1WI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O01 | C01 | doub | 1.22Å | 1.23Å | |
| C01 | N01 | sing | 1.35Å | 1.38Å | |
| C01 | C08 | sing | 1.47Å | 1.46Å | |
| C07 | C08 | doub | 1.39Å | 1.40Å | Aromatic |
| C07 | C06 | sing | 1.38Å | 1.38Å | Aromatic |
| N01 | C02 | sing | 1.34Å | 1.38Å | |
| C08 | C03 | sing | 1.41Å | 1.40Å | Aromatic |
| C06 | C05 | doub | 1.39Å | 1.40Å | Aromatic |
| O04 | C19 | doub | 1.21Å | 1.23Å | |
| C23 | C22 | sing | 1.53Å | 1.53Å | |
| C02 | O02 | doub | 1.22Å | 1.22Å | |
| C02 | N02 | sing | 1.34Å | 1.38Å | |
| O03 | C16 | doub | 1.21Å | 1.23Å | |
| C03 | N02 | sing | 1.39Å | 1.40Å | |
| C03 | C04 | doub | 1.39Å | 1.40Å | Aromatic |
| C19 | C20 | sing | 1.51Å | 1.53Å | |
| C19 | N04 | sing | 1.33Å | 1.34Å | |
| C20 | N03 | sing | 1.47Å | 1.45Å | |
| C05 | C04 | sing | 1.38Å | 1.39Å | Aromatic |
| N02 | C09 | sing | 1.47Å | 1.47Å | |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C16 | N03 | sing | 1.35Å | 1.35Å | |
| C16 | C14 | sing | 1.48Å | 1.50Å | |
| N04 | C21 | sing | 1.46Å | 1.48Å | |
| N04 | C18 | sing | 1.46Å | 1.46Å | |
| C21 | C24 | sing | 1.53Å | 1.53Å | |
| N03 | C17 | sing | 1.47Å | 1.46Å | |
| C15 | C14 | doub | 1.40Å | 1.39Å | Aromatic |
| C15 | C10 | sing | 1.38Å | 1.39Å | Aromatic |
| C09 | C10 | sing | 1.51Å | 1.51Å | |
| C14 | C13 | sing | 1.40Å | 1.39Å | Aromatic |
| C18 | C17 | sing | 1.53Å | 1.51Å | |
| C10 | C11 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C25 | sing | 1.53Å | 1.52Å | |
| C13 | F01 | sing | 1.35Å | 1.35Å | |
| C13 | C12 | doub | 1.38Å | 1.38Å | Aromatic |
| C11 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | H1 | sing | 1.08Å | 1.08Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C17 | H3 | sing | 1.09Å | 1.10Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C21 | H6 | sing | 1.09Å | 1.10Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C24 | H10 | sing | 1.09Å | 1.10Å | |
| C04 | H11 | sing | 1.08Å | 1.08Å | |
| C05 | H12 | sing | 1.08Å | 1.08Å | |
| C06 | H13 | sing | 1.08Å | 1.08Å | |
| C07 | H14 | sing | 1.08Å | 1.08Å | |
| C09 | H15 | sing | 1.09Å | 1.10Å | |
| C09 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.08Å | 1.08Å | |
| C12 | H18 | sing | 1.08Å | 1.08Å | |
