UER
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C19 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C15 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C18 | sing | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.51Å | 1.54Å | |
| C14 | N03 | sing | 1.47Å | 1.46Å | |
| C15 | C16 | doub | 1.38Å | 1.39Å | Aromatic |
| C18 | CL01 | sing | 1.74Å | 1.79Å | |
| C18 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| N03 | C12 | sing | 1.47Å | 1.33Å | |
| N03 | C11 | sing | 1.47Å | 1.32Å | |
| C16 | C17 | sing | 1.38Å | 1.39Å | Aromatic |
| C12 | C13 | sing | 1.53Å | 1.39Å | |
| C11 | C10 | sing | 1.53Å | 1.39Å | |
| C13 | N02 | sing | 1.47Å | 1.33Å | |
| C10 | N02 | sing | 1.47Å | 1.33Å | |
| N02 | C07 | sing | 1.35Å | 1.48Å | |
| C07 | O01 | doub | 1.21Å | 1.18Å | |
| C07 | C06 | sing | 1.51Å | 1.56Å | |
| C09 | C06 | sing | 1.53Å | 1.53Å | |
| C08 | C06 | sing | 1.53Å | 1.53Å | |
| C06 | S01 | sing | 1.81Å | 1.83Å | |
| S01 | O02 | doub | 1.42Å | 1.65Å | |
| S01 | O03 | doub | 1.42Å | 1.65Å | |
| S01 | C03 | sing | 1.76Å | 1.83Å | |
| C04 | C03 | doub | 1.38Å | 1.39Å | Aromatic |
| C04 | C05 | sing | 1.39Å | 1.39Å | Aromatic |
| C03 | N01 | sing | 1.32Å | 1.32Å | Aromatic |
| C05 | C01 | doub | 1.39Å | 1.39Å | Aromatic |
| N01 | C02 | doub | 1.32Å | 1.32Å | Aromatic |
| C01 | C02 | sing | 1.38Å | 1.39Å | Aromatic |
| C01 | C21 | sing | 1.51Å | 1.53Å | |
| F03 | C21 | sing | 1.40Å | 1.36Å | |
| C21 | F02 | sing | 1.40Å | 1.36Å | |
| C21 | F01 | sing | 1.40Å | 1.37Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C12 | H3 | sing | 1.09Å | 1.10Å | |
| C02 | H4 | sing | 1.08Å | 1.08Å | |
| C04 | H5 | sing | 1.08Å | 1.08Å | |
| C05 | H6 | sing | 1.08Å | 1.08Å | |
| C08 | H7 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.09Å | 1.10Å | |
| C08 | H9 | sing | 1.09Å | 1.10Å | |
| C09 | H10 | sing | 1.09Å | 1.10Å | |
| C09 | H11 | sing | 1.09Å | 1.10Å | |
| C09 | H12 | sing | 1.09Å | 1.10Å | |
| C13 | H13 | sing | 1.09Å | 1.10Å | |
| C14 | H14 | sing | 1.09Å | 1.10Å | |
| C14 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C17 | H17 | sing | 1.08Å | 1.08Å | |
| C19 | H18 | sing | 1.08Å | 1.08Å | |
| C20 | H19 | sing | 1.08Å | 1.08Å | |
| C10 | H20 | sing | 1.09Å | 1.10Å | |
| C11 | H21 | sing | 1.09Å | 1.10Å | |
| C12 | H22 | sing | 1.09Å | 1.10Å | |
| C13 | H23 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C20 | C15 | 120.1° | 120.0° |
| C20 | C19 | C18 | 120.0° | 120.0° |
| C20 | C19 | H18 | 120.0° | 120.0° |
