EBL
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C19 | C18 | sing | 1.53Å | 1.52Å | |
| C20 | C18 | sing | 1.53Å | 1.52Å | |
| C20 | N4 | sing | 1.47Å | 1.46Å | |
| C18 | C17 | sing | 1.53Å | 1.52Å | |
| N5 | C21 | doub | 1.33Å | 1.33Å | Aromatic |
| N5 | C14 | sing | 1.32Å | 1.34Å | Aromatic |
| C17 | C16 | sing | 1.53Å | 1.51Å | |
| C21 | C22 | sing | 1.38Å | 1.38Å | Aromatic |
| N4 | C14 | sing | 1.38Å | 1.35Å | |
| N4 | C15 | sing | 1.47Å | 1.46Å | |
| C14 | N3 | doub | 1.32Å | 1.34Å | Aromatic |
| C15 | C16 | sing | 1.53Å | 1.51Å | |
| C16 | O1 | sing | 1.43Å | 1.42Å | |
| C22 | CL | sing | 1.74Å | 1.73Å | |
| C22 | C13 | doub | 1.40Å | 1.40Å | Aromatic |
| N3 | C13 | sing | 1.33Å | 1.33Å | Aromatic |
| C13 | N2 | sing | 1.39Å | 1.35Å | |
| N2 | C12 | sing | 1.40Å | 1.40Å | |
| C12 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
| C12 | C23 | sing | 1.38Å | 1.39Å | Aromatic |
| C5 | C4 | sing | 1.53Å | 1.49Å | |
| C5 | C3 | sing | 1.53Å | 1.49Å | |
| C11 | C10 | sing | 1.38Å | 1.38Å | Aromatic |
| C23 | C7 | doub | 1.40Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.53Å | 1.49Å | |
| C10 | C8 | doub | 1.39Å | 1.39Å | Aromatic |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| C7 | C8 | sing | 1.41Å | 1.40Å | Aromatic |
| C7 | C6 | sing | 1.47Å | 1.45Å | |
| C8 | N1 | sing | 1.38Å | 1.40Å | |
| N | C6 | sing | 1.38Å | 1.33Å | |
| N | C2 | sing | 1.47Å | 1.46Å | |
| C6 | C24 | doub | 1.38Å | 1.36Å | |
| C2 | C | sing | 1.52Å | 1.54Å | |
| N1 | C9 | sing | 1.47Å | 1.46Å | |
| N1 | C25 | sing | 1.34Å | 1.38Å | |
| C24 | C25 | sing | 1.41Å | 1.43Å | |
| C24 | O | sing | 1.37Å | 1.37Å | |
| C25 | O2 | doub | 1.22Å | 1.21Å | |
| C | F | sing | 1.40Å | 1.36Å | |
| C | F1 | sing | 1.40Å | 1.36Å | |
| C | C1 | sing | 1.52Å | 1.51Å | |
| O | C1 | sing | 1.43Å | 1.44Å | |
| C1 | H1 | sing | 1.09Å | 1.10Å | |
| C1 | H2 | sing | 1.09Å | 1.10Å | |
| C2 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C4 | H5 | sing | 1.09Å | 1.10Å | |
| C4 | H6 | sing | 1.09Å | 1.10Å | |
| C5 | H7 | sing | 1.09Å | 1.10Å | |
| C5 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C15 | H10 | sing | 1.09Å | 1.10Å | |
| C16 | H11 | sing | 1.09Å | 1.10Å | |
| C17 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C9 | H16 | sing | 1.09Å | 1.10Å | |