| C18 | H19 | sing | 1.09Å | 1.10Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| N01 | H27 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O01 | C01 | N01 | 121.0° | 120.8° |
| O01 | C01 | C08 | 125.0° | 120.9° |
| N01 | C01 | C08 | 113.9° | 118.3° |
| C01 | N01 | C02 | 128.1° | 121.2° |
| C01 | N01 | H27 | 116.0° | 119.4° |
| C01 | C08 | C07 | 119.2° | 121.8° |
| C01 | C08 | C03 | 119.9° | 118.3° |
| C08 | C07 | C06 | 120.2° | 119.5° |
| C07 | C08 | C03 | 120.9° | 120.0° |
| C08 | C07 | H14 | 119.9° | 120.2° |
| C07 | C06 | C05 | 118.9° | 120.5° |
| C07 | C06 | H13 | 120.5° | 119.7° |
| C06 | C07 | H14 | 119.9° | 120.3° |
| N01 | C02 | O02 | 120.2° | 118.6° |
| N01 | C02 | N02 | 116.0° | 122.8° |
| C02 | N01 | H27 | 116.0° | 119.4° |
| C08 | C03 | N02 | 120.2° | 118.7° |
| C08 | C03 | C04 | 118.7° | 119.7° |
| C06 | C05 | C04 | 121.7° | 120.6° |
| C06 | C05 | H12 | 119.1° | 119.7° |
| C05 | C06 | H13 | 120.5° | 119.8° |
| O04 | C19 | C20 | 117.6° | 118.5° |
| O04 | C19 | N04 | 122.9° | 118.4° |
| C23 | C22 | C21 | 113.1° | 109.4° |
| C23 | C22 | H7 | 108.6° | 109.5° |
| C23 | C22 | H8 | 108.6° | 109.5° |
| C22 | C23 | H21 | 109.5° | 109.5° |
| C22 | C23 | H22 | 109.5° | 109.5° |
| C22 | C23 | H23 | 109.4° | 109.4° |
| O02 | C02 | N02 | 123.8° | 118.6° |
| C02 | N02 | C03 | 121.8° | 120.7° |
| C02 | N02 | C09 | 117.7° | 119.7° |
| O03 | C16 | N03 | 120.6° | 120.0° |
| O03 | C16 | C14 | 117.1° | 120.0° |
| N02 | C03 | C04 | 121.0° | 121.6° |
| C03 | N02 | C09 | 120.4° | 119.7° |
| C03 | C04 | C05 | 119.6° | 119.8° |
| C03 | C04 | H11 | 120.2° | 120.1° |
| C20 | C19 | N04 | 119.5° | 123.0° |
| C19 | C20 | N03 | 115.6° | 108.9° |
| C19 | C20 | H4 | 107.9° | 109.5° |
| C19 | C20 | H5 | 107.9° | 109.6° |
| C19 | N04 | C21 | 121.1° | 117.7° |
| C19 | N04 | C18 | 123.3° | 124.6° |
| C20 | N03 | C16 | 123.7° | 121.4° |
| C20 | N03 | C17 | 113.0° | 117.3° |
| N03 | C20 | H4 | 107.9° | 109.6° |
| N03 | C20 | H5 | 107.9° | 109.6° |
| C05 | C04 | H11 | 120.2° | 120.1° |
| C04 | C05 | H12 | 119.1° | 119.7° |
| N02 | C09 | C10 | 114.8° | 109.4° |
| N02 | C09 | H15 | 108.1° | 109.4° |
| N02 | C09 | H16 | 108.1° | 109.4° |
| C22 | C21 | N04 | 113.8° | 109.5° |
| C22 | C21 | C24 | 114.5° | 109.4° |
| C22 | C21 | H6 | 105.7° | 109.5° |
| C21 | C22 | H7 | 108.5° | 109.4° |
| C21 | C22 | H8 | 108.5° | 109.5° |
| N03 | C16 | C14 | 122.3° | 120.0° |
