A1L8Z
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C13 | C12 | doub | 1.38Å | 1.39Å | Aromatic |
| C13 | C14 | sing | 1.38Å | 1.43Å | Aromatic |
| C12 | C11 | sing | 1.38Å | 1.42Å | Aromatic |
| C14 | C15 | doub | 1.38Å | 1.40Å | Aromatic |
| C11 | C10 | doub | 1.38Å | 1.40Å | Aromatic |
| C15 | C10 | sing | 1.38Å | 1.45Å | Aromatic |
| C10 | C9 | sing | 1.51Å | 1.62Å | |
| C9 | N1 | sing | 1.47Å | 1.51Å | |
| N1 | C8 | sing | 1.35Å | 1.46Å | |
| C8 | C7 | sing | 1.51Å | 1.62Å | |
| C8 | O1 | doub | 1.21Å | 1.21Å | |
| C7 | C6 | sing | 1.51Å | 1.57Å | |
| F1 | C5 | sing | 1.35Å | 1.30Å | |
| C6 | C5 | doub | 1.39Å | 1.47Å | Aromatic |
| C6 | C1 | sing | 1.38Å | 1.41Å | Aromatic |
| C5 | C4 | sing | 1.38Å | 1.42Å | Aromatic |
| C1 | C2 | doub | 1.38Å | 1.46Å | Aromatic |
| C4 | C3 | doub | 1.39Å | 1.46Å | Aromatic |
| C2 | C3 | sing | 1.39Å | 1.42Å | Aromatic |
| C3 | C16 | sing | 1.48Å | 1.62Å | |
| C16 | C21 | doub | 1.39Å | 1.47Å | Aromatic |
| C16 | C17 | sing | 1.39Å | 1.42Å | Aromatic |
| C21 | C20 | sing | 1.38Å | 1.41Å | Aromatic |
| C17 | C18 | doub | 1.38Å | 1.45Å | Aromatic |
| C20 | C19 | doub | 1.39Å | 1.46Å | Aromatic |
| C18 | C19 | sing | 1.39Å | 1.41Å | Aromatic |
| C19 | O2 | sing | 1.36Å | 1.41Å | |
| C23 | C22 | sing | 1.53Å | 1.56Å | |
| C23 | N2 | sing | 1.47Å | 1.48Å | |
| O2 | C22 | sing | 1.43Å | 1.43Å | |
| C27 | N2 | sing | 1.47Å | 1.47Å | |
| C27 | C26 | sing | 1.53Å | 1.53Å | |
| N2 | C24 | sing | 1.46Å | 1.45Å | |
| C26 | N3 | sing | 1.47Å | 1.51Å | |
| C24 | C25 | sing | 1.53Å | 1.57Å | |
| F2 | C30 | sing | 1.40Å | 1.29Å | |
| C30 | C29 | sing | 1.53Å | 1.58Å | |
| C30 | C31 | sing | 1.53Å | 1.53Å | |
| N3 | C25 | sing | 1.47Å | 1.53Å | |
| N3 | C28 | sing | 1.35Å | 1.47Å | |
| C29 | C28 | sing | 1.51Å | 1.61Å | |
| C29 | C31 | sing | 1.53Å | 1.56Å | |
| C28 | O3 | doub | 1.21Å | 1.23Å | |
| N1 | H6 | sing | 0.97Å | 1.00Å | |
| C4 | H3 | sing | 1.08Å | 1.08Å | |
| C7 | H5 | sing | 1.09Å | 1.10Å | |
| C7 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C15 | H13 | sing | 1.08Å | 1.08Å | |
| C17 | H14 | sing | 1.08Å | 1.08Å | |
| C20 | H16 | sing | 1.08Å | 1.08Å | |
| C21 | H17 | sing | 1.08Å | 1.08Å | |
| C22 | H18 | sing | 1.09Å | 1.10Å | |
| C22 | H19 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H22 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C26 | H27 | sing | 1.09Å | 1.10Å | |
| C1 | H1 | sing | 1.08Å | 1.08Å | |
| C11 | H9 | sing | 1.08Å | 1.08Å | |
| C12 | H10 | sing | 1.08Å | 1.08Å | |
| C14 | H12 | sing | 1.08Å | 1.08Å | |