| C19 | C20 | H19 | 119.9° | 120.0° |
| C20 | C15 | C14 | 119.9° | 120.0° |
| C20 | C15 | C16 | 119.8° | 120.0° |
| C15 | C20 | H19 | 119.9° | 120.0° |
| C19 | C18 | CL01 | 119.9° | 120.0° |
| C19 | C18 | C17 | 120.0° | 120.0° |
| C18 | C19 | H18 | 120.0° | 120.0° |
| C15 | C14 | N03 | 109.4° | 109.5° |
| C14 | C15 | C16 | 120.3° | 119.9° |
| C15 | C14 | H14 | 109.5° | 109.4° |
| C15 | C14 | H15 | 109.5° | 109.5° |
| C14 | N03 | C12 | 121.1° | 111.0° |
| C14 | N03 | C11 | 120.7° | 111.0° |
| N03 | C14 | H14 | 109.5° | 109.5° |
| N03 | C14 | H15 | 109.5° | 109.5° |
| C15 | C16 | C17 | 120.0° | 120.0° |
| C15 | C16 | H16 | 120.0° | 120.0° |
| CL01 | C18 | C17 | 120.1° | 120.0° |
| C18 | C17 | C16 | 120.0° | 120.0° |
| C18 | C17 | H17 | 120.0° | 120.0° |
| C12 | N03 | C11 | 118.2° | 111.3° |
| N03 | C12 | C13 | 121.2° | 109.3° |
| N03 | C12 | H3 | 106.4° | 109.5° |
| N03 | C12 | H22 | 106.5° | 109.5° |
| N03 | C11 | C10 | 120.8° | 109.4° |
| N03 | C11 | H2 | 106.6° | 109.5° |
| N03 | C11 | H21 | 106.6° | 109.5° |
| C17 | C16 | H16 | 120.0° | 120.0° |
| C16 | C17 | H17 | 120.0° | 120.1° |
| C12 | C13 | N02 | 120.3° | 108.5° |
| C13 | C12 | H3 | 106.5° | 109.5° |
| C12 | C13 | H13 | 106.7° | 109.6° |
| C13 | C12 | H22 | 106.5° | 109.5° |
| C12 | C13 | H23 | 106.7° | 109.6° |
| C11 | C10 | N02 | 121.1° | 108.5° |
| C11 | C10 | H1 | 106.5° | 109.6° |
| C10 | C11 | H2 | 106.5° | 109.5° |
| C11 | C10 | H20 | 106.5° | 109.8° |
| C10 | C11 | H21 | 106.5° | 109.5° |
| C13 | N02 | C10 | 118.3° | 118.2° |
| C13 | N02 | C07 | 126.2° | 120.9° |
| N02 | C13 | H13 | 106.7° | 109.7° |
| N02 | C13 | H23 | 106.7° | 109.6° |
| C10 | N02 | C07 | 115.5° | 120.9° |
| N02 | C10 | H1 | 106.5° | 109.6° |
| N02 | C10 | H20 | 106.5° | 109.6° |
| N02 | C07 | O01 | 114.1° | 120.0° |
| N02 | C07 | C06 | 130.1° | 120.0° |
| O01 | C07 | C06 | 115.7° | 120.0° |
| C07 | C06 | C09 | 112.9° | 109.5° |
| C07 | C06 | C08 | 115.9° | 109.5° |
| C07 | C06 | S01 | 103.0° | 109.5° |
| C09 | C06 | C08 | 108.4° | 109.5° |
| C09 | C06 | S01 | 111.2° | 109.4° |
| C06 | C09 | H10 | 109.5° | 109.5° |
| C06 | C09 | H11 | 109.4° | 109.5° |
| C06 | C09 | H12 | 109.5° | 109.5° |
| C08 | C06 | S01 | 105.2° | 109.5° |
| C06 | C08 | H7 | 109.5° | 109.5° |
| C06 | C08 | H8 | 109.5° | 109.5° |
| C06 | C08 | H9 | 109.5° | 109.5° |
| C06 | S01 | O02 | 109.4° | 110.5° |
| C06 | S01 | O03 | 105.3° | 110.6° |
| C06 | S01 | C03 | 117.3° | 104.5° |
| O02 | S01 | O03 | 109.8° | 121.0° |
