4FJ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| F1 | C4 | sing | 1.35Å | 1.35Å | |
| C4 | C5 | doub | 1.39Å | 1.39Å | Aromatic |
| C4 | C3 | sing | 1.36Å | 1.39Å | Aromatic |
| C5 | C6 | sing | 1.36Å | 1.39Å | Aromatic |
| C3 | C2 | doub | 1.41Å | 1.39Å | Aromatic |
| C6 | C1 | doub | 1.40Å | 1.39Å | Aromatic |
| C24 | O1 | sing | 1.43Å | 1.44Å | |
| C24 | C23 | sing | 1.53Å | 1.53Å | |
| C2 | C1 | sing | 1.42Å | 1.40Å | Aromatic |
| C2 | N1 | sing | 1.34Å | 1.34Å | Aromatic |
| O1 | C25 | sing | 1.43Å | 1.43Å | |
| C1 | C7 | sing | 1.42Å | 1.40Å | Aromatic |
| C23 | C17 | sing | 1.53Å | 1.54Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| N1 | C9 | doub | 1.32Å | 1.34Å | Aromatic |
| C16 | C17 | sing | 1.53Å | 1.53Å | |
| C16 | N2 | sing | 1.47Å | 1.48Å | |
| C7 | N2 | sing | 1.39Å | 1.35Å | |
| C7 | C8 | doub | 1.38Å | 1.40Å | Aromatic |
| C17 | C26 | sing | 1.53Å | 1.53Å | |
| C17 | C18 | sing | 1.51Å | 1.50Å | |
| N2 | C19 | sing | 1.40Å | 1.34Å | |
| C9 | C8 | sing | 1.40Å | 1.41Å | Aromatic |
| C9 | C10 | sing | 1.48Å | 1.40Å | |
| C8 | C11 | sing | 1.51Å | 1.54Å | |
| C18 | C19 | doub | 1.39Å | 1.40Å | Aromatic |
| C18 | N4 | sing | 1.32Å | 1.34Å | Aromatic |
| C19 | C22 | sing | 1.40Å | 1.39Å | Aromatic |
| C10 | N3 | doub | 1.33Å | 1.35Å | Aromatic |
| C10 | C12 | sing | 1.39Å | 1.40Å | Aromatic |
| N3 | C15 | sing | 1.32Å | 1.33Å | Aromatic |
| N4 | C20 | doub | 1.32Å | 1.32Å | Aromatic |
| C12 | C13 | doub | 1.38Å | 1.39Å | Aromatic |
| C22 | C21 | doub | 1.39Å | 1.39Å | Aromatic |
| C15 | C14 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | C14 | sing | 1.39Å | 1.39Å | Aromatic |
| C20 | C21 | sing | 1.39Å | 1.40Å | Aromatic |
| C21 | N5 | sing | 1.40Å | 1.39Å | |
| N5 | C30 | sing | 1.47Å | 1.47Å | |
| N5 | C27 | sing | 1.47Å | 1.46Å | |
| C30 | C29 | sing | 1.53Å | 1.54Å | |
| C28 | C27 | sing | 1.53Å | 1.51Å | |
| C28 | O2 | sing | 1.43Å | 1.43Å | |
| C29 | O2 | sing | 1.43Å | 1.43Å | |
| C11 | H1 | sing | 1.09Å | 1.10Å | |
| C11 | H2 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.08Å | 1.08Å | |
| C14 | H5 | sing | 1.08Å | 1.08Å | |
| C16 | H6 | sing | 1.09Å | 1.10Å | |
| C16 | H7 | sing | 1.09Å | 1.10Å | |
| C22 | H8 | sing | 1.08Å | 1.08Å | |
| C23 | H9 | sing | 1.09Å | 1.10Å | |
| C23 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| C24 | H12 | sing | 1.09Å | 1.10Å | |