| C18 | H15 | sing | 1.08Å | 1.08Å | |
| C2 | H2 | sing | 1.08Å | 1.08Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C23 | H20 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H28 | sing | 1.09Å | 1.10Å | |
| C29 | H30 | sing | 1.09Å | 1.10Å | |
| C30 | H31 | sing | 1.09Å | 1.10Å | |
| C31 | H32 | sing | 1.09Å | 1.10Å | |
| C31 | H33 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å | |
| C9 | H7 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C12 | C13 | C14 | 120.8° | 120.0° |
| C13 | C12 | C11 | 119.8° | 120.0° |
| C12 | C13 | H11 | 119.6° | 120.0° |
| C13 | C12 | H10 | 120.1° | 120.0° |
| C13 | C14 | C15 | 119.3° | 120.0° |
| C14 | C13 | H11 | 119.6° | 120.0° |
| C13 | C14 | H12 | 120.3° | 120.0° |
| C12 | C11 | C10 | 121.1° | 120.0° |
| C12 | C11 | H9 | 119.4° | 120.0° |
| C11 | C12 | H10 | 120.1° | 120.0° |
| C14 | C15 | C10 | 120.8° | 120.0° |
| C14 | C15 | H13 | 119.6° | 120.0° |
| C15 | C14 | H12 | 120.4° | 120.1° |
| C11 | C10 | C15 | 118.1° | 120.0° |
| C11 | C10 | C9 | 118.4° | 120.0° |
| C10 | C11 | H9 | 119.4° | 119.9° |
| C15 | C10 | C9 | 123.5° | 120.0° |
| C10 | C15 | H13 | 119.6° | 120.0° |
| C10 | C9 | N1 | 107.0° | 109.5° |
| C10 | C9 | H8 | 110.1° | 109.4° |
| C10 | C9 | H7 | 110.1° | 109.5° |
| C9 | N1 | C8 | 128.8° | 120.0° |
| C9 | N1 | H6 | 115.6° | 120.0° |
| N1 | C9 | H8 | 110.1° | 109.5° |
| N1 | C9 | H7 | 110.1° | 109.5° |
| N1 | C8 | C7 | 126.8° | 120.0° |
| N1 | C8 | O1 | 117.3° | 120.0° |
| C8 | N1 | H6 | 115.6° | 120.0° |
| C7 | C8 | O1 | 115.9° | 120.0° |
| C8 | C7 | C6 | 104.5° | 109.5° |
| C8 | C7 | H5 | 110.7° | 109.5° |
| C8 | C7 | H4 | 110.7° | 109.4° |
| C7 | C6 | C5 | 115.7° | 119.9° |
| C7 | C6 | C1 | 124.1° | 119.9° |
| C6 | C7 | H5 | 110.7° | 109.4° |
| C6 | C7 | H4 | 110.7° | 109.5° |
| F1 | C5 | C6 | 124.0° | 120.0° |
| F1 | C5 | C4 | 117.2° | 120.0° |
| C5 | C6 | C1 | 120.2° | 120.3° |
| C6 | C5 | C4 | 118.9° | 120.0° |
| C6 | C1 | C2 | 120.6° | 120.1° |
| C6 | C1 | H1 | 119.7° | 120.0° |
| C5 | C4 | C3 | 121.1° | 119.8° |
| C5 | C4 | H3 | 119.5° | 120.0° |
| C1 | C2 | C3 | 120.0° | 119.9° |
| C2 | C1 | H1 | 119.7° | 119.9° |
| C1 | C2 | H2 | 120.0° | 120.0° |
| C4 | C3 | C2 | 119.2° | 119.8° |
| C4 | C3 | C16 | 113.7° | 120.1° |
| C3 | C4 | H3 | 119.4° | 120.1° |
| C2 | C3 | C16 | 127.1° | 120.1° |
| C3 | C2 | H2 | 120.0° | 120.1° |
| C3 | C16 | C21 | 121.1° | 120.0° |
| C3 | C16 | C17 | 120.5° | 120.1° |
| C21 | C16 | C17 | 118.3° | 119.8° |
| C16 | C21 | C20 | 120.7° | 120.0° |
| C16 | C21 | H17 | 119.7° | 120.0° |
