1UI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C25 | sing | 1.53Å | 1.50Å | |
| C24 | C23 | sing | 1.53Å | 1.50Å | |
| C25 | C23 | sing | 1.53Å | 1.50Å | |
| C23 | C21 | sing | 1.53Å | 1.57Å | |
| C21 | C22 | sing | 1.47Å | 1.47Å | |
| C21 | C20 | sing | 1.55Å | 1.55Å | |
| C21 | C26 | sing | 1.51Å | 1.50Å | |
| C22 | N4 | trip | 1.14Å | 1.14Å | |
| C20 | C19 | sing | 1.55Å | 1.52Å | |
| C19 | N3 | sing | 1.47Å | 1.47Å | |
| C26 | N3 | sing | 1.34Å | 1.36Å | |
| C26 | O2 | doub | 1.21Å | 1.21Å | |
| N3 | C15 | sing | 1.39Å | 1.43Å | |
| C15 | C14 | doub | 1.39Å | 1.38Å | Aromatic |
| C15 | C16 | sing | 1.39Å | 1.40Å | Aromatic |
| C14 | C13 | sing | 1.39Å | 1.38Å | Aromatic |
| O1 | C12 | doub | 1.22Å | 1.22Å | |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C12 | sing | 1.48Å | 1.50Å | |
| C13 | N2 | doub | 1.33Å | 1.34Å | Aromatic |
| C12 | N1 | sing | 1.35Å | 1.33Å | |
| N1 | C11 | sing | 1.46Å | 1.45Å | |
| C17 | N2 | sing | 1.32Å | 1.35Å | Aromatic |
| C17 | C18 | sing | 1.51Å | 1.50Å | |
| C11 | C10 | sing | 1.51Å | 1.51Å | |
| C10 | C27 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | C9 | sing | 1.38Å | 1.39Å | Aromatic |
| C27 | C6 | sing | 1.39Å | 1.39Å | Aromatic |
| C9 | C8 | doub | 1.39Å | 1.37Å | Aromatic |
| C3 | N | doub | 1.32Å | 1.34Å | Aromatic |
| C3 | C4 | sing | 1.39Å | 1.39Å | Aromatic |
| N | C2 | sing | 1.32Å | 1.34Å | Aromatic |
| C6 | C4 | sing | 1.48Å | 1.49Å | |
| C6 | C7 | doub | 1.39Å | 1.39Å | Aromatic |
| C8 | C7 | sing | 1.38Å | 1.37Å | Aromatic |
| C8 | F | sing | 1.35Å | 1.36Å | |
| C4 | C5 | doub | 1.40Å | 1.39Å | Aromatic |
| C2 | C1 | doub | 1.39Å | 1.38Å | Aromatic |
| C5 | C1 | sing | 1.39Å | 1.38Å | Aromatic |
| C1 | O | sing | 1.36Å | 1.37Å | |
| O | C | sing | 1.43Å | 1.43Å | |
| C24 | H1 | sing | 1.09Å | 1.10Å | |
| C24 | H2 | sing | 1.09Å | 1.10Å | |
| C23 | H3 | sing | 1.09Å | 1.10Å | |
| C5 | H4 | sing | 1.08Å | 1.08Å | |
| C2 | H5 | sing | 1.08Å | 1.08Å | |
| C | H6 | sing | 1.09Å | 1.10Å | |
| C | H7 | sing | 1.09Å | 1.10Å | |
| C | H8 | sing | 1.09Å | 1.10Å | |
| N1 | H9 | sing | 0.97Å | 1.00Å | |
| C3 | H10 | sing | 1.08Å | 1.08Å | |
| C7 | H11 | sing | 1.08Å | 1.08Å | |
| C25 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C27 | H14 | sing | 1.08Å | 1.08Å | |