| C9 | H17 | sing | 1.09Å | 1.10Å | |
| C9 | H18 | sing | 1.09Å | 1.10Å | |
| C10 | H19 | sing | 1.08Å | 1.08Å | |
| C11 | H20 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.08Å | 1.08Å | |
| N2 | H22 | sing | 0.97Å | 1.00Å | |
| C21 | H23 | sing | 1.08Å | 1.08Å | |
| C20 | H24 | sing | 1.09Å | 1.10Å | |
| C20 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H26 | sing | 1.09Å | 1.10Å | |
| C19 | H27 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.09Å | 1.10Å | |
| O1 | H29 | sing | 0.97Å | 0.95Å | |
| N | H15 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C18 | C20 | 111.0° | 109.5° |
| C19 | C18 | C17 | 111.2° | 109.5° |
| C19 | C18 | H14 | 108.4° | 109.5° |
| C18 | C19 | H26 | 109.5° | 109.5° |
| C18 | C19 | H27 | 109.5° | 109.5° |
| C18 | C19 | H28 | 109.5° | 109.5° |
| C18 | C20 | N4 | 111.7° | 109.5° |
| C20 | C18 | C17 | 109.6° | 109.3° |
| C20 | C18 | H14 | 108.4° | 109.5° |
| C18 | C20 | H24 | 108.9° | 109.5° |
| C18 | C20 | H25 | 108.9° | 109.5° |
| C20 | N4 | C14 | 124.0° | 111.0° |
| C20 | N4 | C15 | 110.1° | 111.2° |
| N4 | C20 | H24 | 108.9° | 109.5° |
| N4 | C20 | H25 | 108.9° | 109.4° |
| C18 | C17 | C16 | 111.7° | 109.2° |
| C18 | C17 | H12 | 108.9° | 109.5° |
| C18 | C17 | H13 | 108.9° | 109.6° |
| C17 | C18 | H14 | 108.3° | 109.6° |
| C21 | N5 | C14 | 115.8° | 120.9° |
| N5 | C21 | C22 | 122.5° | 119.2° |
| N5 | C21 | H23 | 118.7° | 120.4° |
| N5 | C14 | N4 | 117.2° | 119.2° |
| N5 | C14 | N3 | 126.4° | 121.7° |
| C17 | C16 | C15 | 110.3° | 109.3° |
| C17 | C16 | O1 | 110.2° | 109.5° |
| C17 | C16 | H11 | 108.1° | 109.6° |
| C16 | C17 | H12 | 108.9° | 109.5° |
| C16 | C17 | H13 | 108.9° | 109.5° |
| C21 | C22 | CL | 121.7° | 120.8° |
| C21 | C22 | C13 | 117.6° | 118.5° |
| C22 | C21 | H23 | 118.8° | 120.4° |
| C14 | N4 | C15 | 118.8° | 111.0° |
| N4 | C14 | N3 | 116.4° | 119.1° |
| N4 | C15 | C16 | 108.8° | 109.5° |
| N4 | C15 | H9 | 109.6° | 109.5° |
| N4 | C15 | H10 | 109.6° | 109.4° |
| C14 | N3 | C13 | 117.5° | 120.6° |
| C15 | C16 | O1 | 110.6° | 109.5° |
| C16 | C15 | H9 | 109.7° | 109.4° |
| C16 | C15 | H10 | 109.7° | 109.5° |
| C15 | C16 | H11 | 108.2° | 109.5° |
| O1 | C16 | H11 | 109.4° | 109.5° |
| C16 | O1 | H29 | 109.5° | 114.0° |
| CL | C22 | C13 | 120.7° | 120.8° |
| C22 | C13 | N3 | 120.2° | 119.0° |