| O02 | S01 | C03 | 108.1° | 104.3° |
| O03 | S01 | C03 | 106.8° | 104.3° |
| S01 | C03 | C04 | 120.4° | 119.6° |
| S01 | C03 | N01 | 117.6° | 119.6° |
| C03 | C04 | C05 | 117.9° | 119.2° |
| C04 | C03 | N01 | 122.0° | 120.7° |
| C03 | C04 | H5 | 121.1° | 120.5° |
| C04 | C05 | C01 | 118.6° | 118.4° |
| C05 | C04 | H5 | 121.1° | 120.4° |
| C04 | C05 | H6 | 120.7° | 120.8° |
| C03 | N01 | C02 | 121.5° | 121.8° |
| C05 | C01 | C02 | 119.8° | 119.2° |
| C05 | C01 | C21 | 120.9° | 120.4° |
| C01 | C05 | H6 | 120.7° | 120.8° |
| N01 | C02 | C01 | 120.2° | 120.8° |
| N01 | C02 | H4 | 119.9° | 119.6° |
| C02 | C01 | C21 | 119.3° | 120.4° |
| C01 | C02 | H4 | 119.9° | 119.6° |
| C01 | C21 | F03 | 109.5° | 109.5° |
| C01 | C21 | F02 | 109.8° | 109.5° |
| C01 | C21 | F01 | 109.2° | 109.4° |
| F03 | C21 | F02 | 109.9° | 109.5° |
| F03 | C21 | F01 | 109.2° | 109.5° |
| F02 | C21 | F01 | 109.2° | 109.5° |
| H1 | C10 | H20 | 109.4° | 109.7° |
| H2 | C11 | H21 | 109.5° | 109.5° |
| H3 | C12 | H22 | 109.5° | 109.5° |
| H7 | C08 | H8 | 109.5° | 109.5° |
| H7 | C08 | H9 | 109.4° | 109.5° |
| H8 | C08 | H9 | 109.4° | 109.4° |
| H10 | C09 | H11 | 109.5° | 109.4° |
| H10 | C09 | H12 | 109.4° | 109.5° |
| H11 | C09 | H12 | 109.5° | 109.5° |
| H13 | C13 | H23 | 109.4° | 109.8° |
| H14 | C14 | H15 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C20 | C15 | H19 | 180.0° | 179.4° |
| C20 | C19 | C18 | H18 | 180.0° | 179.7° |
| C19 | C20 | C15 | C14 | 180.0° | 179.7° |
| C19 | C20 | C15 | C16 | 0.3° | 0.6° |
| C20 | C19 | C18 | CL01 | 179.9° | 179.7° |
| C20 | C19 | C18 | C17 | 0.0° | 0.3° |
| C15 | C20 | C19 | C18 | 0.1° | 0.6° |
| C20 | C15 | C14 | C16 | 179.7° | 179.7° |
| C20 | C15 | C14 | N03 | 104.5° | 90.3° |
| C20 | C15 | C16 | C17 | 0.3° | 0.3° |
| C20 | C15 | C14 | H14 | 15.5° | 29.7° |
| C20 | C15 | C14 | H15 | 135.5° | 149.7° |
| C20 | C15 | C16 | H16 | 179.7° | 179.7° |
| C15 | C20 | C19 | H18 | 179.9° | 179.7° |
| C19 | C18 | CL01 | C17 | 179.9° | 179.9° |
| C19 | C18 | C17 | C16 | 0.0° | 0.1° |
| C19 | C18 | C17 | H17 | 180.0° | 180.0° |
| C18 | C19 | C20 | H19 | 179.9° | 180.0° |
| C15 | C14 | N03 | H14 | 120.0° | 119.9° |
| C15 | C14 | N03 | H15 | 120.0° | 120.0° |
| C15 | C14 | N03 | C12 | 149.5° | 170.0° |
| C15 | C14 | N03 | C11 | 30.4° | 45.7° |
| C14 | C15 | C16 | C17 | 179.9° | 180.0° |
| C15 | C14 | H14 | H15 | 120.0° | 120.0° |
| C14 | C15 | C16 | H16 | 0.1° | 0.0° |
| C14 | C15 | C20 | H19 | 0.0° | 0.3° |
| N03 | C14 | C15 | C16 | 75.8° | 90.0° |