| C9 | H15 | sing | 1.08Å | 1.08Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| C11 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.08Å | 1.08Å | |
| C16 | H19 | sing | 1.08Å | 1.08Å | |
| C18 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| C18 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C20 | H26 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C25 | C24 | C23 | 59.8° | 60.0° |
| C24 | C25 | C23 | 60.3° | 60.0° |
| C25 | C24 | H1 | 120.0° | 117.5° |
| C25 | C24 | H2 | 120.0° | 117.5° |
| C24 | C25 | H12 | 119.9° | 117.5° |
| C24 | C25 | H13 | 119.9° | 117.5° |
| C24 | C23 | C25 | 59.9° | 60.0° |
| C24 | C23 | C21 | 123.9° | 117.5° |
| C23 | C24 | H1 | 120.0° | 117.5° |
| C23 | C24 | H2 | 120.0° | 117.5° |
| C24 | C23 | H3 | 114.1° | 117.5° |
| C25 | C23 | C21 | 121.7° | 117.5° |
| C25 | C23 | H3 | 114.2° | 117.5° |
| C23 | C25 | H12 | 119.9° | 117.5° |
| C23 | C25 | H13 | 119.9° | 117.5° |
| C23 | C21 | C22 | 118.2° | 110.4° |
| C23 | C21 | C20 | 111.2° | 110.5° |
| C23 | C21 | C26 | 102.0° | 110.5° |
| C21 | C23 | H3 | 113.0° | 115.6° |
| C22 | C21 | C20 | 109.7° | 110.6° |
| C22 | C21 | C26 | 112.1° | 110.5° |
| C21 | C22 | N4 | 176.5° | 179.9° |
| C20 | C21 | C26 | 102.4° | 104.2° |
| C21 | C20 | C19 | 102.8° | 101.7° |
| C21 | C20 | H25 | 111.1° | 111.3° |
| C21 | C20 | H26 | 111.1° | 110.7° |
| C21 | C26 | N3 | 107.7° | 110.2° |
| C21 | C26 | O2 | 126.4° | 125.0° |
| C20 | C19 | N3 | 103.5° | 105.4° |
| C20 | C19 | H23 | 110.9° | 110.6° |
| C20 | C19 | H24 | 110.9° | 110.1° |
| C19 | C20 | H25 | 111.1° | 111.0° |
| C19 | C20 | H26 | 111.1° | 111.0° |
| C19 | N3 | C26 | 112.6° | 111.3° |
| C19 | N3 | C15 | 119.0° | 124.3° |
| N3 | C19 | H23 | 110.9° | 110.3° |
| N3 | C19 | H24 | 111.0° | 110.2° |
| N3 | C26 | O2 | 125.8° | 124.9° |
| C26 | N3 | C15 | 128.3° | 124.4° |
| N3 | C15 | C14 | 118.9° | 120.9° |
| N3 | C15 | C16 | 122.1° | 120.8° |
| C14 | C15 | C16 | 119.0° | 118.3° |
| C15 | C14 | C13 | 118.4° | 118.9° |
| C15 | C14 | H18 | 120.8° | 120.5° |
| C15 | C16 | C17 | 118.9° | 119.3° |
| C15 | C16 | H19 | 120.5° | 120.3° |
| C14 | C13 | C12 | 118.2° | 119.7° |
| C14 | C13 | N2 | 123.5° | 120.6° |
| C13 | C14 | H18 | 120.8° | 120.6° |
| O1 | C12 | C13 | 121.1° | 120.0° |
| O1 | C12 | N1 | 122.7° | 120.0° |