| C16 | N03 | C17 | 123.3° | 121.3° |
| C16 | C14 | C15 | 119.0° | 120.2° |
| C16 | C14 | C13 | 123.3° | 120.2° |
| C21 | N04 | C18 | 115.6° | 117.7° |
| N04 | C21 | C24 | 109.9° | 109.5° |
| N04 | C21 | H6 | 106.4° | 109.5° |
| N04 | C18 | C17 | 111.0° | 110.8° |
| N04 | C18 | H19 | 109.1° | 109.2° |
| N04 | C18 | H20 | 109.1° | 109.2° |
| C21 | C24 | C25 | 113.3° | 109.4° |
| C24 | C21 | H6 | 105.8° | 109.4° |
| C21 | C24 | H9 | 108.5° | 109.5° |
| C21 | C24 | H10 | 108.5° | 109.5° |
| N03 | C17 | C18 | 111.0° | 108.2° |
| N03 | C17 | H2 | 109.1° | 109.7° |
| N03 | C17 | H3 | 109.1° | 109.7° |
| C14 | C15 | C10 | 121.8° | 119.8° |
| C15 | C14 | C13 | 117.7° | 119.7° |
| C14 | C15 | H1 | 119.1° | 120.0° |
| C15 | C10 | C09 | 119.1° | 119.9° |
| C15 | C10 | C11 | 118.9° | 120.2° |
| C10 | C15 | H1 | 119.1° | 120.1° |
| C09 | C10 | C11 | 122.0° | 119.9° |
| C10 | C09 | H15 | 108.2° | 109.5° |
| C10 | C09 | H16 | 108.1° | 109.5° |
| C14 | C13 | F01 | 119.5° | 120.1° |
| C14 | C13 | C12 | 122.1° | 119.8° |
| C18 | C17 | H2 | 109.1° | 109.8° |
| C18 | C17 | H3 | 109.1° | 109.7° |
| C17 | C18 | H19 | 109.1° | 109.2° |
| C17 | C18 | H20 | 109.1° | 109.2° |
| C10 | C11 | C12 | 120.6° | 120.3° |
| C10 | C11 | H17 | 119.7° | 119.8° |
| C25 | C24 | H9 | 108.5° | 109.5° |
| C25 | C24 | H10 | 108.5° | 109.5° |
| C24 | C25 | H24 | 109.5° | 109.5° |
| C24 | C25 | H25 | 109.5° | 109.5° |
| C24 | C25 | H26 | 109.5° | 109.4° |
| F01 | C13 | C12 | 118.4° | 120.1° |
| C13 | C12 | C11 | 119.0° | 120.1° |
| C13 | C12 | H18 | 120.5° | 120.0° |
| C12 | C11 | H17 | 119.7° | 119.8° |
| C11 | C12 | H18 | 120.5° | 119.9° |
| H2 | C17 | H3 | 109.5° | 109.7° |
| H4 | C20 | H5 | 109.4° | 109.6° |
| H7 | C22 | H8 | 109.5° | 109.5° |
| H9 | C24 | H10 | 109.5° | 109.4° |
| H15 | C09 | H16 | 109.5° | 109.5° |
| H19 | C18 | H20 | 109.5° | 109.2° |
| H21 | C23 | H22 | 109.5° | 109.4° |
| H21 | C23 | H23 | 109.5° | 109.5° |
| H22 | C23 | H23 | 109.5° | 109.4° |
| H24 | C25 | H25 | 109.4° | 109.4° |
| H24 | C25 | H26 | 109.4° | 109.5° |
| H25 | C25 | H26 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O01 | C01 | N01 | C08 | 179.9° | 179.7° |
| O01 | C01 | C08 | C07 | 0.0° | 0.3° |
| O01 | C01 | N01 | C02 | 180.0° | 179.7° |
| O01 | C01 | C08 | C03 | 180.0° | 179.7° |
| O01 | C01 | N01 | H27 | 0.1° | 0.3° |