| C16 | C17 | C18 | 121.2° | 119.9° |
| C16 | C17 | H14 | 119.4° | 120.0° |
| C21 | C20 | C19 | 119.6° | 120.1° |
| C21 | C20 | H16 | 120.2° | 120.0° |
| C20 | C21 | H17 | 119.6° | 120.0° |
| C17 | C18 | C19 | 119.9° | 120.1° |
| C18 | C17 | H14 | 119.4° | 120.1° |
| C17 | C18 | H15 | 120.1° | 119.9° |
| C20 | C19 | C18 | 120.4° | 120.2° |
| C20 | C19 | O2 | 121.1° | 120.0° |
| C19 | C20 | H16 | 120.2° | 120.0° |
| C18 | C19 | O2 | 118.5° | 119.9° |
| C19 | C18 | H15 | 120.0° | 120.0° |
| C19 | O2 | C22 | 120.5° | 117.1° |
| C22 | C23 | N2 | 109.6° | 109.5° |
| C23 | C22 | O2 | 109.7° | 109.5° |
| C23 | C22 | H18 | 109.4° | 109.5° |
| C23 | C22 | H19 | 109.4° | 109.5° |
| C22 | C23 | H21 | 109.4° | 109.5° |
| C22 | C23 | H20 | 109.4° | 109.5° |
| C23 | N2 | C27 | 104.6° | 111.0° |
| C23 | N2 | C24 | 107.1° | 111.1° |
| N2 | C23 | H21 | 109.4° | 109.4° |
| N2 | C23 | H20 | 109.5° | 109.5° |
| O2 | C22 | H18 | 109.4° | 109.5° |
| O2 | C22 | H19 | 109.4° | 109.5° |
| N2 | C27 | C26 | 108.6° | 109.3° |
| C27 | N2 | C24 | 99.8° | 111.3° |
| N2 | C27 | H29 | 109.7° | 109.5° |
| N2 | C27 | H28 | 109.7° | 109.5° |
| C27 | C26 | N3 | 109.9° | 108.5° |
| C27 | C26 | H26 | 109.4° | 109.6° |
| C27 | C26 | H27 | 109.3° | 109.8° |
| C26 | C27 | H29 | 109.7° | 109.4° |
| C26 | C27 | H28 | 109.7° | 109.5° |
| N2 | C24 | C25 | 113.0° | 109.6° |
| N2 | C24 | H23 | 108.6° | 109.6° |
| N2 | C24 | H22 | 108.6° | 109.2° |
| C26 | N3 | C25 | 114.7° | 118.2° |
| C26 | N3 | C28 | 127.3° | 120.9° |
| N3 | C26 | H26 | 109.4° | 109.6° |
| N3 | C26 | H27 | 109.4° | 109.6° |
| C24 | C25 | N3 | 117.5° | 108.5° |
| C25 | C24 | H23 | 108.6° | 109.5° |
| C25 | C24 | H22 | 108.6° | 109.5° |
| C24 | C25 | H25 | 107.4° | 109.7° |
| C24 | C25 | H24 | 107.4° | 109.6° |
| F2 | C30 | C29 | 107.5° | 117.5° |
| F2 | C30 | C31 | 133.1° | 117.5° |
| F2 | C30 | H31 | 115.2° | 115.5° |
| C29 | C30 | C31 | 60.1° | 60.0° |
| C30 | C29 | C28 | 123.4° | 117.5° |
| C30 | C29 | C31 | 58.2° | 60.0° |
| C30 | C29 | H30 | 112.6° | 117.5° |
| C29 | C30 | H31 | 110.4° | 117.5° |
| C30 | C31 | C29 | 61.7° | 60.0° |
| C31 | C30 | H31 | 111.2° | 117.5° |
| C30 | C31 | H32 | 119.7° | 117.5° |
| C30 | C31 | H33 | 119.7° | 117.5° |
| C25 | N3 | C28 | 118.0° | 120.9° |
| N3 | C25 | H25 | 107.4° | 109.6° |
| N3 | C25 | H24 | 107.4° | 109.6° |
| N3 | C28 | C29 | 127.1° | 120.0° |
| N3 | C28 | O3 | 116.8° | 120.0° |
| C28 | C29 | C31 | 127.0° | 117.5° |
| C29 | C28 | O3 | 116.0° | 120.0° |
| C28 | C29 | H30 | 112.3° | 115.5° |
| C31 | C29 | H30 | 113.0° | 117.5° |