| C16 | C17 | N2 | 121.8° | 121.0° |
| C16 | C17 | C18 | 121.7° | 119.5° |
| C17 | C16 | H19 | 120.6° | 120.4° |
| C12 | C13 | N2 | 118.3° | 119.7° |
| C13 | C12 | N1 | 116.2° | 120.0° |
| C13 | N2 | C17 | 118.3° | 121.9° |
| C12 | N1 | C11 | 119.6° | 120.0° |
| C12 | N1 | H9 | 120.2° | 120.0° |
| N1 | C11 | C10 | 112.0° | 109.5° |
| C11 | N1 | H9 | 120.2° | 120.0° |
| N1 | C11 | H16 | 108.8° | 109.5° |
| N1 | C11 | H17 | 108.8° | 109.5° |
| N2 | C17 | C18 | 116.4° | 119.5° |
| C17 | C18 | H20 | 109.5° | 109.5° |
| C17 | C18 | H21 | 109.5° | 109.5° |
| C17 | C18 | H22 | 109.5° | 109.5° |
| C11 | C10 | C27 | 120.8° | 119.9° |
| C11 | C10 | C9 | 120.4° | 120.0° |
| C10 | C11 | H16 | 108.8° | 109.5° |
| C10 | C11 | H17 | 108.8° | 109.4° |
| C27 | C10 | C9 | 118.9° | 120.1° |
| C10 | C27 | C6 | 121.9° | 120.0° |
| C10 | C27 | H14 | 119.1° | 120.0° |
| C10 | C9 | C8 | 118.4° | 120.2° |
| C10 | C9 | H15 | 120.8° | 119.9° |
| C27 | C6 | C4 | 121.3° | 120.1° |
| C27 | C6 | C7 | 118.7° | 119.8° |
| C6 | C27 | H14 | 119.0° | 120.0° |
| C9 | C8 | C7 | 123.9° | 120.1° |
| C9 | C8 | F | 118.3° | 119.9° |
| C8 | C9 | H15 | 120.8° | 119.9° |
| N | C3 | C4 | 124.0° | 120.7° |
| C3 | N | C2 | 117.8° | 121.9° |
| N | C3 | H10 | 118.0° | 119.6° |
| C3 | C4 | C6 | 122.0° | 120.5° |
| C3 | C4 | C5 | 117.0° | 119.0° |
| C4 | C3 | H10 | 118.0° | 119.7° |
| N | C2 | C1 | 122.7° | 120.9° |
| N | C2 | H5 | 118.7° | 119.6° |
| C4 | C6 | C7 | 119.9° | 120.1° |
| C6 | C4 | C5 | 120.9° | 120.5° |
| C6 | C7 | C8 | 118.2° | 119.8° |
| C6 | C7 | H11 | 120.9° | 120.1° |
| C7 | C8 | F | 117.8° | 120.0° |
| C8 | C7 | H11 | 120.9° | 120.0° |
| C4 | C5 | C1 | 119.6° | 118.2° |
| C4 | C5 | H4 | 120.2° | 120.9° |
| C2 | C1 | C5 | 118.9° | 119.2° |
| C2 | C1 | O | 123.3° | 120.4° |
| C1 | C2 | H5 | 118.6° | 119.5° |
| C5 | C1 | O | 117.7° | 120.4° |
| C1 | C5 | H4 | 120.2° | 120.9° |
| C1 | O | C | 117.6° | 117.0° |
| O | C | H6 | 109.5° | 109.5° |
| O | C | H7 | 109.4° | 109.4° |
| O | C | H8 | 109.5° | 109.5° |
| H1 | C24 | H2 | 109.5° | 115.5° |
| H6 | C | H7 | 109.5° | 109.5° |
| H6 | C | H8 | 109.5° | 109.5° |
| H7 | C | H8 | 109.5° | 109.5° |
| H12 | C25 | H13 | 109.5° | 115.5° |
| H16 | C11 | H17 | 109.5° | 109.5° |
| H20 | C18 | H21 | 109.5° | 109.5° |