| N01 | C01 | C08 | C07 | 180.0° | 180.0° |
| C01 | N01 | C02 | H27 | 180.0° | 180.0° |
| N01 | C01 | C08 | C03 | 0.0° | 0.1° |
| C01 | N01 | C02 | O02 | 180.0° | 180.0° |
| C01 | N01 | C02 | N02 | 0.3° | 0.0° |
| C01 | C08 | C07 | C03 | 180.0° | 180.0° |
| C01 | C08 | C07 | C06 | 180.0° | 180.0° |
| C08 | C01 | N01 | C02 | 0.1° | 0.0° |
| C01 | C08 | C03 | N02 | 0.1° | 0.1° |
| C01 | C08 | C03 | C04 | 179.9° | 180.0° |
| C01 | C08 | C07 | H14 | 0.1° | 0.0° |
| C08 | C01 | N01 | H27 | 179.9° | 180.0° |
| C08 | C07 | C06 | H14 | 180.0° | 180.0° |
| C08 | C07 | C06 | C05 | 0.0° | 0.0° |
| C07 | C08 | C03 | N02 | 179.9° | 179.9° |
| C07 | C08 | C03 | C04 | 0.1° | 0.0° |
| C08 | C07 | C06 | H13 | 180.0° | 180.0° |
| C06 | C07 | C08 | C03 | 0.0° | 0.0° |
| C07 | C06 | C05 | H13 | 180.0° | 180.0° |
| C07 | C06 | C05 | C04 | 0.1° | 0.0° |
| C07 | C06 | C05 | H12 | 179.9° | 180.0° |
| N01 | C02 | O02 | N02 | 179.6° | 180.0° |
| N01 | C02 | N02 | C03 | 0.4° | 0.1° |
| N01 | C02 | N02 | C09 | 179.8° | 180.0° |
| C08 | C03 | N02 | C02 | 0.3° | 0.1° |
| C08 | C03 | N02 | C04 | 180.0° | 180.0° |
| C08 | C03 | C04 | C05 | 0.2° | 0.0° |
| C08 | C03 | N02 | C09 | 179.7° | 180.0° |
| C08 | C03 | C04 | H11 | 179.8° | 179.9° |
| C03 | C08 | C07 | H14 | 179.9° | 180.0° |
| C06 | C05 | C04 | C03 | 0.2° | 0.0° |
| C06 | C05 | C04 | H12 | 180.0° | 179.9° |
| C06 | C05 | C04 | H11 | 179.8° | 179.9° |
| C05 | C06 | C07 | H14 | 179.9° | 180.0° |
| O04 | C19 | C20 | N04 | 179.8° | 179.9° |
| O04 | C19 | C20 | N03 | 174.5° | 167.3° |
| O04 | C19 | N04 | C21 | 0.1° | 4.2° |
| O04 | C19 | N04 | C18 | 179.9° | 175.7° |
| O04 | C19 | C20 | H4 | 53.6° | 72.9° |
| O04 | C19 | C20 | H5 | 64.6° | 47.4° |
| C23 | C22 | C21 | H7 | 120.6° | 120.0° |
| C23 | C22 | C21 | H8 | 120.6° | 120.0° |
| C23 | C22 | C21 | N04 | 47.5° | 65.0° |
| C23 | C22 | C21 | C24 | 175.0° | 175.0° |
| C23 | C22 | C21 | H6 | 69.0° | 55.1° |
| C23 | C22 | H7 | H8 | 118.4° | 120.1° |
| C22 | C23 | H21 | H22 | 120.0° | 120.1° |
| C22 | C23 | H21 | H23 | 120.0° | 120.0° |
| C22 | C23 | H22 | H23 | 119.9° | 120.0° |
| O02 | C02 | N02 | C03 | 180.0° | 180.0° |
| O02 | C02 | N02 | C09 | 0.6° | 0.0° |
| O02 | C02 | N01 | H27 | 0.0° | 0.0° |
| C02 | N02 | C03 | C09 | 179.4° | 179.9° |
| C02 | N02 | C03 | C04 | 179.7° | 180.0° |
| C02 | N02 | C09 | C10 | 92.5° | 90.0° |