| C25 | H13 | sing | 1.09Å | 1.10Å | |
| C25 | H14 | sing | 1.09Å | 1.10Å | |
| C27 | H15 | sing | 1.09Å | 1.10Å | |
| C27 | H16 | sing | 1.09Å | 1.10Å | |
| C28 | H17 | sing | 1.09Å | 1.10Å | |
| C28 | H18 | sing | 1.09Å | 1.10Å | |
| C30 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.09Å | 1.10Å | |
| C26 | H21 | sing | 1.09Å | 1.10Å | |
| C26 | H22 | sing | 1.09Å | 1.10Å | |
| C20 | H23 | sing | 1.08Å | 1.08Å | |
| C29 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C6 | H26 | sing | 1.08Å | 1.08Å | |
| C5 | H27 | sing | 1.08Å | 1.08Å | |
| C3 | H28 | sing | 1.08Å | 1.08Å | |
| C12 | H29 | sing | 1.08Å | 1.08Å | |
| C15 | H30 | sing | 1.08Å | 1.08Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| F1 | C4 | C5 | 119.4° | 119.6° |
| F1 | C4 | C3 | 120.9° | 119.5° |
| C5 | C4 | C3 | 119.7° | 120.9° |
| C4 | C5 | C6 | 120.1° | 120.8° |
| C4 | C5 | H27 | 120.0° | 119.5° |
| C4 | C3 | C2 | 120.3° | 119.8° |
| C4 | C3 | H28 | 119.8° | 120.1° |
| C5 | C6 | C1 | 120.4° | 119.7° |
| C5 | C6 | H26 | 119.8° | 120.1° |
| C6 | C5 | H27 | 119.9° | 119.7° |
| C3 | C2 | C1 | 120.1° | 119.0° |
| C3 | C2 | N1 | 119.2° | 120.9° |
| C2 | C3 | H28 | 119.9° | 120.1° |
| C6 | C1 | C2 | 119.4° | 119.7° |
| C6 | C1 | C7 | 120.3° | 121.2° |
| C1 | C6 | H26 | 119.8° | 120.2° |
| O1 | C24 | C23 | 112.7° | 109.4° |
| C24 | O1 | C25 | 109.0° | 114.2° |
| O1 | C24 | H11 | 108.7° | 109.5° |
| O1 | C24 | H12 | 108.7° | 109.5° |
| C24 | C23 | C17 | 111.0° | 109.2° |
| C24 | C23 | H9 | 109.1° | 109.5° |
| C24 | C23 | H10 | 109.1° | 109.6° |
| C23 | C24 | H11 | 108.7° | 109.5° |
| C23 | C24 | H12 | 108.7° | 109.5° |
| C1 | C2 | N1 | 120.7° | 120.1° |
| C2 | C1 | C7 | 120.3° | 119.0° |
| C2 | N1 | C9 | 121.1° | 121.6° |
| O1 | C25 | C26 | 106.8° | 109.4° |
| O1 | C25 | H13 | 110.1° | 109.5° |
| O1 | C25 | H14 | 110.1° | 109.5° |
| C1 | C7 | N2 | 120.7° | 121.0° |
| C1 | C7 | C8 | 117.8° | 118.0° |
| C23 | C17 | C16 | 112.2° | 110.3° |
| C23 | C17 | C26 | 111.2° | 110.2° |
| C23 | C17 | C18 | 107.8° | 110.5° |
| C17 | C23 | H9 | 109.1° | 109.5° |
| C17 | C23 | H10 | 109.1° | 109.5° |
| C25 | C26 | C17 | 108.9° | 109.2° |
| C26 | C25 | H13 | 110.1° | 109.5° |
| C26 | C25 | H14 | 110.1° | 109.5° |
| C25 | C26 | H21 | 109.6° | 109.5° |
| C25 | C26 | H22 | 109.6° | 109.5° |
| N1 | C9 | C8 | 120.6° | 121.6° |
| N1 | C9 | C10 | 117.6° | 119.2° |
| C17 | C16 | N2 | 103.6° | 105.0° |
