F0S
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C14 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C14 | C15 | sing | 1.38Å | 1.40Å | Aromatic |
| F | C15 | sing | 1.35Å | 1.35Å | |
| C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| C15 | C10 | doub | 1.40Å | 1.37Å | Aromatic |
| C26 | N5 | doub | 1.30Å | 1.34Å | Aromatic |
| C26 | C27 | sing | 1.46Å | 1.43Å | Aromatic |
| N5 | N4 | sing | 1.40Å | 1.40Å | Aromatic |
| O4 | C21 | doub | 1.22Å | 1.20Å | |
| O2 | C9 | doub | 1.22Å | 1.22Å | |
| C12 | C16 | sing | 1.51Å | 1.51Å | |
| C12 | C11 | doub | 1.38Å | 1.41Å | Aromatic |
| C27 | C28 | sing | 1.40Å | 1.40Å | Aromatic |
| C27 | C25 | doub | 1.41Å | 1.36Å | Aromatic |
| C28 | C22 | doub | 1.38Å | 1.39Å | Aromatic |
| C10 | C11 | sing | 1.40Å | 1.40Å | Aromatic |
| C10 | C9 | sing | 1.48Å | 1.50Å | |
| C16 | N1 | sing | 1.47Å | 1.49Å | |
| C16 | C20 | sing | 1.51Å | 1.49Å | |
| N4 | C25 | sing | 1.37Å | 1.35Å | Aromatic |
| C21 | N3 | sing | 1.35Å | 1.35Å | |
| C21 | C20 | sing | 1.42Å | 1.49Å | |
| C9 | N | sing | 1.35Å | 1.31Å | |
| C25 | C24 | sing | 1.39Å | 1.39Å | Aromatic |
| C22 | N3 | sing | 1.40Å | 1.37Å | |
| C22 | C23 | sing | 1.40Å | 1.40Å | Aromatic |
| N1 | C17 | sing | 1.35Å | 1.34Å | |
| C20 | C18 | doub | 1.35Å | 1.47Å | |
| C24 | C23 | doub | 1.37Å | 1.40Å | Aromatic |
| N | C8 | sing | 1.46Å | 1.44Å | |
| C17 | O3 | doub | 1.22Å | 1.26Å | |
| C17 | N2 | sing | 1.34Å | 1.34Å | |
| C8 | C7 | sing | 1.51Å | 1.50Å | |
| C18 | N2 | sing | 1.37Å | 1.35Å | |
| C18 | C19 | sing | 1.51Å | 1.51Å | |
| C | O | sing | 1.43Å | 1.42Å | |
| O | C1 | sing | 1.36Å | 1.36Å | |
| C7 | C1 | doub | 1.39Å | 1.38Å | Aromatic |
| C7 | C5 | sing | 1.39Å | 1.39Å | Aromatic |
| C6 | O1 | sing | 1.43Å | 1.45Å | |
| C1 | C2 | sing | 1.39Å | 1.39Å | Aromatic |
| O1 | C5 | sing | 1.36Å | 1.38Å | |
| C5 | C4 | doub | 1.39Å | 1.39Å | Aromatic |
| C2 | C3 | doub | 1.38Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.38Å | 1.39Å | Aromatic |
| N3 | H1 | sing | 0.97Å | 1.00Å | |
| C28 | H2 | sing | 1.08Å | 1.08Å | |
| C26 | H3 | sing | 1.08Å | 1.08Å | |
| C24 | H5 | sing | 1.08Å | 1.08Å | |
| C23 | H6 | sing | 1.08Å | 1.08Å | |
| C19 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.09Å | 1.10Å | |
| N1 | H11 | sing | 0.97Å | 1.00Å | |