| C22 | C13 | N2 | 121.4° | 120.5° |
| N3 | C13 | N2 | 118.5° | 120.5° |
| C13 | N2 | C12 | 126.7° | 120.0° |
| C13 | N2 | H22 | 116.6° | 119.9° |
| N2 | C12 | C11 | 118.7° | 119.9° |
| N2 | C12 | C23 | 121.6° | 119.9° |
| C12 | N2 | H22 | 116.7° | 120.0° |
| C11 | C12 | C23 | 119.7° | 120.2° |
| C12 | C11 | C10 | 120.4° | 120.6° |
| C12 | C11 | H20 | 119.8° | 119.7° |
| C12 | C23 | C7 | 120.6° | 119.5° |
| C12 | C23 | H21 | 119.7° | 120.2° |
| C4 | C5 | C3 | 60.1° | 60.0° |
| C5 | C4 | C3 | 60.1° | 60.0° |
| C5 | C4 | H5 | 120.0° | 117.5° |
| C5 | C4 | H6 | 120.0° | 117.5° |
| C4 | C5 | H7 | 120.0° | 117.5° |
| C4 | C5 | H8 | 120.0° | 117.5° |
| C5 | C3 | C4 | 59.7° | 60.0° |
| C5 | C3 | C2 | 119.1° | 117.5° |
| C5 | C3 | H4 | 115.9° | 117.5° |
| C3 | C5 | H7 | 120.0° | 117.5° |
| C3 | C5 | H8 | 120.0° | 117.5° |
| C11 | C10 | C8 | 120.5° | 120.1° |
| C11 | C10 | H19 | 119.7° | 120.0° |
| C10 | C11 | H20 | 119.8° | 119.7° |
| C23 | C7 | C8 | 119.2° | 120.1° |
| C23 | C7 | C6 | 122.5° | 121.4° |
| C7 | C23 | H21 | 119.7° | 120.3° |
| C4 | C3 | C2 | 119.2° | 117.5° |
| C4 | C3 | H4 | 116.0° | 117.5° |
| C3 | C4 | H5 | 120.0° | 117.5° |
| C3 | C4 | H6 | 120.0° | 117.5° |
| C10 | C8 | C7 | 119.6° | 119.5° |
| C10 | C8 | N1 | 120.1° | 120.9° |
| C8 | C10 | H19 | 119.8° | 120.0° |
| C3 | C2 | N | 110.1° | 109.2° |
| C3 | C2 | C | 112.2° | 109.4° |
| C3 | C2 | H3 | 106.6° | 109.4° |
| C2 | C3 | H4 | 115.5° | 115.6° |
| C8 | C7 | C6 | 118.4° | 118.5° |
| C7 | C8 | N1 | 120.2° | 119.6° |
| C7 | C6 | N | 115.7° | 121.5° |
| C7 | C6 | C24 | 118.1° | 118.9° |
| C8 | N1 | C9 | 119.4° | 119.2° |
| C8 | N1 | C25 | 123.3° | 121.7° |
| C6 | N | C2 | 122.5° | 118.1° |
| N | C6 | C24 | 126.0° | 119.6° |
| C6 | N | H15 | 106.1° | 121.0° |
| N | C2 | C | 114.0° | 110.2° |
| N | C2 | H3 | 107.2° | 109.3° |
| C2 | N | H15 | 106.1° | 120.9° |
| C6 | C24 | C25 | 124.7° | 119.9° |
| C6 | C24 | O | 121.5° | 119.5° |
| C2 | C | F | 108.1° | 108.9° |
| C2 | C | F1 | 114.7° | 108.9° |
| C2 | C | C1 | 112.7° | 112.4° |
| C | C2 | H3 | 106.3° | 109.3° |
| C9 | N1 | C25 | 117.4° | 119.2° |
| N1 | C9 | H16 | 109.5° | 109.4° |
| N1 | C9 | H17 | 109.5° | 109.5° |
| N1 | C9 | H18 | 109.5° | 109.5° |
| N1 | C25 | C24 | 115.3° | 121.4° |
| N1 | C25 | O2 | 120.0° | 119.3° |