| C16 | C17 | C26 | 110.7° | 110.3° |
| C16 | C17 | C18 | 104.3° | 105.1° |
| C17 | C16 | H6 | 110.9° | 110.3° |
| C17 | C16 | H7 | 110.9° | 110.3° |
| C16 | N2 | C7 | 123.5° | 125.0° |
| C16 | N2 | C19 | 112.0° | 110.0° |
| N2 | C16 | H6 | 110.9° | 110.4° |
| N2 | C16 | H7 | 110.9° | 110.3° |
| N2 | C7 | C8 | 121.6° | 121.0° |
| C7 | N2 | C19 | 124.5° | 125.0° |
| C7 | C8 | C9 | 119.5° | 119.6° |
| C7 | C8 | C11 | 119.5° | 120.2° |
| C26 | C17 | C18 | 110.4° | 110.4° |
| C17 | C26 | H21 | 109.6° | 109.5° |
| C17 | C26 | H22 | 109.6° | 109.6° |
| C17 | C18 | C19 | 108.6° | 108.1° |
| C17 | C18 | N4 | 129.7° | 131.0° |
| N2 | C19 | C18 | 110.8° | 111.8° |
| N2 | C19 | C22 | 131.5° | 129.6° |
| C8 | C9 | C10 | 121.7° | 119.2° |
| C9 | C8 | C11 | 121.0° | 120.2° |
| C9 | C10 | N3 | 121.5° | 119.7° |
| C9 | C10 | C12 | 118.6° | 119.7° |
| C8 | C11 | H1 | 109.5° | 109.5° |
| C8 | C11 | H2 | 109.5° | 109.5° |
| C8 | C11 | H3 | 109.5° | 109.5° |
| C19 | C18 | N4 | 121.7° | 120.9° |
| C18 | C19 | C22 | 117.7° | 118.6° |
| C18 | N4 | C20 | 121.3° | 122.1° |
| C19 | C22 | C21 | 119.5° | 118.6° |
| C19 | C22 | H8 | 120.3° | 120.6° |
| N3 | C10 | C12 | 119.9° | 120.5° |
| C10 | N3 | C15 | 121.3° | 121.6° |
| C10 | C12 | C13 | 120.0° | 119.1° |
| C10 | C12 | H29 | 120.0° | 120.4° |
| N3 | C15 | C14 | 121.1° | 120.9° |
| N3 | C15 | H30 | 119.4° | 119.6° |
| N4 | C20 | C21 | 120.2° | 120.6° |
| N4 | C20 | H23 | 119.9° | 119.7° |
| C12 | C13 | C14 | 118.4° | 118.5° |
| C12 | C13 | H4 | 120.8° | 120.7° |
| C13 | C12 | H29 | 120.0° | 120.5° |
| C22 | C21 | C20 | 119.7° | 119.1° |
| C22 | C21 | N5 | 119.7° | 120.5° |
| C21 | C22 | H8 | 120.2° | 120.7° |
| C15 | C14 | C13 | 119.3° | 119.4° |
| C15 | C14 | H5 | 120.3° | 120.3° |
| C14 | C15 | H30 | 119.5° | 119.6° |
| C14 | C13 | H4 | 120.8° | 120.8° |
| C13 | C14 | H5 | 120.3° | 120.3° |
| C20 | C21 | N5 | 120.7° | 120.5° |
| C21 | C20 | H23 | 119.9° | 119.7° |
| C21 | N5 | C30 | 121.2° | 111.0° |
| C21 | N5 | C27 | 120.5° | 111.0° |
| C30 | N5 | C27 | 118.4° | 110.7° |
| N5 | C30 | C29 | 112.0° | 109.2° |
| N5 | C30 | H19 | 108.8° | 109.5° |
| N5 | C30 | H20 | 108.8° | 109.6° |
| N5 | C27 | C28 | 107.3° | 109.3° |
| N5 | C27 | H15 | 110.0° | 109.5° |
| N5 | C27 | H16 | 110.0° | 109.5° |
| C30 | C29 | O2 | 111.0° | 109.3° |
| C29 | C30 | H19 | 108.8° | 109.5° |
| C29 | C30 | H20 | 108.8° | 109.5° |
