | C15 | H17 | 101.3° | 154.4° |
| C08 | C15 | C16 | C17 | 109.2° | 107.5° |
| C08 | C15 | C16 | H17 | 144.7° | 145.0° |
| C08 | C15 | C17 | H17 | 145.7° | 145.1° |
| C15 | C08 | C09 | H16 | 1.5° | 0.0° |
| C08 | C15 | C16 | H18 | 0.3° | 0.0° |
| C08 | C15 | C16 | H19 | 141.3° | 145.0° |
| C08 | C15 | C17 | H20 | 142.2° | 145.1° |
| C08 | C15 | C17 | H21 | 1.3° | 0.0° |
| C21 | C22 | C23 | C24 | 0.0° | 0.0° |
| C21 | C22 | C23 | CL01 | 180.0° | 180.0° |
| C21 | C22 | C23 | H27 | 180.0° | 180.0° |
| N02 | S01 | C12 | O03 | 113.0° | 111.7° |
| N02 | S01 | C12 | H2 | 65.3° | 60.0° |
| N02 | S01 | C12 | H3 | 174.6° | 180.0° |
| N02 | S01 | C12 | H4 | 54.7° | 60.0° |
| S01 | C12 | H2 | H3 | 120.0° | 120.0° |
| S01 | C12 | H2 | H4 | 120.0° | 120.0° |
| S01 | C12 | H3 | H4 | 120.0° | 120.0° |
| C12 | S01 | N02 | H30 | 106.6° | 115.0° |
| O03 | S01 | C12 | H2 | 47.7° | 171.7° |
| O03 | S01 | C12 | H3 | 72.4° | 68.3° |
| O03 | S01 | C12 | H4 | 167.7° | 51.7° |
| O03 | S01 | N02 | H30 | 9.2° | 128.9° |
| CL02 | C24 | C23 | C22 | 180.0° | 180.0° |
| CL02 | C24 | C23 | H27 | 0.0° | 0.0° |
| CL02 | C24 | C25 | H28 | 0.2° | 0.0° |
| C24 | C23 | C22 | H27 | 180.0° | 179.9° |
| C24 | C23 | C22 | CL01 | 180.0° | 180.0° |
| C23 | C24 | C25 | H28 | 179.8° | 179.7° |
| C16 | C15 | C17 | H17 | 106.0° | 107.5° |
| C15 | C16 | C17 | H18 | 109.5° | 107.5° |
| C15 | C16 | C17 | H19 | 109.5° | 107.5° |
| C15 | C16 | H18 | H19 | 144.6° | 145.7° |
| C16 | C15 | C17 | H20 | 109.5° | 107.5° |
| C16 | C15 | C17 | H21 | 109.6° | 107.5° |
| C15 | C17 | H20 | H21 | 144.6° | 145.7° |
| C23 | C22 | C21 | H26 | 179.9° | 180.0° |
| CL01 | C22 | C21 | H26 | 0.1° | 0.0° |
| CL01 | C22 | C23 | H27 | 0.0° | 0.0° |
| C17 | C16 | H18 | H19 | 144.6° | 145.7° |
| C16 | C17 | H20 | H21 | 144.6° | 145.7° |
| H2 | C12 | H3 | H4 | 120.0° | 120.0° |
| H5 | C01 | H6 | H7 | 120.0° | 119.9° |
| H5 | C01 | C02 | H8 | 61.4° | 60.1° |
| H6 | C01 | C02 | H8 | 58.6° | 180.0° |
| H7 | C01 | C02 | H8 | 178.6° | 59.9° |
| H9 | C03 | C04 | H11 | 174.4° | 179.2° |
| H9 | C03 | C04 | H12 | 55.5° | 59.2° |
| H10 | C03 | C04 | H11 | 54.7° | 59.2° |
| H10 | C03 | C04 | H12 | 64.2° | 60.9° |
| H11 | C04 | C05 | H13 | 172.0° | 177.8° |
| H12 | C04 | C05 | H13 | 53.1° | 57.6° |
| H13 | C05 | C06 | H14 | 169.1° | 174.8° |
| H13 | C05 | C06 | H15 | 49.7° | 65.1° |
| H13 | C05 | C18 | H22 | 173.5° | 177.8° |
| H13 | C05 | C18 | H23 | 54.2° | 57.7° |
| H17 | C15 | C16 | H18 | 144.4° | 145.0° |
| H17 | C15 | C16 | H19 | 3.5° | 0.0° |
| H17 | C15 | C17 | H20 | 3.5° | 0.1° |
| H17 | C15 | C17 | H21 | 144.5° | 145.1° |
| H18 | C16 | C17 | H20 | 141.0° | 145.0° |
| H18 | C16 | C17 | H21 | 0.0° | 0.0° |
| H19 | C16 | C17 | H20 | 0.0° | 0.0° |
| H19 | C16 | C17 | H21 | 140.9° | 145.0° |
| H22 | C18 | C19 | H24 | 177.7° | 59.2° |
| H22 | C18 | C19 | H25 | 57.8° | 179.2° |
| H23 | C18 | C19 | H24 | 58.4° | 60.9° |
| H23 | C18 | C19 | H25 | 61.5° | 59.1° |