| C25 | C24 | O | 113.6° | 120.6° |
| C24 | C25 | O2 | 124.7° | 119.3° |
| C24 | O | C1 | 115.2° | 116.3° |
| F | C | F1 | 101.9° | 108.8° |
| F | C | C1 | 109.1° | 108.9° |
| F1 | C | C1 | 109.6° | 108.9° |
| C | C1 | O | 107.6° | 111.1° |
| C | C1 | H1 | 110.0° | 109.1° |
| C | C1 | H2 | 110.0° | 109.1° |
| O | C1 | H1 | 109.9° | 109.1° |
| O | C1 | H2 | 110.0° | 109.2° |
| H1 | C1 | H2 | 109.4° | 109.1° |
| H5 | C4 | H6 | 109.5° | 115.6° |
| H7 | C5 | H8 | 109.5° | 115.5° |
| H9 | C15 | H10 | 109.5° | 109.5° |
| H12 | C17 | H13 | 109.5° | 109.5° |
| H16 | C9 | H17 | 109.5° | 109.5° |
| H16 | C9 | H18 | 109.4° | 109.5° |
| H17 | C9 | H18 | 109.5° | 109.5° |
| H24 | C20 | H25 | 109.4° | 109.5° |
| H26 | C19 | H27 | 109.5° | 109.5° |
| H26 | C19 | H28 | 109.5° | 109.5° |
| H27 | C19 | H28 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C18 | C20 | C17 | 123.1° | 119.9° |
| C19 | C18 | C20 | H14 | 118.9° | 120.1° |
| C19 | C18 | C20 | N4 | 177.4° | 60.8° |
| C19 | C18 | C17 | H14 | 119.0° | 120.1° |
| C19 | C18 | C17 | C16 | 173.5° | 62.3° |
| C19 | C18 | C17 | H12 | 66.1° | 57.6° |
| C19 | C18 | C17 | H13 | 53.2° | 177.8° |
| C19 | C18 | C20 | H24 | 57.0° | 59.3° |
| C19 | C18 | C20 | H25 | 62.2° | 179.2° |
| C18 | C19 | H26 | H27 | 120.0° | 120.0° |
| C18 | C19 | H26 | H28 | 120.0° | 120.0° |
| C18 | C19 | H27 | H28 | 120.0° | 120.0° |
| C18 | C20 | N4 | H24 | 120.3° | 120.0° |
| C18 | C20 | N4 | H25 | 120.3° | 120.0° |
| C20 | C18 | C17 | H14 | 118.0° | 119.9° |
| C20 | C18 | C17 | C16 | 50.5° | 57.6° |
| C18 | C20 | N4 | C14 | 88.0° | 174.1° |
| C18 | C20 | N4 | C15 | 62.0° | 61.7° |
| C20 | C18 | C17 | H12 | 170.9° | 177.6° |
| C20 | C18 | C17 | H13 | 69.8° | 62.3° |
| C18 | C20 | H24 | H25 | 118.9° | 120.0° |
| C20 | C18 | C19 | H26 | 180.0° | 167.6° |
| C20 | C18 | C19 | H27 | 60.0° | 72.5° |
| C20 | C18 | C19 | H28 | 60.0° | 47.6° |
| N4 | C20 | C18 | C17 | 54.3° | 59.1° |
| C20 | N4 | C14 | N5 | 13.7° | 0.3° |
| C20 | N4 | C14 | C15 | 147.6° | 124.3° |
| C20 | N4 | C14 | N3 | 166.0° | 179.5° |
| C20 | N4 | C15 | C16 | 63.8° | 61.7° |
| C20 | N4 | C15 | H9 | 56.1° | 58.3° |
| C20 | N4 | C15 | H10 | 176.3° | 178.3° |
| N4 | C20 | C18 | H14 | 63.7° | 179.1° |
| N4 | C20 | H24 | H25 | 119.0° | 119.9° |
| C18 | C17 | C16 | H12 | 120.3° | 119.9° |