| C30 | C29 | H24 | 109.1° | 109.5° |
| C30 | C29 | H25 | 109.1° | 109.5° |
| C27 | C28 | O2 | 109.3° | 109.2° |
| C28 | C27 | H15 | 110.0° | 109.5° |
| C28 | C27 | H16 | 110.0° | 109.5° |
| C27 | C28 | H17 | 109.5° | 109.5° |
| C27 | C28 | H18 | 109.5° | 109.5° |
| C28 | O2 | C29 | 109.0° | 113.7° |
| O2 | C28 | H17 | 109.5° | 109.5° |
| O2 | C28 | H18 | 109.5° | 109.5° |
| O2 | C29 | H24 | 109.1° | 109.5° |
| O2 | C29 | H25 | 109.1° | 109.5° |
| H1 | C11 | H2 | 109.5° | 109.5° |
| H1 | C11 | H3 | 109.5° | 109.4° |
| H2 | C11 | H3 | 109.4° | 109.5° |
| H6 | C16 | H7 | 109.5° | 110.4° |
| H9 | C23 | H10 | 109.4° | 109.5° |
| H11 | C24 | H12 | 109.4° | 109.5° |
| H13 | C25 | H14 | 109.5° | 109.4° |
| H15 | C27 | H16 | 109.5° | 109.5° |
| H17 | C28 | H18 | 109.5° | 109.6° |
| H19 | C30 | H20 | 109.5° | 109.5° |
| H21 | C26 | H22 | 109.4° | 109.6° |
| H24 | C29 | H25 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| F1 | C4 | C5 | C3 | 179.6° | 180.0° |
| F1 | C4 | C5 | C6 | 179.5° | 180.0° |
| F1 | C4 | C3 | C2 | 179.7° | 180.0° |
| F1 | C4 | C5 | H27 | 0.5° | 0.0° |
| F1 | C4 | C3 | H28 | 0.3° | 0.0° |
| C4 | C5 | C6 | H27 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.1° | 0.1° |
| C4 | C5 | C6 | C1 | 0.2° | 0.0° |
| C4 | C5 | C6 | H26 | 179.8° | 180.0° |
| C5 | C4 | C3 | H28 | 179.9° | 180.0° |
| C3 | C4 | C5 | C6 | 0.1° | 0.0° |
| C4 | C3 | C2 | H28 | 180.0° | 180.0° |
| C4 | C3 | C2 | C1 | 0.2° | 0.1° |
| C4 | C3 | C2 | N1 | 179.9° | 180.0° |
| C3 | C4 | C5 | H27 | 179.9° | 180.0° |
| C5 | C6 | C1 | H26 | 180.0° | 180.0° |
| C5 | C6 | C1 | C2 | 0.1° | 0.0° |
| C5 | C6 | C1 | C7 | 179.8° | 180.0° |
| C3 | C2 | C1 | C6 | 0.1° | 0.1° |
| C3 | C2 | C1 | N1 | 179.7° | 180.0° |
| C3 | C2 | C1 | C7 | 179.6° | 180.0° |
| C3 | C2 | N1 | C9 | 179.4° | 179.7° |
| C6 | C1 | C2 | C7 | 179.8° | 180.0° |
| C6 | C1 | C2 | N1 | 179.8° | 180.0° |
| C6 | C1 | C7 | N2 | 0.4° | 0.0° |
| C6 | C1 | C7 | C8 | 179.9° | 179.7° |
| C1 | C6 | C5 | H27 | 179.9° | 180.0° |
| O1 | C24 | C23 | H11 | 120.5° | 120.0° |
| O1 | C24 | C23 | H12 | 120.5° | 120.0° |
| O1 | C24 | C23 | C17 | 49.2° | 56.8° |
| C24 | O1 | C25 | C26 | 70.7° | 61.5° |
| O1 | C24 | C23 | H9 | 169.4° | 63.1° |
| O1 | C24 | C23 | H10 | 71.0° | 176.8° |
| O1 | C24 | H11 | H12 | 118.5° | 120.1° |
| C24 | O1 | C25 | H13 | 169.7° | 178.5° |
| C24 | O1 | C25 | H14 | 48.9° | 58.5° |
| C23 | C24 | O1 | C25 | 63.3° | 61.5° |