| H20 | C18 | H22 | 109.4° | 109.4° |
| H21 | C18 | H22 | 109.5° | 109.5° |
| H23 | C19 | H24 | 109.5° | 110.3° |
| H25 | C20 | H26 | 109.5° | 110.9° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C25 | C24 | C23 | H1 | 109.4° | 107.5° |
| C25 | C24 | C23 | H2 | 109.4° | 107.5° |
| C24 | C25 | C23 | H12 | 109.5° | 107.5° |
| C24 | C25 | C23 | H13 | 109.5° | 107.5° |
| C25 | C24 | C23 | C21 | 110.1° | 107.5° |
| C25 | C24 | H1 | H2 | 144.8° | 145.7° |
| C25 | C24 | C23 | H3 | 105.1° | 107.5° |
| C24 | C25 | H12 | H13 | 144.6° | 145.7° |
| C24 | C23 | C21 | H3 | 145.2° | 145.7° |
| C24 | C23 | C21 | C22 | 43.7° | 59.3° |
| C24 | C23 | C21 | C20 | 84.5° | 178.0° |
| C24 | C23 | C21 | C26 | 167.0° | 63.2° |
| C23 | C24 | H1 | H2 | 144.8° | 145.7° |
| C25 | C23 | C21 | H3 | 141.9° | 145.7° |
| C25 | C23 | C21 | C22 | 29.2° | 127.9° |
| C25 | C23 | C21 | C20 | 157.3° | 109.4° |
| C25 | C23 | C21 | C26 | 94.2° | 5.4° |
| C23 | C25 | H12 | H13 | 144.6° | 145.7° |
| C23 | C21 | C22 | C20 | 128.8° | 122.7° |
| C23 | C21 | C22 | C26 | 118.1° | 122.5° |
| C23 | C21 | C20 | C26 | 108.3° | 118.7° |
| C23 | C21 | C22 | N4 | 168.9° | 47.1° |
| C23 | C21 | C20 | C19 | 75.6° | 93.7° |
| C23 | C21 | C26 | N3 | 87.9° | 102.4° |
| C23 | C21 | C26 | O2 | 90.5° | 77.9° |
| C21 | C23 | C24 | H1 | 140.5° | 0.0° |
| C21 | C23 | C24 | H2 | 0.6° | 145.0° |
| C21 | C23 | C25 | H12 | 4.0° | 0.0° |
| C21 | C23 | C25 | H13 | 136.9° | 145.0° |
| C23 | C21 | C20 | H25 | 43.4° | 148.1° |
| C23 | C21 | C20 | H26 | 165.5° | 24.3° |
| C22 | C21 | C20 | C26 | 119.2° | 118.7° |
| C22 | C21 | C20 | C19 | 151.9° | 143.7° |
| C22 | C21 | C26 | N3 | 144.8° | 135.0° |
| C22 | C21 | C26 | O2 | 36.9° | 44.7° |
| C22 | C21 | C23 | H3 | 171.1° | 86.4° |
| C22 | C21 | C20 | H25 | 89.2° | 25.4° |
| C22 | C21 | C20 | H26 | 32.9° | 98.3° |
| C20 | C21 | C22 | N4 | 40.1° | 75.5° |
| C21 | C20 | C19 | H25 | 118.9° | 118.5° |
| C21 | C20 | C19 | H26 | 118.9° | 117.8° |
| C21 | C20 | C19 | N3 | 26.6° | 25.8° |
| C20 | C21 | C26 | N3 | 27.3° | 16.3° |
| C20 | C21 | C26 | O2 | 154.4° | 163.4° |
| C20 | C21 | C23 | H3 | 60.7° | 36.3° |
| C21 | C20 | C19 | H23 | 92.4° | 93.4° |
| C21 | C20 | C19 | H24 | 145.7° | 144.6° |
| C21 | C20 | H25 | H26 | 123.0° | 123.7° |
| C26 | C21 | C22 | N4 | 73.0° | 169.7° |