| C16 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H13 | sing | 1.08Å | 1.08Å | |
| C13 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| N | H16 | sing | 0.97Å | 1.00Å | |
| C8 | H17 | sing | 1.09Å | 1.10Å | |
| C8 | H18 | sing | 1.09Å | 1.10Å | |
| C | H19 | sing | 1.09Å | 1.10Å | |
| C | H20 | sing | 1.09Å | 1.10Å | |
| C | H21 | sing | 1.09Å | 1.10Å | |
| C6 | H22 | sing | 1.09Å | 1.10Å | |
| C6 | H23 | sing | 1.09Å | 1.10Å | |
| C6 | H24 | sing | 1.09Å | 1.10Å | |
| C4 | H25 | sing | 1.08Å | 1.08Å | |
| C3 | H26 | sing | 1.08Å | 1.08Å | |
| C2 | H27 | sing | 1.08Å | 1.08Å | |
| N4 | H4 | sing | 0.97Å | 1.00Å | |
| N2 | H7 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C13 | C14 | C15 | 121.2° | 120.1° |
| C14 | C13 | C12 | 119.8° | 120.3° |
| C14 | C13 | H14 | 120.1° | 119.8° |
| C13 | C14 | H15 | 119.4° | 119.9° |
| C14 | C15 | F | 120.5° | 120.1° |
| C14 | C15 | C10 | 119.8° | 119.7° |
| C15 | C14 | H15 | 119.4° | 119.9° |
| F | C15 | C10 | 119.7° | 120.2° |
| C13 | C12 | C16 | 118.5° | 119.9° |
| C13 | C12 | C11 | 118.5° | 120.2° |
| C12 | C13 | H14 | 120.1° | 119.8° |
| C15 | C10 | C11 | 119.1° | 119.7° |
| C15 | C10 | C9 | 119.5° | 120.1° |
| N5 | C26 | C27 | 109.7° | 107.8° |
| C26 | N5 | N4 | 102.7° | 110.1° |
| N5 | C26 | H3 | 125.1° | 126.1° |
| C26 | C27 | C28 | 129.9° | 133.9° |
| C26 | C27 | C25 | 109.1° | 106.4° |
| C27 | C26 | H3 | 125.1° | 126.2° |
| N5 | N4 | C25 | 115.0° | 109.1° |
| N5 | N4 | H4 | 122.5° | 125.5° |
| O4 | C21 | N3 | 127.0° | 120.0° |
| O4 | C21 | C20 | 113.6° | 120.0° |
| O2 | C9 | C10 | 117.3° | 120.0° |
| O2 | C9 | N | 119.4° | 120.0° |
| C16 | C12 | C11 | 122.9° | 119.9° |
| C12 | C16 | N1 | 110.4° | 107.9° |
| C12 | C16 | C20 | 114.0° | 108.4° |
| C12 | C16 | H12 | 106.4° | 107.8° |
| C12 | C11 | C10 | 121.6° | 119.9° |
| C12 | C11 | H13 | 119.2° | 120.0° |
| C28 | C27 | C25 | 121.0° | 119.8° |
| C27 | C28 | C22 | 121.6° | 119.5° |
| C27 | C28 | H2 | 119.2° | 120.3° |
| C27 | C25 | N4 | 103.5° | 106.7° |
| C27 | C25 | C24 | 119.5° | 119.6° |
| C28 | C22 | N3 | 125.8° | 119.8° |
| C28 | C22 | C23 | 116.6° | 120.3° |
| C22 | C28 | H2 | 119.2° | 120.3° |
| C11 | C10 | C9 | 121.3° | 120.2° |
| C10 | C11 | H13 | 119.2° | 120.1° |
| C10 | C9 | N | 122.8° | 120.0° |
| N1 | C16 | C20 | 112.1° | 117.0° |
| C16 | N1 | C17 | 122.9° | 118.4° |