| C18 | C17 | C16 | H13 | 120.3° | 120.0° |
| C18 | C17 | C16 | C15 | 54.3° | 57.7° |
| C18 | C17 | C16 | O1 | 176.6° | 62.3° |
| C18 | C17 | C16 | H11 | 63.8° | 177.6° |
| C18 | C17 | H12 | H13 | 119.0° | 120.2° |
| C17 | C18 | C20 | H24 | 66.1° | 179.2° |
| C17 | C18 | C20 | H25 | 174.6° | 60.8° |
| C17 | C18 | C19 | H26 | 57.8° | 47.8° |
| C17 | C18 | C19 | H27 | 177.8° | 167.7° |
| C17 | C18 | C19 | H28 | 62.2° | 72.2° |
| N5 | C21 | C22 | H23 | 180.0° | 180.0° |
| C21 | N5 | C14 | N4 | 179.8° | 179.9° |
| C21 | N5 | C14 | N3 | 0.1° | 0.3° |
| N5 | C21 | C22 | CL | 178.9° | 180.0° |
| N5 | C21 | C22 | C13 | 0.2° | 0.0° |
| C14 | N5 | C21 | C22 | 0.1° | 0.0° |
| N5 | C14 | N4 | N3 | 179.8° | 179.8° |
| N5 | C14 | N4 | C15 | 161.3° | 123.9° |
| N5 | C14 | N3 | C13 | 0.2° | 0.6° |
| C14 | N5 | C21 | H23 | 179.9° | 180.0° |
| C17 | C16 | C15 | N4 | 59.9° | 59.2° |
| C17 | C16 | C15 | O1 | 122.2° | 119.9° |
| C17 | C16 | C15 | H11 | 118.1° | 120.0° |
| C17 | C16 | O1 | H11 | 118.8° | 120.2° |
| C17 | C16 | C15 | H9 | 59.9° | 60.8° |
| C17 | C16 | C15 | H10 | 179.8° | 179.1° |
| C16 | C17 | H12 | H13 | 118.9° | 120.1° |
| C16 | C17 | C18 | H14 | 67.5° | 177.6° |
| C17 | C16 | O1 | H29 | 180.0° | 179.8° |
| C21 | C22 | CL | C13 | 178.6° | 180.0° |
| C21 | C22 | C13 | N3 | 0.1° | 0.3° |
| C21 | C22 | C13 | N2 | 179.5° | 180.0° |
| C14 | N4 | C15 | C16 | 88.0° | 174.2° |
| N4 | C14 | N3 | C13 | 179.9° | 179.6° |
| C14 | N4 | C15 | H9 | 152.1° | 65.9° |
| C14 | N4 | C15 | H10 | 31.9° | 54.2° |
| C14 | N4 | C20 | H24 | 151.7° | 54.1° |
| C14 | N4 | C20 | H25 | 32.3° | 65.9° |
| C15 | N4 | C14 | N3 | 18.4° | 56.3° |
| N4 | C15 | C16 | H9 | 119.9° | 120.0° |
| N4 | C15 | C16 | H10 | 119.9° | 120.0° |
| N4 | C15 | C16 | O1 | 177.9° | 60.8° |
| N4 | C15 | H9 | H10 | 120.3° | 119.9° |
| N4 | C15 | C16 | H11 | 58.1° | 179.2° |
| C15 | N4 | C20 | H24 | 58.3° | 178.3° |
| C15 | N4 | C20 | H25 | 177.6° | 58.3° |
| C14 | N3 | C13 | C22 | 0.1° | 0.6° |
| C14 | N3 | C13 | N2 | 179.3° | 179.8° |
| C15 | C16 | O1 | H11 | 119.0° | 120.0° |
| C16 | C15 | H9 | H10 | 120.4° | 120.0° |
| C15 | C16 | C17 | H12 | 174.6° | 177.6° |
| C15 | C16 | C17 | H13 | 66.1° | 62.3° |
| C15 | C16 | O1 | H29 | 57.7° | 60.0° |
| O1 | C16 | C15 | H9 | 62.3° | 179.3° |