| C26 | C21 | C20 | C19 | 32.7° | 25.0° |
| C21 | C26 | N3 | C19 | 10.8° | 0.7° |
| C21 | C26 | N3 | O2 | 178.4° | 179.7° |
| C21 | C26 | N3 | C15 | 166.2° | 179.4° |
| C26 | C21 | C23 | H3 | 47.8° | 151.1° |
| C26 | C21 | C20 | H25 | 151.6° | 93.2° |
| C26 | C21 | C20 | H26 | 86.3° | 143.0° |
| C20 | C19 | N3 | H23 | 119.0° | 119.4° |
| C20 | C19 | N3 | H24 | 119.1° | 118.7° |
| C20 | C19 | N3 | C26 | 10.8° | 17.4° |
| C20 | C19 | N3 | C15 | 171.9° | 162.6° |
| C20 | C19 | H23 | H24 | 122.7° | 121.9° |
| C19 | C20 | H25 | H26 | 123.1° | 123.8° |
| C19 | N3 | C26 | C15 | 177.0° | 179.9° |
| C19 | N3 | C26 | O2 | 170.8° | 179.6° |
| C19 | N3 | C15 | C14 | 6.1° | 0.0° |
| C19 | N3 | C15 | C16 | 177.1° | 180.0° |
| N3 | C19 | H23 | H24 | 122.8° | 121.9° |
| N3 | C19 | C20 | H25 | 145.5° | 92.7° |
| N3 | C19 | C20 | H26 | 92.3° | 143.6° |
| C26 | N3 | C15 | C14 | 170.7° | 180.0° |
| C26 | N3 | C15 | C16 | 6.0° | 0.1° |
| C26 | N3 | C19 | H23 | 108.3° | 101.9° |
| C26 | N3 | C19 | H24 | 129.8° | 136.1° |
| O2 | C26 | N3 | C15 | 12.2° | 0.3° |
| N3 | C15 | C14 | C16 | 176.8° | 180.0° |
| N3 | C15 | C14 | C13 | 175.9° | 179.9° |
| N3 | C15 | C16 | C17 | 175.5° | 180.0° |
| N3 | C15 | C14 | H18 | 4.1° | 0.0° |
| N3 | C15 | C16 | H19 | 4.5° | 0.1° |
| C15 | N3 | C19 | H23 | 69.0° | 78.0° |
| C15 | N3 | C19 | H24 | 52.9° | 44.0° |
| C15 | C14 | C13 | H18 | 180.0° | 179.9° |
| C14 | C15 | C16 | C17 | 1.2° | 0.0° |
| C15 | C14 | C13 | C12 | 178.8° | 180.0° |
| C15 | C14 | C13 | N2 | 0.5° | 0.0° |
| C14 | C15 | C16 | H19 | 178.8° | 180.0° |
| C16 | C15 | C14 | C13 | 1.0° | 0.0° |
| C15 | C16 | C17 | H19 | 180.0° | 180.0° |
| C15 | C16 | C17 | N2 | 0.1° | 0.0° |
| C15 | C16 | C17 | C18 | 179.8° | 180.0° |
| C16 | C15 | C14 | H18 | 179.0° | 180.0° |
| C14 | C13 | C12 | O1 | 15.5° | 0.0° |
| C14 | C13 | C12 | N2 | 179.4° | 180.0° |
| C14 | C13 | C12 | N1 | 161.4° | 179.9° |
| C14 | C13 | N2 | C17 | 1.8° | 0.0° |
| O1 | C12 | C13 | N1 | 176.9° | 179.9° |
| O1 | C12 | C13 | N2 | 163.9° | 180.0° |
| O1 | C12 | N1 | C11 | 1.0° | 0.1° |
| O1 | C12 | N1 | H9 | 179.1° | 180.0° |
| C16 | C17 | N2 | C13 | 1.5° | 0.0° |
| C16 | C17 | N2 | C18 | 179.9° | 180.0° |
| C16 | C17 | C18 | H20 | 179.9° | 90.0° |
| C16 | C17 | C18 | H21 | 59.9° | 150.0° |