| C02 | N02 | C09 | H15 | 28.3° | 30.0° |
| C02 | N02 | C09 | H16 | 146.8° | 150.0° |
| N02 | C02 | N01 | H27 | 179.7° | 180.0° |
| O03 | C16 | N03 | C20 | 1.5° | 175.8° |
| O03 | C16 | N03 | C14 | 177.9° | 180.0° |
| O03 | C16 | N03 | C17 | 180.0° | 4.3° |
| O03 | C16 | C14 | C15 | 59.4° | 129.7° |
| O03 | C16 | C14 | C13 | 119.2° | 50.2° |
| N02 | C03 | C04 | C05 | 179.8° | 180.0° |
| C03 | N02 | C09 | C10 | 88.1° | 89.9° |
| N02 | C03 | C04 | H11 | 0.2° | 0.0° |
| C03 | N02 | C09 | H15 | 151.1° | 150.1° |
| C03 | N02 | C09 | H16 | 32.6° | 30.1° |
| C03 | C04 | C05 | H11 | 180.0° | 179.9° |
| C04 | C03 | N02 | C09 | 0.3° | 0.0° |
| C03 | C04 | C05 | H12 | 179.8° | 180.0° |
| C19 | C20 | N03 | H4 | 120.9° | 119.8° |
| C19 | C20 | N03 | H5 | 120.9° | 120.0° |
| C19 | C20 | N03 | C16 | 146.0° | 137.2° |
| C20 | C19 | N04 | C21 | 179.7° | 175.7° |
| C20 | C19 | N04 | C18 | 0.1° | 4.4° |
| C19 | C20 | N03 | C17 | 35.4° | 42.7° |
| C19 | C20 | H4 | H5 | 117.2° | 120.3° |
| N04 | C19 | C20 | N03 | 5.7° | 12.7° |
| C19 | N04 | C21 | C22 | 114.7° | 60.0° |
| C19 | N04 | C21 | C18 | 179.8° | 179.9° |
| C19 | N04 | C21 | C24 | 115.4° | 60.0° |
| C19 | N04 | C18 | C17 | 22.9° | 21.9° |
| N04 | C19 | C20 | H4 | 126.6° | 107.1° |
| N04 | C19 | C20 | H5 | 115.2° | 132.7° |
| C19 | N04 | C21 | H6 | 1.3° | 180.0° |
| C19 | N04 | C18 | H19 | 143.2° | 142.3° |
| C19 | N04 | C18 | H20 | 97.3° | 98.4° |
| C20 | N03 | C16 | C17 | 178.5° | 179.9° |
| C20 | N03 | C16 | C14 | 179.4° | 4.2° |
| C20 | N03 | C17 | C18 | 59.0° | 61.4° |
| C20 | N03 | C17 | H2 | 179.2° | 178.8° |
| C20 | N03 | C17 | H3 | 61.2° | 58.2° |
| N03 | C20 | H4 | H5 | 117.2° | 120.3° |
| C04 | C05 | C06 | H13 | 179.9° | 180.0° |
| N02 | C09 | C10 | C15 | 33.9° | 90.3° |
| N02 | C09 | C10 | H15 | 120.8° | 119.9° |
| N02 | C09 | C10 | H16 | 120.8° | 119.9° |
| N02 | C09 | C10 | C11 | 146.4° | 90.0° |
| N02 | C09 | H15 | H16 | 117.6° | 119.9° |
| C22 | C21 | N04 | C24 | 129.8° | 120.0° |
| C22 | C21 | N04 | H6 | 116.0° | 120.1° |
| C22 | C21 | N04 | C18 | 65.5° | 120.0° |
| C22 | C21 | C24 | H6 | 116.0° | 120.0° |
| C22 | C21 | C24 | C25 | 169.5° | 175.0° |
| C21 | C22 | H7 | H8 | 118.3° | 120.0° |
| C22 | C21 | C24 | H9 | 49.0° | 55.0° |
| C22 | C21 | C24 | H10 | 69.9° | 65.0° |
| C21 | C22 | C23 | H21 | 180.0° | 60.0° |