| C24 | C23 | C17 | H9 | 120.2° | 119.9° |
| C24 | C23 | C17 | H10 | 120.2° | 120.0° |
| C24 | C23 | C17 | C16 | 80.4° | 66.2° |
| C24 | C23 | C17 | C26 | 44.2° | 55.8° |
| C24 | C23 | C17 | C18 | 165.3° | 178.1° |
| C24 | C23 | H9 | H10 | 119.3° | 120.1° |
| C23 | C24 | H11 | H12 | 118.6° | 120.0° |
| C1 | C2 | N1 | C9 | 0.3° | 0.3° |
| C2 | C1 | C7 | N2 | 179.8° | 180.0° |
| C2 | C1 | C7 | C8 | 0.1° | 0.3° |
| C2 | C1 | C6 | H26 | 179.9° | 180.0° |
| C1 | C2 | C3 | H28 | 179.8° | 180.0° |
| N1 | C2 | C1 | C7 | 0.0° | 0.0° |
| C2 | N1 | C9 | C8 | 0.6° | 0.3° |
| C2 | N1 | C9 | C10 | 179.0° | 180.0° |
| N1 | C2 | C3 | H28 | 0.1° | 0.0° |
| O1 | C25 | C26 | H13 | 119.6° | 120.0° |
| O1 | C25 | C26 | H14 | 119.6° | 120.0° |
| O1 | C25 | C26 | C17 | 65.6° | 56.9° |
| C25 | O1 | C24 | H11 | 57.2° | 178.5° |
| C25 | O1 | C24 | H12 | 176.2° | 58.4° |
| O1 | C25 | H13 | H14 | 121.2° | 120.0° |
| O1 | C25 | C26 | H21 | 54.3° | 176.8° |
| O1 | C25 | C26 | H22 | 174.5° | 63.1° |
| C1 | C7 | N2 | C16 | 73.4° | 90.3° |
| C1 | C7 | N2 | C8 | 179.7° | 179.7° |
| C1 | C7 | N2 | C19 | 107.0° | 89.7° |
| C1 | C7 | C8 | C9 | 0.4° | 0.4° |
| C1 | C7 | C8 | C11 | 179.8° | 179.8° |
| C7 | C1 | C6 | H26 | 0.2° | 0.1° |
| C23 | C17 | C26 | C25 | 52.8° | 55.8° |
| C23 | C17 | C16 | C26 | 124.8° | 121.9° |
| C23 | C17 | C16 | C18 | 116.4° | 119.1° |
| C23 | C17 | C16 | N2 | 109.1° | 119.1° |
| C23 | C17 | C26 | C18 | 119.6° | 122.3° |
| C23 | C17 | C18 | C19 | 114.2° | 119.1° |
| C23 | C17 | C18 | N4 | 65.5° | 61.0° |
| C23 | C17 | C16 | H6 | 131.8° | 121.9° |
| C23 | C17 | C16 | H7 | 10.0° | 0.3° |
| C17 | C23 | H9 | H10 | 119.3° | 120.1° |
| C17 | C23 | C24 | H11 | 71.3° | 176.8° |
| C17 | C23 | C24 | H12 | 169.7° | 63.2° |
| C23 | C17 | C26 | H21 | 67.1° | 175.7° |
| C23 | C17 | C26 | H22 | 172.7° | 64.1° |
| C25 | C26 | C17 | C16 | 72.5° | 66.2° |
| C25 | C26 | C17 | H21 | 119.9° | 119.9° |
| C25 | C26 | C17 | H22 | 119.9° | 119.9° |
| C25 | C26 | C17 | C18 | 172.4° | 178.1° |
| C26 | C25 | H13 | H14 | 121.2° | 120.0° |
| C25 | C26 | H21 | H22 | 120.2° | 120.1° |
| N1 | C9 | C8 | C7 | 0.7° | 0.1° |
| N1 | C9 | C8 | C10 | 178.3° | 179.7° |
| N1 | C9 | C8 | C11 | 179.6° | 180.0° |
| N1 | C9 | C10 | N3 | 116.7° | 152.7° |
| N1 | C9 | C10 | C12 | 63.4° | 26.6° |
| C17 | C16 | N2 | H6 | 119.0° | 118.9° |
| C17 | C16 | N2 | H7 | 119.1° | 118.8° |