| C16 | C17 | C18 | H22 | 60.1° | 30.0° |
| C13 | C12 | N1 | C11 | 177.8° | 180.0° |
| C12 | C13 | N2 | C17 | 177.6° | 180.0° |
| C13 | C12 | N1 | H9 | 2.2° | 0.1° |
| C12 | C13 | C14 | H18 | 1.2° | 0.0° |
| N2 | C13 | C12 | N1 | 19.2° | 0.1° |
| C13 | N2 | C17 | C18 | 178.4° | 180.0° |
| N2 | C13 | C14 | H18 | 179.5° | 179.9° |
| C12 | N1 | C11 | H9 | 180.0° | 179.9° |
| C12 | N1 | C11 | C10 | 95.9° | 179.9° |
| C12 | N1 | C11 | H16 | 143.7° | 60.1° |
| C12 | N1 | C11 | H17 | 24.4° | 60.0° |
| N1 | C11 | C10 | H16 | 120.4° | 120.0° |
| N1 | C11 | C10 | H17 | 120.4° | 120.0° |
| N1 | C11 | C10 | C27 | 77.0° | 90.0° |
| N1 | C11 | C10 | C9 | 102.5° | 90.1° |
| N1 | C11 | H16 | H17 | 118.8° | 120.1° |
| N2 | C17 | C16 | H19 | 179.9° | 180.0° |
| N2 | C17 | C18 | H20 | 0.0° | 90.0° |
| N2 | C17 | C18 | H21 | 120.0° | 30.0° |
| N2 | C17 | C18 | H22 | 120.0° | 150.0° |
| C18 | C17 | C16 | H19 | 0.2° | 0.0° |
| C17 | C18 | H20 | H21 | 120.0° | 120.0° |
| C17 | C18 | H20 | H22 | 120.0° | 120.0° |
| C17 | C18 | H21 | H22 | 120.0° | 120.0° |
| C11 | C10 | C27 | C9 | 179.5° | 179.9° |
| C11 | C10 | C27 | C6 | 179.7° | 180.0° |
| C11 | C10 | C9 | C8 | 179.0° | 179.7° |
| C10 | C11 | N1 | H9 | 84.1° | 0.0° |
| C11 | C10 | C27 | H14 | 0.2° | 0.0° |
| C11 | C10 | C9 | H15 | 1.0° | 0.0° |
| C10 | C11 | H16 | H17 | 118.8° | 120.0° |
| C10 | C27 | C6 | H14 | 180.0° | 180.0° |
| C27 | C10 | C9 | C8 | 0.5° | 0.2° |
| C10 | C27 | C6 | C4 | 174.3° | 180.0° |
| C10 | C27 | C6 | C7 | 1.8° | 0.3° |
| C27 | C10 | C9 | H15 | 179.5° | 180.0° |
| C27 | C10 | C11 | H16 | 162.6° | 30.0° |
| C27 | C10 | C11 | H17 | 43.4° | 150.0° |
| C9 | C10 | C27 | C6 | 0.8° | 0.0° |
| C10 | C9 | C8 | H15 | 180.0° | 179.8° |
| C10 | C9 | C8 | C7 | 0.8° | 0.2° |
| C10 | C9 | C8 | F | 178.8° | 179.8° |
| C9 | C10 | C27 | H14 | 179.2° | 179.9° |
| C9 | C10 | C11 | H16 | 17.9° | 149.9° |
| C9 | C10 | C11 | H17 | 137.1° | 30.0° |
| C27 | C6 | C4 | C3 | 16.0° | 0.3° |
| C27 | C6 | C4 | C7 | 176.1° | 179.7° |
| C27 | C6 | C7 | C8 | 1.4° | 0.3° |
| C27 | C6 | C4 | C5 | 167.9° | 179.8° |
| C27 | C6 | C7 | H11 | 178.6° | 179.8° |
| C9 | C8 | C7 | C6 | 0.2° | 0.0° |
| C9 | C8 | C7 | F | 179.7° | 180.0° |
| C9 | C8 | C7 | H11 | 179.8° | 180.0° |
| N | C3 | C4 | H10 | 180.0° | 179.1° |