| C21 | C22 | C23 | H22 | 60.0° | 60.0° |
| C21 | C22 | C23 | H23 | 60.0° | 180.0° |
| N03 | C16 | C14 | C15 | 118.5° | 50.4° |
| N03 | C16 | C14 | C13 | 62.8° | 129.7° |
| C16 | N03 | C17 | C18 | 122.4° | 118.5° |
| C16 | N03 | C17 | H2 | 2.1° | 1.2° |
| C16 | N03 | C17 | H3 | 117.4° | 121.9° |
| C16 | N03 | C20 | H4 | 25.1° | 103.0° |
| C16 | N03 | C20 | H5 | 93.1° | 17.3° |
| C14 | C16 | N03 | C17 | 2.1° | 175.7° |
| C16 | C14 | C15 | C13 | 178.7° | 179.9° |
| C16 | C14 | C15 | C10 | 179.5° | 179.9° |
| C16 | C14 | C13 | F01 | 0.8° | 0.1° |
| C16 | C14 | C13 | C12 | 179.6° | 180.0° |
| C16 | C14 | C15 | H1 | 0.5° | 0.1° |
| N04 | C21 | C24 | H6 | 114.5° | 120.0° |
| C21 | N04 | C18 | C17 | 156.9° | 158.2° |
| N04 | C21 | C24 | C25 | 61.0° | 65.0° |
| N04 | C21 | C22 | H7 | 168.0° | 55.0° |
| N04 | C21 | C22 | H8 | 73.1° | 175.0° |
| N04 | C21 | C24 | H9 | 178.4° | 175.0° |
| N04 | C21 | C24 | H10 | 59.6° | 55.0° |
| C21 | N04 | C18 | H19 | 36.6° | 37.8° |
| C21 | N04 | C18 | H20 | 82.9° | 81.5° |
| C18 | N04 | C21 | C24 | 64.4° | 120.1° |
| N04 | C18 | C17 | N03 | 51.6° | 46.7° |
| N04 | C18 | C17 | H19 | 120.2° | 120.4° |
| N04 | C18 | C17 | H20 | 120.2° | 120.3° |
| N04 | C18 | C17 | H2 | 171.8° | 166.4° |
| N04 | C18 | C17 | H3 | 68.6° | 73.0° |
| C18 | N04 | C21 | H6 | 178.5° | 0.1° |
| N04 | C18 | H19 | H20 | 119.3° | 119.3° |
| C21 | C24 | C25 | H9 | 120.6° | 120.0° |
| C21 | C24 | C25 | H10 | 120.6° | 120.0° |
| C24 | C21 | C22 | H7 | 64.5° | 65.0° |
| C24 | C21 | C22 | H8 | 54.4° | 55.0° |
| C21 | C24 | H9 | H10 | 118.2° | 120.0° |
| C21 | C24 | C25 | H24 | 180.0° | 60.0° |
| C21 | C24 | C25 | H25 | 60.0° | 180.0° |
| C21 | C24 | C25 | H26 | 60.0° | 60.0° |
| N03 | C17 | C18 | H2 | 120.2° | 119.7° |
| N03 | C17 | C18 | H3 | 120.2° | 119.6° |
| N03 | C17 | H2 | H3 | 119.3° | 120.6° |
| C17 | N03 | C20 | H4 | 156.3° | 77.1° |
| C17 | N03 | C20 | H5 | 85.5° | 162.7° |
| N03 | C17 | C18 | H19 | 171.8° | 167.0° |
| N03 | C17 | C18 | H20 | 68.7° | 73.6° |
| C14 | C15 | C10 | H1 | 180.0° | 180.0° |
| C14 | C15 | C10 | C09 | 179.4° | 179.7° |
| C14 | C15 | C10 | C11 | 0.3° | 0.0° |
| C15 | C14 | C13 | F01 | 179.5° | 180.0° |
| C15 | C14 | C13 | C12 | 0.9° | 0.1° |
| C15 | C10 | C09 | C11 | 179.7° | 179.7° |
| C10 | C15 | C14 | C13 | 0.8° | 0.0° |