| C14 | N03 | C12 | C11 | 179.9° | 124.1° |
| C14 | N03 | C12 | C13 | 180.0° | 172.8° |
| C14 | N03 | C11 | C10 | 179.8° | 172.8° |
| C14 | N03 | C11 | H2 | 58.2° | 52.8° |
| C14 | N03 | C12 | H3 | 58.3° | 67.3° |
| N03 | C14 | H14 | H15 | 120.0° | 120.1° |
| C14 | N03 | C11 | H21 | 58.7° | 67.3° |
| C14 | N03 | C12 | H22 | 58.4° | 52.8° |
| C15 | C16 | C17 | C18 | 0.2° | 0.0° |
| C15 | C16 | C17 | H16 | 180.0° | 180.0° |
| C16 | C15 | C14 | H14 | 164.2° | 150.0° |
| C16 | C15 | C14 | H15 | 44.2° | 30.0° |
| C15 | C16 | C17 | H17 | 179.8° | 180.0° |
| C16 | C15 | C20 | H19 | 179.7° | 180.0° |
| CL01 | C18 | C17 | C16 | 179.9° | 180.0° |
| CL01 | C18 | C17 | H17 | 0.1° | 0.1° |
| CL01 | C18 | C19 | H18 | 0.1° | 0.0° |
| C18 | C17 | C16 | H17 | 180.0° | 179.9° |
| C18 | C17 | C16 | H16 | 179.8° | 180.0° |
| C17 | C18 | C19 | H18 | 180.0° | 180.0° |
| N03 | C12 | C13 | H3 | 121.6° | 119.9° |
| N03 | C12 | C13 | H22 | 121.6° | 120.0° |
| C12 | N03 | C11 | C10 | 0.1° | 63.1° |
| N03 | C12 | C13 | N02 | 0.4° | 53.8° |
| C12 | N03 | C11 | H2 | 121.7° | 176.9° |
| N03 | C12 | H3 | H22 | 114.7° | 120.1° |
| N03 | C12 | C13 | H13 | 121.2° | 65.9° |
| C12 | N03 | C14 | H14 | 90.5° | 70.0° |
| C12 | N03 | C14 | H15 | 29.5° | 50.0° |
| C12 | N03 | C11 | H21 | 121.5° | 56.9° |
| N03 | C12 | C13 | H23 | 121.9° | 173.5° |
| C11 | N03 | C12 | C13 | 0.2° | 63.1° |
| N03 | C11 | C10 | H2 | 121.6° | 120.0° |
| N03 | C11 | C10 | H21 | 121.6° | 120.0° |
| N03 | C11 | C10 | N02 | 0.2° | 53.8° |
| N03 | C11 | C10 | H1 | 121.4° | 173.5° |
| N03 | C11 | H2 | H21 | 114.9° | 120.1° |
| C11 | N03 | C12 | H3 | 121.8° | 56.9° |
| C11 | N03 | C14 | H14 | 89.6° | 165.7° |
| C11 | N03 | C14 | H15 | 150.4° | 74.3° |
| N03 | C11 | C10 | H20 | 121.8° | 65.9° |
| C11 | N03 | C12 | H22 | 121.5° | 176.9° |
| C12 | C13 | N02 | H13 | 121.6° | 119.7° |
| C12 | C13 | N02 | H23 | 121.5° | 119.7° |
| C12 | C13 | N02 | C10 | 0.3° | 51.2° |
| C12 | C13 | N02 | C07 | 179.9° | 128.8° |
| C13 | C12 | H3 | H22 | 114.7° | 120.1° |
| C12 | C13 | H13 | H23 | 115.1° | 120.5° |
| C11 | C10 | N02 | C13 | 0.0° | 51.2° |
| C11 | C10 | N02 | H1 | 121.6° | 119.7° |
| C11 | C10 | N02 | H20 | 121.7° | 119.9° |
| C11 | C10 | N02 | C07 | 179.7° | 128.9° |
| C11 | C10 | H1 | H20 | 114.8° | 120.6° |
| C10 | C11 | H2 | H21 | 114.8° | 120.0° |
| C13 | N02 | C10 | C07 | 179.7° | 179.9° |
| C13 | N02 | C07 | O01 | 179.8° | 175.0° |
| C13 | N02 | C07 | C06 | 1.1° | 5.1° |