| O1 | C16 | C15 | H10 | 58.0° | 59.2° |
| O1 | C16 | C17 | H12 | 63.0° | 57.6° |
| O1 | C16 | C17 | H13 | 56.3° | 177.7° |
| CL | C22 | C13 | N3 | 178.8° | 179.6° |
| CL | C22 | C13 | N2 | 1.8° | 0.0° |
| CL | C22 | C21 | H23 | 1.1° | 0.0° |
| C22 | C13 | N3 | N2 | 179.4° | 179.6° |
| C22 | C13 | N2 | C12 | 167.8° | 174.4° |
| C22 | C13 | N2 | H22 | 12.2° | 5.7° |
| C13 | C22 | C21 | H23 | 179.8° | 180.0° |
| N3 | C13 | N2 | C12 | 11.6° | 5.2° |
| N3 | C13 | N2 | H22 | 168.4° | 174.7° |
| C13 | N2 | C12 | H22 | 180.0° | 179.9° |
| C13 | N2 | C12 | C11 | 58.8° | 32.9° |
| C13 | N2 | C12 | C23 | 119.3° | 147.0° |
| N2 | C12 | C11 | C23 | 178.2° | 179.9° |
| N2 | C12 | C11 | C10 | 177.9° | 180.0° |
| N2 | C12 | C23 | C7 | 177.9° | 179.9° |
| N2 | C12 | C11 | H20 | 2.1° | 0.1° |
| N2 | C12 | C23 | H21 | 2.2° | 0.0° |
| C12 | C11 | C10 | H20 | 180.0° | 179.9° |
| C11 | C12 | C23 | C7 | 0.3° | 0.1° |
| C12 | C11 | C10 | C8 | 0.2° | 0.0° |
| C12 | C11 | C10 | H19 | 179.8° | 180.0° |
| C11 | C12 | C23 | H21 | 179.7° | 179.9° |
| C11 | C12 | N2 | H22 | 121.2° | 147.2° |
| C23 | C12 | C11 | C10 | 0.3° | 0.1° |
| C12 | C23 | C7 | H21 | 180.0° | 180.0° |
| C12 | C23 | C7 | C8 | 0.1° | 0.2° |
| C12 | C23 | C7 | C6 | 179.2° | 179.7° |
| C23 | C12 | C11 | H20 | 179.7° | 180.0° |
| C23 | C12 | N2 | H22 | 60.7° | 32.9° |
| C4 | C5 | C3 | H7 | 109.5° | 107.5° |
| C4 | C5 | C3 | H8 | 109.5° | 107.5° |
| C5 | C4 | C3 | H5 | 109.5° | 107.5° |
| C5 | C4 | C3 | H6 | 109.5° | 107.5° |
| C4 | C5 | C3 | C2 | 108.8° | 107.5° |
| C4 | C5 | C3 | H4 | 106.3° | 107.4° |
| C5 | C4 | H5 | H6 | 144.6° | 145.7° |
| C4 | C5 | H7 | H8 | 144.7° | 145.7° |
| C5 | C3 | C2 | H4 | 145.1° | 145.7° |
| C5 | C3 | C2 | N | 70.8° | 104.6° |
| C5 | C3 | C2 | C | 161.0° | 134.8° |
| C5 | C3 | C2 | H3 | 45.1° | 15.0° |
| C3 | C5 | H7 | H8 | 144.7° | 145.7° |
| C11 | C10 | C8 | H19 | 180.0° | 180.0° |
| C11 | C10 | C8 | C7 | 0.1° | 0.1° |
| C11 | C10 | C8 | N1 | 179.9° | 179.9° |
| C23 | C7 | C8 | C10 | 0.0° | 0.2° |
| C23 | C7 | C8 | C6 | 179.4° | 179.9° |
| C23 | C7 | C8 | N1 | 179.9° | 179.8° |
| C23 | C7 | C6 | N | 4.2° | 0.4° |
| C23 | C7 | C6 | C24 | 179.4° | 179.8° |
| C4 | C3 | C2 | H4 | 145.3° | 145.6° |
| C4 | C3 | C2 | N | 140.4° | 173.3° |
| C4 | C3 | C2 | C | 91.5° | 66.1° |