| C17 | C16 | N2 | C7 | 172.9° | 180.0° |
| C16 | C17 | C26 | C18 | 115.0° | 115.7° |
| C17 | C16 | N2 | C19 | 7.5° | 0.0° |
| C16 | C17 | C18 | C19 | 5.2° | 0.1° |
| C16 | C17 | C18 | N4 | 175.1° | 180.0° |
| C17 | C16 | H6 | H7 | 122.7° | 122.2° |
| C16 | C17 | C23 | H9 | 39.9° | 173.9° |
| C16 | C17 | C23 | H10 | 159.4° | 53.8° |
| C16 | C17 | C26 | H21 | 167.5° | 53.7° |
| C16 | C17 | C26 | H22 | 47.4° | 173.9° |
| C16 | N2 | C7 | C19 | 179.6° | 180.0° |
| C16 | N2 | C7 | C8 | 107.0° | 90.0° |
| N2 | C16 | C17 | C26 | 126.1° | 118.9° |
| N2 | C16 | C17 | C18 | 7.3° | 0.1° |
| C16 | N2 | C19 | C18 | 4.5° | 0.1° |
| C16 | N2 | C19 | C22 | 174.7° | 180.0° |
| N2 | C16 | H6 | H7 | 122.8° | 122.2° |
| N2 | C7 | C8 | C9 | 179.9° | 180.0° |
| N2 | C7 | C8 | C11 | 0.2° | 0.1° |
| C7 | N2 | C19 | C18 | 175.9° | 179.9° |
| C7 | N2 | C19 | C22 | 4.9° | 0.0° |
| C7 | N2 | C16 | H6 | 68.1° | 61.1° |
| C7 | N2 | C16 | H7 | 53.8° | 61.1° |
| C8 | C7 | N2 | C19 | 72.6° | 89.9° |
| C7 | C8 | C9 | C11 | 179.8° | 179.9° |
| C7 | C8 | C9 | C10 | 179.0° | 179.7° |
| C7 | C8 | C11 | H1 | 89.9° | 95.9° |
| C7 | C8 | C11 | H2 | 150.1° | 144.1° |
| C7 | C8 | C11 | H3 | 30.1° | 24.1° |
| C26 | C17 | C18 | C19 | 124.2° | 118.8° |
| C26 | C17 | C18 | N4 | 56.1° | 61.1° |
| C26 | C17 | C16 | H6 | 7.0° | 0.0° |
| C26 | C17 | C16 | H7 | 114.8° | 122.2° |
| C26 | C17 | C23 | H9 | 164.4° | 64.1° |
| C26 | C17 | C23 | H10 | 76.0° | 175.8° |
| C17 | C26 | C25 | H13 | 174.8° | 176.8° |
| C17 | C26 | C25 | H14 | 54.0° | 63.2° |
| C17 | C26 | H21 | H22 | 120.3° | 120.2° |
| C17 | C18 | C19 | N2 | 0.7° | 0.1° |
| C17 | C18 | C19 | N4 | 179.7° | 179.9° |
| C17 | C18 | C19 | C22 | 180.0° | 180.0° |
| C17 | C18 | N4 | C20 | 179.9° | 179.9° |
| C18 | C17 | C16 | H6 | 111.8° | 119.0° |
| C18 | C17 | C16 | H7 | 126.4° | 118.8° |
| C18 | C17 | C23 | H9 | 74.4° | 58.2° |
| C18 | C17 | C23 | H10 | 45.1° | 61.9° |
| C18 | C17 | C26 | H21 | 52.5° | 62.0° |
| C18 | C17 | C26 | H22 | 67.6° | 58.3° |
| N2 | C19 | C18 | C22 | 179.4° | 179.9° |
| N2 | C19 | C18 | N4 | 179.6° | 180.0° |
| N2 | C19 | C22 | C21 | 179.3° | 180.0° |
| C19 | N2 | C16 | H6 | 111.5° | 118.9° |
| C19 | N2 | C16 | H7 | 126.6° | 118.8° |
| N2 | C19 | C22 | H8 | 0.7° | 0.1° |
| C8 | C9 | C10 | N3 | 64.9° | 27.6° |
| C8 | C9 | C10 | C12 | 115.0° | 153.1° |
| C9 | C8 | C11 | H1 | 89.9° | 84.2° |
| C9 | C8 | C11 | H2 | 30.2° | 35.8° |