| C13 | N02 | C10 | H1 | 121.7° | 170.9° |
| N02 | C13 | C12 | H3 | 122.0° | 66.1° |
| N02 | C13 | H13 | H23 | 115.1° | 120.5° |
| C13 | N02 | C10 | H20 | 121.6° | 68.7° |
| N02 | C13 | C12 | H22 | 121.3° | 173.8° |
| C10 | N02 | C07 | O01 | 0.5° | 5.1° |
| C10 | N02 | C07 | C06 | 179.3° | 174.9° |
| N02 | C10 | H1 | H20 | 114.7° | 120.4° |
| N02 | C10 | C11 | H2 | 121.8° | 173.8° |
| C10 | N02 | C13 | H13 | 121.3° | 68.5° |
| N02 | C10 | C11 | H21 | 121.4° | 66.2° |
| C10 | N02 | C13 | H23 | 121.8° | 170.9° |
| N02 | C07 | O01 | C06 | 178.9° | 180.0° |
| N02 | C07 | C06 | C09 | 97.0° | 65.5° |
| N02 | C07 | C06 | C08 | 28.8° | 54.5° |
| N02 | C07 | C06 | S01 | 143.0° | 174.5° |
| C07 | N02 | C10 | H1 | 58.7° | 9.2° |
| C07 | N02 | C13 | H13 | 58.4° | 111.5° |
| C07 | N02 | C10 | H20 | 58.0° | 111.3° |
| C07 | N02 | C13 | H23 | 58.6° | 9.1° |
| O01 | C07 | C06 | C09 | 84.3° | 114.5° |
| O01 | C07 | C06 | C08 | 149.9° | 125.5° |
| O01 | C07 | C06 | S01 | 35.7° | 5.4° |
| C07 | C06 | C09 | C08 | 129.7° | 120.0° |
| C07 | C06 | C09 | S01 | 115.2° | 120.0° |
| C07 | C06 | C08 | S01 | 113.0° | 120.1° |
| C07 | C06 | S01 | O02 | 13.7° | 68.4° |
| C07 | C06 | S01 | O03 | 104.2° | 68.3° |
| C07 | C06 | S01 | C03 | 137.2° | 180.0° |
| C07 | C06 | C08 | H7 | 180.0° | 53.7° |
| C07 | C06 | C08 | H8 | 60.0° | 66.3° |
| C07 | C06 | C08 | H9 | 60.0° | 173.7° |
| C07 | C06 | C09 | H10 | 180.0° | 162.8° |
| C07 | C06 | C09 | H11 | 60.0° | 42.8° |
| C07 | C06 | C09 | H12 | 60.0° | 77.2° |
| C09 | C06 | C08 | S01 | 118.9° | 120.0° |
| C09 | C06 | S01 | O02 | 107.5° | 171.6° |
| C09 | C06 | S01 | O03 | 134.6° | 51.6° |
| C09 | C06 | S01 | C03 | 16.0° | 60.0° |
| C09 | C06 | C08 | H7 | 52.0° | 173.7° |
| C09 | C06 | C08 | H8 | 68.1° | 53.7° |
| C09 | C06 | C08 | H9 | 172.0° | 66.3° |
| C06 | C09 | H10 | H11 | 120.0° | 120.0° |
| C06 | C09 | H10 | H12 | 120.0° | 120.1° |
| C06 | C09 | H11 | H12 | 120.0° | 120.0° |
| C08 | C06 | S01 | O02 | 135.5° | 51.7° |
| C08 | C06 | S01 | O03 | 17.5° | 171.6° |
| C08 | C06 | S01 | C03 | 101.1° | 60.0° |
| C06 | C08 | H7 | H8 | 120.0° | 120.0° |
| C06 | C08 | H7 | H9 | 120.0° | 120.0° |
| C06 | C08 | H8 | H9 | 120.0° | 120.0° |
| C08 | C06 | C09 | H10 | 50.3° | 42.8° |
| C08 | C06 | C09 | H11 | 170.3° | 77.2° |
| C08 | C06 | C09 | H12 | 69.7° | 162.8° |
| C06 | S01 | O02 | O03 | 115.1° | 131.5° |
| C06 | S01 | O02 | C03 | 128.7° | 111.7° |
| C06 | S01 | O03 | C03 | 125.4° | 111.8° |
| C06 | S01 | C03 | C04 | 83.2° | 89.5° |