| C4 | C3 | C2 | H3 | 24.4° | 53.6° |
| C3 | C4 | H5 | H6 | 144.7° | 145.7° |
| C10 | C8 | C7 | N1 | 179.9° | 180.0° |
| C10 | C8 | C7 | C6 | 179.3° | 179.8° |
| C10 | C8 | N1 | C9 | 0.4° | 0.1° |
| C10 | C8 | N1 | C25 | 179.7° | 179.9° |
| C8 | C10 | C11 | H20 | 179.8° | 180.0° |
| C3 | C2 | N | C6 | 163.7° | 158.1° |
| C3 | C2 | N | C | 127.1° | 120.1° |
| C3 | C2 | N | H3 | 115.5° | 119.7° |
| C3 | C2 | C | H3 | 116.1° | 119.8° |
| C3 | C2 | C | F | 73.6° | 56.0° |
| C3 | C2 | C | F1 | 39.3° | 62.6° |
| C3 | C2 | C | C1 | 165.7° | 176.7° |
| C2 | C3 | C4 | H5 | 0.9° | 145.0° |
| C2 | C3 | C4 | H6 | 141.9° | 0.0° |
| C2 | C3 | C5 | H7 | 141.8° | 0.0° |
| C2 | C3 | C5 | H8 | 0.8° | 145.0° |
| C3 | C2 | N | H15 | 41.9° | 21.8° |
| C8 | C7 | C6 | N | 175.1° | 179.5° |
| C8 | C7 | C6 | C24 | 1.2° | 0.3° |
| C7 | C8 | N1 | C9 | 179.7° | 179.9° |
| C7 | C8 | N1 | C25 | 0.4° | 0.2° |
| C7 | C8 | C10 | H19 | 179.9° | 180.0° |
| C8 | C7 | C23 | H21 | 179.8° | 179.9° |
| C6 | C7 | C8 | N1 | 0.8° | 0.2° |
| C7 | C6 | N | C24 | 176.0° | 179.8° |
| C7 | C6 | N | C2 | 161.4° | 113.5° |
| C7 | C6 | C24 | C25 | 1.4° | 0.2° |
| C7 | C6 | C24 | O | 172.5° | 179.6° |
| C6 | C7 | C23 | H21 | 0.8° | 0.2° |
| C7 | C6 | N | H15 | 39.7° | 66.5° |
| C8 | N1 | C9 | C25 | 179.3° | 179.9° |
| C8 | N1 | C25 | C24 | 0.5° | 0.1° |
| C8 | N1 | C25 | O2 | 176.4° | 179.9° |
| C8 | N1 | C9 | H16 | 180.0° | 180.0° |
| C8 | N1 | C9 | H17 | 60.0° | 60.1° |
| C8 | N1 | C9 | H18 | 60.0° | 59.9° |
| N1 | C8 | C10 | H19 | 0.2° | 0.1° |
| C6 | N | C2 | H15 | 121.8° | 179.9° |
| C6 | N | C2 | C | 69.2° | 81.8° |
| N | C6 | C24 | C25 | 174.5° | 179.6° |
| N | C6 | C24 | O | 11.5° | 0.7° |
| C6 | N | C2 | H3 | 48.2° | 38.4° |
| C2 | N | C6 | C24 | 14.6° | 66.3° |
| N | C2 | C | H3 | 117.9° | 120.2° |
| N | C2 | C | F | 160.4° | 176.0° |
| N | C2 | C | F1 | 86.7° | 57.5° |
| N | C2 | C | C1 | 39.7° | 63.3° |
| N | C2 | C3 | H4 | 74.3° | 41.1° |
| C6 | C24 | C25 | N1 | 1.0° | 0.1° |
| C6 | C24 | C25 | O | 174.4° | 179.8° |
| C6 | C24 | C25 | O2 | 175.7° | 179.9° |
| C6 | C24 | O | C1 | 44.4° | 68.4° |
| C24 | C6 | N | H15 | 136.4° | 113.8° |
| C2 | C | F | F1 | 121.3° | 118.6° |
| C2 | C | F | C1 | 122.9° | 122.9° |
| C2 | C | F1 | C1 | 128.0° | 122.9° |
| C2 | C | C1 | O | 41.8° | 66.3° |