| C16 | N1 | H11 | 118.6° | 120.8° |
| N1 | C16 | H12 | 106.7° | 107.9° |
| C16 | C20 | C21 | 123.3° | 121.1° |
| C16 | C20 | C18 | 119.0° | 117.8° |
| C20 | C16 | H12 | 106.6° | 107.5° |
| N4 | C25 | C24 | 136.9° | 133.7° |
| C25 | N4 | H4 | 122.5° | 125.5° |
| N3 | C21 | C20 | 119.4° | 120.0° |
| C21 | N3 | C22 | 129.2° | 120.0° |
| C21 | N3 | H1 | 115.4° | 120.0° |
| C21 | C20 | C18 | 117.7° | 121.1° |
| C9 | N | C8 | 119.6° | 120.0° |
| C9 | N | H16 | 120.2° | 120.0° |
| C25 | C24 | C23 | 119.4° | 120.1° |
| C25 | C24 | H5 | 120.3° | 119.9° |
| N3 | C22 | C23 | 117.6° | 119.8° |
| C22 | N3 | H1 | 115.4° | 120.0° |
| C22 | C23 | C24 | 121.8° | 120.7° |
| C22 | C23 | H6 | 119.1° | 119.6° |
| N1 | C17 | O3 | 120.1° | 118.9° |
| N1 | C17 | N2 | 121.7° | 122.1° |
| C17 | N1 | H11 | 118.5° | 120.8° |
| C20 | C18 | N2 | 119.6° | 121.0° |
| C20 | C18 | C19 | 121.0° | 119.5° |
| C23 | C24 | H5 | 120.3° | 120.0° |
| C24 | C23 | H6 | 119.1° | 119.6° |
| N | C8 | C7 | 112.0° | 109.5° |
| C8 | N | H16 | 120.2° | 120.0° |
| N | C8 | H17 | 108.8° | 109.5° |
| N | C8 | H18 | 108.8° | 109.5° |
| O3 | C17 | N2 | 118.2° | 118.9° |
| C17 | N2 | C18 | 122.5° | 123.7° |
| C17 | N2 | H7 | 118.8° | 118.1° |
| C8 | C7 | C1 | 117.6° | 120.0° |
| C8 | C7 | C5 | 122.2° | 120.1° |
| C7 | C8 | H17 | 108.8° | 109.5° |
| C7 | C8 | H18 | 108.9° | 109.5° |
| N2 | C18 | C19 | 119.4° | 119.5° |
| C18 | N2 | H7 | 118.7° | 118.2° |
| C18 | C19 | H8 | 109.5° | 109.5° |
| C18 | C19 | H9 | 109.4° | 109.5° |
| C18 | C19 | H10 | 109.4° | 109.5° |
| C | O | C1 | 120.7° | 117.0° |
| O | C | H19 | 109.5° | 109.5° |
| O | C | H20 | 109.5° | 109.5° |
| O | C | H21 | 109.5° | 109.5° |
| O | C1 | C7 | 119.8° | 120.1° |
| O | C1 | C2 | 119.5° | 120.0° |
| C1 | C7 | C5 | 120.2° | 119.9° |
| C7 | C1 | C2 | 120.7° | 120.0° |
| C7 | C5 | O1 | 122.1° | 120.0° |
| C7 | C5 | C4 | 119.6° | 119.9° |
| C6 | O1 | C5 | 120.8° | 117.0° |
| O1 | C6 | H22 | 109.5° | 109.5° |
| O1 | C6 | H23 | 109.4° | 109.5° |
| O1 | C6 | H24 | 109.5° | 109.5° |
| C1 | C2 | C3 | 119.8° | 120.0° |
| C1 | C2 | H27 | 120.1° | 120.0° |
| O1 | C5 | C4 | 118.3° | 120.1° |
| C5 | C4 | C3 | 120.4° | 120.0° |
| C5 | C4 | H25 | 119.8° | 120.0° |
| C2 | C3 | C4 | 119.3° | 120.1° |
| C2 | C3 | H26 | 120.3° | 120.0° |
| C3 | C2 | H27 | 120.1° | 120.0° |