| N | C3 | C4 | C6 | 175.1° | 179.4° |
| N | C3 | C4 | C5 | 1.1° | 0.6° |
| C3 | N | C2 | C1 | 0.7° | 0.6° |
| C3 | N | C2 | H5 | 179.3° | 179.4° |
| C4 | C3 | N | C2 | 0.1° | 0.9° |
| C3 | C4 | C6 | C5 | 176.1° | 180.0° |
| C3 | C4 | C6 | C7 | 160.1° | 180.0° |
| C3 | C4 | C5 | C1 | 1.7° | 0.0° |
| C3 | C4 | C5 | H4 | 178.3° | 179.7° |
| N | C2 | C1 | H5 | 180.0° | 180.0° |
| N | C2 | C1 | C5 | 0.1° | 0.1° |
| N | C2 | C1 | O | 179.1° | 180.0° |
| C2 | N | C3 | H10 | 180.0° | 180.0° |
| C4 | C6 | C7 | C8 | 174.7° | 180.0° |
| C6 | C4 | C5 | C1 | 174.5° | 180.0° |
| C6 | C4 | C5 | H4 | 5.4° | 0.2° |
| C6 | C4 | C3 | H10 | 4.9° | 0.3° |
| C4 | C6 | C7 | H11 | 5.3° | 0.1° |
| C4 | C6 | C27 | H14 | 5.6° | 0.0° |
| C6 | C7 | C8 | H11 | 180.0° | 179.9° |
| C6 | C7 | C8 | F | 179.8° | 180.0° |
| C7 | C6 | C4 | C5 | 16.0° | 0.0° |
| C7 | C6 | C27 | H14 | 178.3° | 179.7° |
| C7 | C8 | C9 | H15 | 179.2° | 180.0° |
| F | C8 | C7 | H11 | 0.1° | 0.1° |
| F | C8 | C9 | H15 | 1.1° | 0.0° |
| C4 | C5 | C1 | C2 | 1.2° | 0.2° |
| C4 | C5 | C1 | H4 | 180.0° | 179.8° |
| C4 | C5 | C1 | O | 177.9° | 179.7° |
| C5 | C4 | C3 | H10 | 178.8° | 179.7° |
| C2 | C1 | C5 | O | 179.1° | 179.9° |
| C2 | C1 | O | C | 23.0° | 0.0° |
| C2 | C1 | C5 | H4 | 178.8° | 180.0° |
| C5 | C1 | O | C | 156.0° | 180.0° |
| C5 | C1 | C2 | H5 | 179.9° | 180.0° |
| O | C1 | C5 | H4 | 2.1° | 0.0° |
| O | C1 | C2 | H5 | 0.9° | 0.0° |
| C1 | O | C | H6 | 180.0° | 180.0° |
| C1 | O | C | H7 | 60.0° | 60.0° |
| C1 | O | C | H8 | 60.0° | 60.0° |
| O | C | H6 | H7 | 120.0° | 120.0° |
| O | C | H6 | H8 | 120.0° | 120.0° |
| O | C | H7 | H8 | 120.0° | 120.0° |
| H1 | C24 | C23 | H3 | 4.3° | 145.0° |
| H1 | C24 | C25 | H12 | 141.1° | 0.0° |
| H1 | C24 | C25 | H13 | 0.1° | 145.0° |
| H2 | C24 | C23 | H3 | 145.5° | 0.0° |
| H2 | C24 | C25 | H12 | 0.1° | 145.0° |
| H2 | C24 | C25 | H13 | 141.1° | 0.0° |
| H3 | C23 | C25 | H12 | 145.6° | 145.0° |
| H3 | C23 | C25 | H13 | 4.6° | 0.0° |
| H6 | C | H7 | H8 | 120.0° | 120.0° |
| H9 | N1 | C11 | H16 | 36.4° | 120.0° |
| H9 | N1 | C11 | H17 | 155.6° | 119.9° |
| H20 | C18 | H21 | H22 | 120.0° | 119.9° |
| H23 | C19 | C20 | H25 | 26.5° | 148.2° |
| H23 | C19 | C20 | H26 | 148.7° | 24.4° |
| H24 | C19 | C20 | H25 | 95.4° | 26.1° |
| H24 | C19 | C20 | H26 | 26.8° | 97.6° |