| C2 | C | C1 | H1 | 161.5° | 173.2° |
| C2 | C | C1 | H2 | 78.0° | 54.1° |
| C | C2 | C3 | H4 | 53.8° | 79.5° |
| C | C2 | N | H15 | 169.0° | 98.3° |
| C9 | N1 | C25 | C24 | 179.8° | 180.0° |
| C9 | N1 | C25 | O2 | 2.9° | 0.0° |
| N1 | C9 | H16 | H17 | 120.0° | 120.0° |
| N1 | C9 | H16 | H18 | 120.0° | 120.0° |
| N1 | C9 | H17 | H18 | 120.0° | 120.0° |
| N1 | C25 | C24 | O2 | 176.7° | 180.0° |
| N1 | C25 | C24 | O | 173.3° | 179.7° |
| C25 | N1 | C9 | H16 | 0.7° | 0.0° |
| C25 | N1 | C9 | H17 | 120.7° | 120.0° |
| C25 | N1 | C9 | H18 | 119.3° | 120.0° |
| C25 | C24 | O | C1 | 130.2° | 111.8° |
| O | C24 | C25 | O2 | 10.0° | 0.3° |
| C24 | O | C1 | C | 93.5° | 86.1° |
| C24 | O | C1 | H1 | 146.8° | 153.5° |
| C24 | O | C1 | H2 | 26.2° | 34.3° |
| F | C | F1 | C1 | 115.5° | 118.5° |
| F | C | C1 | O | 78.4° | 172.9° |
| F | C | C1 | H1 | 41.3° | 52.5° |
| F | C | C1 | H2 | 161.9° | 66.7° |
| F | C | C2 | H3 | 42.5° | 63.8° |
| F1 | C | C1 | O | 170.8° | 54.4° |
| F1 | C | C1 | H1 | 69.4° | 66.0° |
| F1 | C | C1 | H2 | 51.1° | 174.8° |
| F1 | C | C2 | H3 | 155.4° | 177.7° |
| C | C1 | O | H1 | 119.7° | 120.4° |
| C | C1 | O | H2 | 119.7° | 120.4° |
| C | C1 | H1 | H2 | 120.9° | 119.2° |
| C1 | C | C2 | H3 | 78.2° | 56.9° |
| O | C1 | H1 | H2 | 120.9° | 119.2° |
| H3 | C2 | C3 | H4 | 169.8° | 160.8° |
| H3 | C2 | N | H15 | 73.6° | 141.5° |
| H4 | C3 | C4 | H5 | 144.3° | 0.1° |
| H4 | C3 | C4 | H6 | 3.3° | 145.0° |
| H4 | C3 | C5 | H7 | 3.2° | 145.1° |
| H4 | C3 | C5 | H8 | 144.2° | 0.0° |
| H5 | C4 | C5 | H7 | 141.0° | 145.0° |
| H5 | C4 | C5 | H8 | 0.0° | 0.0° |
| H6 | C4 | C5 | H7 | 0.0° | 0.0° |
| H6 | C4 | C5 | H8 | 141.0° | 145.0° |
| H9 | C15 | C16 | H11 | 178.0° | 59.2° |
| H10 | C15 | C16 | H11 | 61.8° | 60.8° |
| H11 | C16 | C17 | H12 | 56.5° | 62.4° |
| H11 | C16 | C17 | H13 | 175.8° | 57.7° |
| H11 | C16 | O1 | H29 | 61.3° | 60.1° |
| H12 | C17 | C18 | H14 | 52.8° | 62.5° |
| H13 | C17 | C18 | H14 | 172.2° | 57.6° |
| H14 | C18 | C20 | H24 | 175.9° | 60.8° |
| H14 | C18 | C20 | H25 | 56.6° | 59.1° |
| H14 | C18 | C19 | H26 | 61.1° | 72.4° |
| H14 | C18 | C19 | H27 | 58.9° | 47.6° |
| H14 | C18 | C19 | H28 | 178.8° | 167.6° |
| H16 | C9 | H17 | H18 | 119.9° | 120.0° |
| H19 | C10 | C11 | H20 | 0.2° | 0.1° |
| H26 | C19 | H27 | H28 | 120.0° | 120.0° |