| C06 | S01 | C03 | N01 | 98.7° | 90.0° |
| S01 | C06 | C08 | H7 | 67.0° | 66.4° |
| S01 | C06 | C08 | H8 | 173.0° | 173.6° |
| S01 | C06 | C08 | H9 | 53.0° | 53.7° |
| S01 | C06 | C09 | H10 | 64.8° | 77.2° |
| S01 | C06 | C09 | H11 | 55.2° | 162.8° |
| S01 | C06 | C09 | H12 | 175.2° | 42.8° |
| O02 | S01 | O03 | C03 | 116.9° | 116.8° |
| O02 | S01 | C03 | C04 | 40.9° | 26.5° |
| O02 | S01 | C03 | N01 | 137.2° | 153.9° |
| O03 | S01 | C03 | C04 | 158.9° | 154.4° |
| O03 | S01 | C03 | N01 | 19.1° | 26.0° |
| S01 | C03 | C04 | N01 | 177.9° | 179.5° |
| S01 | C03 | C04 | C05 | 179.2° | 179.8° |
| S01 | C03 | N01 | C02 | 179.3° | 180.0° |
| S01 | C03 | C04 | H5 | 0.8° | 0.4° |
| C03 | C04 | C05 | H5 | 180.0° | 179.3° |
| C03 | C04 | C05 | C01 | 0.6° | 0.5° |
| C04 | C03 | N01 | C02 | 1.3° | 0.5° |
| C03 | C04 | C05 | H6 | 179.3° | 179.5° |
| C05 | C04 | C03 | N01 | 1.3° | 0.7° |
| C04 | C05 | C01 | H6 | 180.0° | 180.0° |
| C04 | C05 | C01 | C02 | 0.0° | 0.0° |
| C04 | C05 | C01 | C21 | 179.8° | 179.8° |
| C03 | N01 | C02 | C01 | 0.6° | 0.0° |
| C03 | N01 | C02 | H4 | 179.4° | 180.0° |
| N01 | C03 | C04 | H5 | 178.7° | 180.0° |
| C05 | C01 | C02 | N01 | 0.1° | 0.2° |
| C05 | C01 | C02 | C21 | 179.8° | 179.8° |
| C05 | C01 | C21 | F03 | 102.2° | 60.2° |
| C05 | C01 | C21 | F02 | 18.6° | 179.8° |
| C05 | C01 | C21 | F01 | 138.3° | 59.8° |
| C05 | C01 | C02 | H4 | 180.0° | 179.8° |
| C01 | C05 | C04 | H5 | 179.4° | 179.8° |
| N01 | C02 | C01 | H4 | 180.0° | 180.0° |
| N01 | C02 | C01 | C21 | 179.9° | 180.0° |
| C02 | C01 | C21 | F03 | 78.0° | 120.0° |
| C02 | C01 | C21 | F02 | 161.2° | 0.1° |
| C02 | C01 | C21 | F01 | 41.5° | 120.1° |
| C02 | C01 | C05 | H6 | 180.0° | 180.0° |
| C01 | C21 | F03 | F02 | 120.7° | 120.1° |
| C01 | C21 | F03 | F01 | 119.5° | 119.9° |
| C01 | C21 | F02 | F01 | 119.7° | 120.0° |
| C21 | C01 | C02 | H4 | 0.1° | 0.0° |
| C21 | C01 | C05 | H6 | 0.2° | 0.2° |
| F03 | C21 | F02 | F01 | 119.7° | 120.0° |
| H1 | C10 | C11 | H2 | 0.2° | 66.5° |
| H1 | C10 | C11 | H21 | 117.0° | 53.5° |
| H2 | C11 | C10 | H20 | 116.6° | 54.0° |
| H3 | C12 | C13 | H13 | 0.5° | 174.2° |
| H3 | C12 | C13 | H23 | 116.5° | 53.6° |
| H5 | C04 | C05 | H6 | 0.6° | 0.2° |
| H7 | C08 | H8 | H9 | 120.0° | 120.0° |
| H10 | C09 | H11 | H12 | 120.0° | 120.0° |
| H13 | C13 | C12 | H22 | 117.2° | 54.1° |
| H16 | C16 | C17 | H17 | 0.2° | 0.1° |
| H18 | C19 | C20 | H19 | 0.1° | 0.3° |
| H20 | C10 | C11 | H21 | 0.3° | 174.1° |
| H22 | C12 | C13 | H23 | 0.3° | 66.5° |