| C9 | C8 | C11 | H3 | 150.1° | 155.8° |
| C10 | C9 | C8 | C11 | 1.3° | 0.2° |
| C9 | C10 | N3 | C12 | 179.9° | 179.3° |
| C9 | C10 | N3 | C15 | 179.8° | 179.9° |
| C9 | C10 | C12 | C13 | 179.8° | 179.8° |
| C9 | C10 | C12 | H29 | 0.2° | 0.2° |
| C8 | C11 | H1 | H2 | 120.0° | 120.0° |
| C8 | C11 | H1 | H3 | 120.0° | 120.0° |
| C8 | C11 | H2 | H3 | 120.0° | 120.0° |
| C19 | C18 | N4 | C20 | 0.5° | 0.0° |
| C18 | C19 | C22 | C21 | 0.2° | 0.1° |
| C18 | C19 | C22 | H8 | 179.8° | 180.0° |
| N4 | C18 | C19 | C22 | 0.2° | 0.0° |
| C18 | N4 | C20 | C21 | 0.6° | 0.0° |
| C18 | N4 | C20 | H23 | 179.5° | 180.0° |
| C19 | C22 | C21 | H8 | 180.0° | 179.9° |
| C19 | C22 | C21 | C20 | 0.3° | 0.1° |
| C19 | C22 | C21 | N5 | 179.8° | 180.0° |
| N3 | C10 | C12 | C13 | 0.0° | 0.5° |
| C10 | N3 | C15 | C14 | 0.1° | 0.6° |
| N3 | C10 | C12 | H29 | 179.9° | 179.5° |
| C10 | N3 | C15 | H30 | 179.9° | 179.6° |
| C12 | C10 | N3 | C15 | 0.1° | 0.8° |
| C10 | C12 | C13 | H29 | 180.0° | 179.9° |
| C10 | C12 | C13 | C14 | 0.0° | 0.0° |
| C10 | C12 | C13 | H4 | 179.9° | 179.8° |
| N3 | C15 | C14 | H30 | 180.0° | 179.9° |
| N3 | C15 | C14 | C13 | 0.0° | 0.0° |
| N3 | C15 | C14 | H5 | 180.0° | 180.0° |
| N4 | C20 | C21 | C22 | 0.5° | 0.0° |
| N4 | C20 | C21 | H23 | 180.0° | 180.0° |
| N4 | C20 | C21 | N5 | 179.6° | 180.0° |
| C12 | C13 | C14 | C15 | 0.1° | 0.2° |
| C12 | C13 | C14 | H4 | 180.0° | 179.8° |
| C12 | C13 | C14 | H5 | 179.9° | 179.8° |
| C22 | C21 | C20 | N5 | 180.0° | 180.0° |
| C22 | C21 | N5 | C30 | 19.3° | 180.0° |
| C22 | C21 | N5 | C27 | 160.6° | 56.4° |
| C22 | C21 | C20 | H23 | 179.5° | 180.0° |
| C15 | C14 | C13 | H5 | 180.0° | 180.0° |
| C15 | C14 | C13 | H4 | 179.9° | 180.0° |
| C14 | C13 | C12 | H29 | 180.0° | 180.0° |
| C13 | C14 | C15 | H30 | 180.0° | 179.9° |
| C20 | C21 | N5 | C30 | 160.6° | 0.0° |
| C20 | C21 | N5 | C27 | 19.4° | 123.6° |
| C20 | C21 | C22 | H8 | 179.7° | 180.0° |
| C21 | N5 | C30 | C27 | 180.0° | 123.8° |
| C21 | N5 | C30 | C29 | 141.3° | 177.7° |
| C21 | N5 | C27 | C28 | 133.6° | 177.6° |
| N5 | C21 | C22 | H8 | 0.2° | 0.0° |
| C21 | N5 | C27 | H15 | 13.9° | 62.4° |
| C21 | N5 | C27 | H16 | 106.8° | 57.7° |
| C21 | N5 | C30 | H19 | 98.4° | 62.4° |
| C21 | N5 | C30 | H20 | 20.9° | 57.7° |
| N5 | C21 | C20 | H23 | 0.4° | 0.0° |
| N5 | C30 | C29 | H19 | 120.4° | 119.9° |
| N5 | C30 | C29 | H20 | 120.3° | 120.0° |