| C3 | C4 | H25 | 119.8° | 120.0° |
| C4 | C3 | H26 | 120.4° | 119.9° |
| H8 | C19 | H9 | 109.5° | 109.4° |
| H8 | C19 | H10 | 109.5° | 109.5° |
| H9 | C19 | H10 | 109.5° | 109.4° |
| H17 | C8 | H18 | 109.4° | 109.4° |
| H19 | C | H20 | 109.5° | 109.5° |
| H19 | C | H21 | 109.5° | 109.5° |
| H20 | C | H21 | 109.4° | 109.4° |
| H22 | C6 | H23 | 109.5° | 109.4° |
| H22 | C6 | H24 | 109.5° | 109.5° |
| H23 | C6 | H24 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C13 | C14 | C15 | H15 | 180.0° | 179.9° |
| C13 | C14 | C15 | F | 179.7° | 180.0° |
| C14 | C13 | C12 | H14 | 180.0° | 180.0° |
| C13 | C14 | C15 | C10 | 0.6° | 0.3° |
| C14 | C13 | C12 | C16 | 178.7° | 180.0° |
| C14 | C13 | C12 | C11 | 1.4° | 0.3° |
| C14 | C15 | F | C10 | 179.1° | 179.7° |
| C15 | C14 | C13 | C12 | 0.9° | 0.0° |
| C14 | C15 | C10 | C11 | 0.8° | 0.3° |
| C14 | C15 | C10 | C9 | 177.4° | 180.0° |
| C15 | C14 | C13 | H14 | 179.1° | 180.0° |
| F | C15 | C10 | C11 | 179.9° | 180.0° |
| F | C15 | C10 | C9 | 3.5° | 0.3° |
| F | C15 | C14 | H15 | 0.3° | 0.0° |
| C13 | C12 | C16 | C11 | 177.1° | 179.7° |
| C13 | C12 | C11 | C10 | 1.6° | 0.3° |
| C13 | C12 | C16 | N1 | 159.6° | 133.4° |
| C13 | C12 | C16 | C20 | 73.1° | 99.0° |
| C13 | C12 | C16 | H12 | 44.2° | 17.1° |
| C13 | C12 | C11 | H13 | 178.4° | 179.7° |
| C12 | C13 | C14 | H15 | 179.1° | 180.0° |
| C15 | C10 | C9 | O2 | 46.1° | 5.6° |
| C15 | C10 | C11 | C12 | 1.4° | 0.0° |
| C15 | C10 | C11 | C9 | 176.5° | 179.7° |
| C15 | C10 | C9 | N | 142.1° | 174.3° |
| C15 | C10 | C11 | H13 | 178.6° | 180.0° |
| C10 | C15 | C14 | H15 | 179.4° | 179.8° |
| N5 | C26 | C27 | H3 | 180.0° | 180.0° |
| N5 | C26 | C27 | C28 | 179.7° | 179.9° |
| N5 | C26 | C27 | C25 | 0.2° | 0.0° |
| C26 | N5 | N4 | C25 | 0.7° | 0.0° |
| C26 | N5 | N4 | H4 | 179.3° | 180.0° |
| C27 | C26 | N5 | N4 | 0.5° | 0.0° |
| C26 | C27 | C28 | C25 | 179.4° | 179.9° |
| C26 | C27 | C28 | C22 | 179.2° | 180.0° |
| C26 | C27 | C25 | N4 | 0.2° | 0.0° |
| C26 | C27 | C25 | C24 | 179.0° | 180.0° |
| C26 | C27 | C28 | H2 | 0.8° | 0.1° |
| N5 | N4 | C25 | C27 | 0.6° | 0.0° |
| N5 | N4 | C25 | H4 | 180.0° | 180.0° |
| N5 | N4 | C25 | C24 | 179.1° | 180.0° |
| N4 | N5 | C26 | H3 | 179.4° | 180.0° |
| O4 | C21 | C20 | C16 | 66.0° | 79.7° |
| O4 | C21 | N3 | C20 | 176.0° | 179.8° |