| C15 | C10 | C11 | C12 | 0.1° | 0.0° |
| C15 | C10 | C09 | H15 | 86.9° | 29.6° |
| C15 | C10 | C09 | H16 | 154.7° | 149.8° |
| C15 | C10 | C11 | H17 | 179.9° | 180.0° |
| C09 | C10 | C11 | C12 | 179.8° | 179.6° |
| C09 | C10 | C15 | H1 | 0.6° | 0.3° |
| C10 | C09 | H15 | H16 | 117.6° | 120.1° |
| C09 | C10 | C11 | H17 | 0.1° | 0.3° |
| C14 | C13 | F01 | C12 | 179.6° | 180.0° |
| C14 | C13 | C12 | C11 | 0.5° | 0.1° |
| C13 | C14 | C15 | H1 | 179.2° | 180.0° |
| C14 | C13 | C12 | H18 | 179.5° | 180.0° |
| C18 | C17 | H2 | H3 | 119.3° | 120.6° |
| C17 | C18 | H19 | H20 | 119.3° | 119.3° |
| C10 | C11 | C12 | C13 | 0.0° | 0.1° |
| C10 | C11 | C12 | H17 | 180.0° | 180.0° |
| C11 | C10 | C15 | H1 | 179.7° | 180.0° |
| C11 | C10 | C09 | H15 | 92.9° | 150.0° |
| C11 | C10 | C09 | H16 | 25.6° | 29.9° |
| C10 | C11 | C12 | H18 | 180.0° | 180.0° |
| C25 | C24 | C21 | H6 | 53.5° | 55.0° |
| C25 | C24 | H9 | H10 | 118.2° | 120.0° |
| C24 | C25 | H24 | H25 | 120.0° | 120.0° |
| C24 | C25 | H24 | H26 | 120.0° | 120.0° |
| C24 | C25 | H25 | H26 | 120.0° | 120.0° |
| F01 | C13 | C12 | C11 | 179.9° | 180.0° |
| F01 | C13 | C12 | H18 | 0.1° | 0.0° |
| C13 | C12 | C11 | H18 | 180.0° | 180.0° |
| C13 | C12 | C11 | H17 | 180.0° | 180.0° |
| H2 | C17 | C18 | H19 | 68.0° | 73.2° |
| H2 | C17 | C18 | H20 | 51.6° | 46.1° |
| H3 | C17 | C18 | H19 | 51.6° | 47.4° |
| H3 | C17 | C18 | H20 | 171.1° | 166.8° |
| H6 | C21 | C22 | H7 | 51.6° | 175.1° |
| H6 | C21 | C22 | H8 | 170.5° | 65.0° |
| H6 | C21 | C24 | H9 | 67.0° | 65.0° |
| H6 | C21 | C24 | H10 | 174.1° | 175.0° |
| H7 | C22 | C23 | H21 | 59.5° | 180.0° |
| H7 | C22 | C23 | H22 | 60.6° | 59.9° |
| H7 | C22 | C23 | H23 | 179.5° | 60.0° |
| H8 | C22 | C23 | H21 | 59.5° | 60.0° |
| H8 | C22 | C23 | H22 | 179.5° | 180.0° |
| H8 | C22 | C23 | H23 | 60.5° | 60.1° |
| H9 | C24 | C25 | H24 | 59.4° | 60.0° |
| H9 | C24 | C25 | H25 | 179.5° | 60.0° |
| H9 | C24 | C25 | H26 | 60.6° | 180.0° |
| H10 | C24 | C25 | H24 | 59.4° | 179.9° |
| H10 | C24 | C25 | H25 | 60.6° | 60.0° |
| H10 | C24 | C25 | H26 | 179.4° | 60.0° |
| H11 | C04 | C05 | H12 | 0.2° | 0.0° |
| H12 | C05 | C06 | H13 | 0.1° | 0.0° |
| H13 | C06 | C07 | H14 | 0.1° | 0.0° |
| H17 | C11 | C12 | H18 | 0.0° | 0.0° |
| H21 | C23 | H22 | H23 | 120.0° | 120.0° |
| H24 | C25 | H25 | H26 | 119.9° | 120.1° |