| C30 | N5 | C27 | C28 | 46.4° | 58.6° |
| N5 | C30 | C29 | O2 | 43.6° | 56.8° |
| C30 | N5 | C27 | H15 | 166.0° | 61.4° |
| C30 | N5 | C27 | H16 | 73.3° | 178.6° |
| N5 | C30 | H19 | H20 | 118.8° | 120.1° |
| N5 | C30 | C29 | H24 | 163.9° | 176.8° |
| N5 | C30 | C29 | H25 | 76.6° | 63.1° |
| C27 | N5 | C30 | C29 | 38.7° | 58.6° |
| N5 | C27 | C28 | H15 | 119.6° | 120.0° |
| N5 | C27 | C28 | H16 | 119.7° | 119.9° |
| N5 | C27 | C28 | O2 | 61.0° | 56.9° |
| N5 | C27 | H15 | H16 | 121.0° | 120.1° |
| N5 | C27 | C28 | H17 | 59.0° | 63.0° |
| N5 | C27 | C28 | H18 | 179.1° | 176.8° |
| C27 | N5 | C30 | H19 | 81.7° | 61.4° |
| C27 | N5 | C30 | H20 | 159.1° | 178.6° |
| C30 | C29 | O2 | C28 | 60.7° | 58.7° |
| C30 | C29 | O2 | H24 | 120.2° | 119.9° |
| C30 | C29 | O2 | H25 | 120.2° | 120.0° |
| C29 | C30 | H19 | H20 | 118.9° | 120.1° |
| C30 | C29 | H24 | H25 | 119.3° | 120.1° |
| C27 | C28 | O2 | H17 | 120.0° | 119.9° |
| C27 | C28 | O2 | H18 | 119.9° | 119.9° |
| C27 | C28 | O2 | C29 | 71.0° | 58.7° |
| C28 | C27 | H15 | H16 | 121.0° | 120.1° |
| C27 | C28 | H17 | H18 | 120.1° | 120.1° |
| O2 | C28 | C27 | H15 | 179.4° | 63.1° |
| O2 | C28 | C27 | H16 | 58.7° | 176.8° |
| O2 | C28 | H17 | H18 | 120.1° | 120.1° |
| C28 | O2 | C29 | H24 | 179.1° | 178.6° |
| C28 | O2 | C29 | H25 | 59.6° | 61.3° |
| C29 | O2 | C28 | H17 | 49.0° | 61.2° |
| C29 | O2 | C28 | H18 | 169.0° | 178.6° |
| O2 | C29 | C30 | H19 | 76.7° | 63.0° |
| O2 | C29 | C30 | H20 | 163.9° | 176.8° |
| O2 | C29 | H24 | H25 | 119.3° | 120.1° |
| H1 | C11 | H2 | H3 | 120.0° | 119.9° |
| H4 | C13 | C14 | H5 | 0.1° | 0.0° |
| H4 | C13 | C12 | H29 | 0.0° | 0.2° |
| H5 | C14 | C15 | H30 | 0.0° | 0.1° |
| H9 | C23 | C24 | H11 | 48.9° | 56.9° |
| H9 | C23 | C24 | H12 | 70.1° | 176.9° |
| H10 | C23 | C24 | H11 | 168.5° | 63.2° |
| H10 | C23 | C24 | H12 | 49.4° | 56.8° |
| H13 | C25 | C26 | H21 | 65.3° | 63.3° |
| H13 | C25 | C26 | H22 | 54.9° | 56.9° |
| H14 | C25 | C26 | H21 | 173.9° | 56.7° |
| H14 | C25 | C26 | H22 | 66.0° | 176.9° |
| H15 | C27 | C28 | H17 | 60.7° | 177.0° |
| H15 | C27 | C28 | H18 | 59.4° | 56.8° |
| H16 | C27 | C28 | H17 | 178.6° | 56.9° |
| H16 | C27 | C28 | H18 | 61.3° | 63.3° |
| H19 | C30 | C29 | H24 | 43.5° | 56.9° |
| H19 | C30 | C29 | H25 | 163.0° | 177.0° |
| H20 | C30 | C29 | H24 | 75.8° | 63.2° |
| H20 | C30 | C29 | H25 | 43.7° | 56.9° |
| H26 | C6 | C5 | H27 | 0.2° | 0.1° |