| O4 | C21 | N3 | C22 | 14.6° | 8.7° |
| O4 | C21 | C20 | C18 | 111.1° | 100.6° |
| O4 | C21 | N3 | H1 | 165.4° | 171.3° |
| O2 | C9 | C10 | C11 | 130.4° | 174.1° |
| O2 | C9 | C10 | N | 171.8° | 179.9° |
| O2 | C9 | N | C8 | 13.5° | 5.6° |
| O2 | C9 | N | H16 | 166.5° | 174.5° |
| C16 | C12 | C11 | C10 | 178.8° | 180.0° |
| C12 | C16 | N1 | C20 | 128.4° | 122.5° |
| C12 | C16 | N1 | H12 | 115.3° | 116.2° |
| C12 | C16 | C20 | H12 | 117.1° | 116.2° |
| C12 | C16 | C20 | C21 | 68.4° | 58.1° |
| C12 | C16 | N1 | C17 | 114.3° | 121.9° |
| C12 | C16 | C20 | C18 | 114.5° | 121.7° |
| C12 | C16 | N1 | H11 | 65.7° | 57.8° |
| C16 | C12 | C11 | H13 | 1.2° | 0.0° |
| C16 | C12 | C13 | H14 | 1.4° | 0.0° |
| C12 | C11 | C10 | H13 | 180.0° | 180.0° |
| C12 | C11 | C10 | C9 | 177.9° | 179.7° |
| C11 | C12 | C16 | N1 | 17.6° | 46.9° |
| C11 | C12 | C16 | C20 | 109.8° | 80.7° |
| C11 | C12 | C16 | H12 | 133.0° | 163.2° |
| C11 | C12 | C13 | H14 | 178.6° | 179.7° |
| C27 | C28 | C22 | H2 | 180.0° | 179.9° |
| C28 | C27 | C25 | N4 | 179.3° | 180.0° |
| C28 | C27 | C25 | C24 | 0.5° | 0.0° |
| C27 | C28 | C22 | N3 | 178.9° | 180.0° |
| C27 | C28 | C22 | C23 | 0.4° | 0.3° |
| C28 | C27 | C26 | H3 | 0.3° | 0.1° |
| C25 | C27 | C28 | C22 | 0.2° | 0.1° |
| C27 | C25 | N4 | C24 | 178.5° | 180.0° |
| C27 | C25 | C24 | C23 | 0.1° | 0.3° |
| C25 | C27 | C28 | H2 | 179.8° | 180.0° |
| C25 | C27 | C26 | H3 | 179.7° | 180.0° |
| C27 | C25 | C24 | H5 | 179.9° | 180.0° |
| C27 | C25 | N4 | H4 | 179.4° | 180.0° |
| C28 | C22 | N3 | C21 | 9.6° | 147.9° |
| C28 | C22 | N3 | C23 | 178.5° | 179.7° |
| C28 | C22 | C23 | C24 | 0.8° | 0.6° |
| C28 | C22 | N3 | H1 | 170.4° | 32.1° |
| C28 | C22 | C23 | H6 | 179.2° | 179.7° |
| C11 | C10 | C9 | N | 41.4° | 6.0° |
| C10 | C9 | N | C8 | 158.1° | 174.5° |
| C9 | C10 | C11 | H13 | 2.1° | 0.3° |
| C10 | C9 | N | H16 | 21.9° | 5.4° |
| N1 | C16 | C20 | H12 | 116.4° | 121.5° |
| N1 | C16 | C20 | C21 | 165.1° | 179.7° |
| C16 | N1 | C17 | H11 | 180.0° | 179.6° |
| N1 | C16 | C20 | C18 | 11.9° | 0.6° |
| C16 | N1 | C17 | O3 | 177.8° | 179.7° |
| C16 | N1 | C17 | N2 | 3.9° | 0.4° |
| C16 | C20 | C21 | N3 | 117.6° | 100.1° |
| C16 | C20 | C21 | C18 | 177.1° | 179.7° |
| C20 | C16 | N1 | C17 | 14.1° | 0.6° |
| C16 | C20 | C18 | N2 | 0.4° | 0.3° |
| C16 | C20 | C18 | C19 | 177.4° | 179.7° |
| C20 | C16 | N1 | H11 | 165.9° | 179.7° |
| N4 | C25 | C24 | C23 | 178.4° | 179.7° |
| N4 | C25 | C24 | H5 | 1.5° | 0.1° |
| C21 | N3 | C22 | H1 | 180.0° | 180.0° |
| C21 | N3 | C22 | C23 | 168.9° | 31.7° |
| N3 | C21 | C20 | C18 | 65.4° | 79.6° |
| C20 | C21 | N3 | C22 | 161.4° | 171.6° |
| C21 | C20 | C18 | N2 | 176.8° | 180.0° |
| C21 | C20 | C18 | C19 | 0.2° | 0.0° |
| C20 | C21 | N3 | H1 | 18.6° | 8.5° |
| C21 | C20 | C16 | H12 | 48.7° | 58.2° |
| C9 | N | C8 | H16 | 180.0° | 179.9° |
| C9 | N | C8 | C7 | 155.0° | 175.2° |
| C9 | N | C8 | H17 | 34.6° | 55.1° |
| C9 | N | C8 | H18 | 84.6° | 64.8° |
| C25 | C24 | C23 | C22 | 0.6° | 0.5° |
| C25 | C24 | C23 | H5 | 180.0° | 179.8° |
| C25 | C24 | C23 | H6 | 179.4° | 179.7° |
| C24 | C25 | N4 | H4 | 0.9° | 0.1° |
| N3 | C22 | C23 | C24 | 179.4° | 179.7° |
| N3 | C22 | C28 | H2 | 1.1° | 0.1° |
| N3 | C22 | C23 | H6 | 0.6° | 0.0° |
| C22 | C23 | C24 | H6 | 180.0° | 179.7° |
| C23 | C22 | N3 | H1 | 11.1° | 148.2° |
| C23 | C22 | C28 | H2 | 179.6° | 179.8° |
| C22 | C23 | C24 | H5 | 179.5° | 179.7° |
| N1 | C17 | O3 | N2 | 178.4° | 180.0° |
| N1 | C17 | N2 | C18 | 10.0° | 0.0° |
| C17 | N1 | C16 | H12 | 130.4° | 121.9° |
| N1 | C17 | N2 | H7 | 170.0° | 179.9° |
| C20 | C18 | N2 | C17 | 11.4° | 0.0° |
| C20 | C18 | N2 | C19 | 177.0° | 180.0° |
| C20 | C18 | C19 | H8 | 180.0° | 84.5° |
| C20 | C18 | C19 | H9 | 60.0° | 155.6° |
| C20 | C18 | C19 | H10 | 60.0° | 35.6° |
| C18 | C20 | C16 | H12 | 128.3° | 122.1° |
| C20 | C18 | N2 | H7 | 168.6° | 180.0° |
| N | C8 | C7 | H17 | 120.4° | 120.0° |
| N | C8 | C7 | H18 | 120.4° | 120.0° |
| N | C8 | C7 | C1 | 71.3° | 94.7° |
| N | C8 | C7 | C5 | 109.4° | 85.6° |
| N | C8 | H17 | H18 | 118.8° | 120.0° |
| O3 | C17 | N2 | C18 | 168.4° | 180.0° |
| O3 | C17 | N1 | H11 | 2.2° | 0.1° |
| O3 | C17 | N2 | H7 | 11.6° | 0.0° |
| C17 | N2 | C18 | H7 | 180.0° | 180.0° |
| C17 | N2 | C18 | C19 | 165.6° | 180.0° |
| N2 | C17 | N1 | H11 | 176.1° | 180.0° |
| C8 | C7 | C1 | O | 0.7° | 0.0° |
| C8 | C7 | C1 | C5 | 179.3° | 179.7° |
| C8 | C7 | C1 | C2 | 178.9° | 180.0° |
| C8 | C7 | C5 | O1 | 0.4° | 0.1° |
| C8 | C7 | C5 | C4 | 179.6° | 180.0° |
| C7 | C8 | N | H16 | 25.0° | 4.9° |
| C7 | C8 | H17 | H18 | 118.8° | 120.0° |
| N2 | C18 | C19 | H8 | 3.0° | 95.5° |
| N2 | C18 | C19 | H9 | 117.0° | 24.5° |
| N2 | C18 | C19 | H10 | 123.0° | 144.4° |
| C18 | C19 | H8 | H9 | 120.0° | 120.0° |
| C18 | C19 | H8 | H10 | 120.0° | 120.1° |
| C18 | C19 | H9 | H10 | 120.0° | 120.0° |
| C19 | C18 | N2 | H7 | 14.4° | 0.1° |
| C | O | C1 | C7 | 86.9° | 180.0° |
| C | O | C1 | C2 | 93.5° | 0.0° |
| O | C | H19 | H20 | 120.0° | 120.0° |
| O | C | H19 | H21 | 120.0° | 120.0° |
| O | C | H20 | H21 | 120.0° | 120.0° |
| O | C1 | C7 | C2 | 179.6° | 180.0° |
| O | C1 | C7 | C5 | 180.0° | 179.7° |
| O | C1 | C2 | C3 | 179.4° | 180.0° |
| C1 | O | C | H19 | 180.0° | 60.0° |
| C1 | O | C | H20 | 60.0° | 180.0° |
| C1 | O | C | H21 | 60.0° | 60.0° |
| O | C1 | C2 | H27 | 0.6° | 0.0° |
| C1 | C7 | C5 | O1 | 179.7° | 179.7° |
| C1 | C7 | C5 | C4 | 0.3° | 0.4° |
| C7 | C1 | C2 | C3 | 1.0° | 0.1° |
| C1 | C7 | C8 | H17 | 49.1° | 25.3° |
| C1 | C7 | C8 | H18 | 168.3° | 145.3° |
| C7 | C1 | C2 | H27 | 179.0° | 180.0° |
| C7 | C5 | O1 | C6 | 72.4° | 175.0° |
| C5 | C7 | C1 | C2 | 0.4° | 0.4° |
| C7 | C5 | O1 | C4 | 179.9° | 179.9° |
| C7 | C5 | C4 | C3 | 0.4° | 0.1° |
| C5 | C7 | C8 | H17 | 130.2° | 154.3° |
| C5 | C7 | C8 | H18 | 11.0° | 34.4° |
| C7 | C5 | C4 | H25 | 179.6° | 180.0° |
| C6 | O1 | C5 | C4 | 107.7° | 5.1° |
| O1 | C6 | H22 | H23 | 120.0° | 120.0° |
| O1 | C6 | H22 | H24 | 120.0° | 120.0° |
| O1 | C6 | H23 | H24 | 120.0° | 120.0° |
| C1 | C2 | C3 | H27 | 180.0° | 179.9° |
| C1 | C2 | C3 | C4 | 0.9° | 0.2° |
| C1 | C2 | C3 | H26 | 179.1° | 180.0° |
| O1 | C5 | C4 | C3 | 179.7° | 180.0° |
| C5 | O1 | C6 | H22 | 180.0° | 63.2° |
| C5 | O1 | C6 | H23 | 60.0° | 176.9° |
| C5 | O1 | C6 | H24 | 60.0° | 56.9° |
| O1 | C5 | C4 | H25 | 0.4° | 0.1° |
| C5 | C4 | C3 | C2 | 0.2° | 0.2° |
| C5 | C4 | C3 | H25 | 180.0° | 179.9° |
| C5 | C4 | C3 | H26 | 179.8° | 179.9° |
| C2 | C3 | C4 | H26 | 180.0° | 179.8° |
| C2 | C3 | C4 | H25 | 179.8° | 179.7° |
| C4 | C3 | C2 | H27 | 179.1° | 179.7° |
| H5 | C24 | C23 | H6 | 0.5° | 0.0° |
| H8 | C19 | H9 | H10 | 120.0° | 120.0° |
| H11 | N1 | C16 | H12 | 49.6° | 58.4° |
| H14 | C13 | C14 | H15 | 0.9° | 0.0° |
| H16 | N | C8 | H17 | 145.4° | 124.9° |
| H16 | N | C8 | H18 | 95.4° | 115.2° |
| H19 | C | H20 | H21 | 120.0° | 120.0° |
| H22 | C6 | H23 | H24 | 120.0° | 120.0° |
| H25 | C4 | C3 | H26 | 0.2° | 0.0° |
| H26 | C3 | C2 | H27 | 0.9° | 0.0° |