| C29 | C31 | H32 | 119.7° | 117.5° |
| C29 | C31 | H33 | 119.7° | 117.6° |
| H5 | C7 | H4 | 109.5° | 109.6° |
| H18 | C22 | H19 | 109.5° | 109.4° |
| H23 | C24 | H22 | 109.5° | 109.5° |
| H26 | C26 | H27 | 109.4° | 109.6° |
| H21 | C23 | H20 | 109.5° | 109.4° |
| H25 | C25 | H24 | 109.5° | 109.8° |
| H29 | C27 | H28 | 109.4° | 109.6° |
| H32 | C31 | H33 | 109.5° | 115.5° |
| H8 | C9 | H7 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C12 | C13 | C14 | H11 | 180.0° | 179.7° |
| C13 | C12 | C11 | H10 | 180.0° | 179.7° |
| C12 | C13 | C14 | C15 | 0.4° | 0.3° |
| C13 | C12 | C11 | C10 | 0.0° | 0.1° |
| C13 | C12 | C11 | H9 | 180.0° | 180.0° |
| C12 | C13 | C14 | H12 | 179.6° | 180.0° |
| C14 | C13 | C12 | C11 | 0.4° | 0.3° |
| C13 | C14 | C15 | H12 | 180.0° | 179.7° |
| C13 | C14 | C15 | C10 | 0.1° | 0.0° |
| C13 | C14 | C15 | H13 | 179.9° | 180.0° |
| C14 | C13 | C12 | H10 | 179.7° | 180.0° |
| C12 | C11 | C10 | H9 | 180.0° | 179.9° |
| C12 | C11 | C10 | C15 | 0.3° | 0.2° |
| C12 | C11 | C10 | C9 | 178.5° | 179.9° |
| C11 | C12 | C13 | H11 | 179.6° | 180.0° |
| C14 | C15 | C10 | C11 | 0.3° | 0.2° |
| C14 | C15 | C10 | H13 | 180.0° | 179.9° |
| C14 | C15 | C10 | C9 | 178.4° | 180.0° |
| C15 | C14 | C13 | H11 | 179.6° | 180.0° |
| C11 | C10 | C15 | C9 | 178.1° | 179.8° |
| C11 | C10 | C9 | N1 | 130.2° | 90.3° |
| C11 | C10 | C15 | H13 | 179.7° | 179.7° |
| C10 | C11 | C12 | H10 | 180.0° | 179.8° |
| C11 | C10 | C9 | H8 | 10.6° | 149.8° |
| C11 | C10 | C9 | H7 | 110.2° | 29.7° |
| C15 | C10 | C9 | N1 | 47.9° | 90.0° |
| C15 | C10 | C11 | H9 | 179.7° | 179.7° |
| C10 | C15 | C14 | H12 | 180.0° | 179.7° |
| C15 | C10 | C9 | H8 | 167.5° | 30.0° |
| C15 | C10 | C9 | H7 | 71.7° | 150.0° |
| C10 | C9 | N1 | H8 | 119.6° | 119.9° |
| C10 | C9 | N1 | H7 | 119.6° | 120.0° |
| C10 | C9 | N1 | C8 | 122.6° | 180.0° |
| C10 | C9 | N1 | H6 | 57.4° | 0.3° |
| C9 | C10 | C15 | H13 | 1.6° | 0.0° |
| C9 | C10 | C11 | H9 | 1.5° | 0.0° |
| C10 | C9 | H8 | H7 | 121.1° | 120.0° |
| C9 | N1 | C8 | H6 | 180.0° | 179.7° |
| C9 | N1 | C8 | C7 | 0.1° | 179.7° |
| C9 | N1 | C8 | O1 | 179.5° | 0.3° |
| N1 | C9 | H8 | H7 | 121.2° | 120.0° |
| N1 | C8 | C7 | O1 | 179.5° | 180.0° |
| N1 | C8 | C7 | C6 | 130.6° | 180.0° |
| N1 | C8 | C7 | H5 | 11.4° | 60.0° |
| N1 | C8 | C7 | H4 | 110.2° | 60.1° |
| C8 | N1 | C9 | H8 | 117.8° | 60.1° |
| C8 | N1 | C9 | H7 | 3.0° | 60.0° |
| C8 | C7 | C6 | H5 | 119.2° | 120.0° |
| C8 | C7 | C6 | H4 | 119.2° | 119.9° |
| C8 | C7 | C6 | C5 | 106.7° | 85.0° |
| C8 | C7 | C6 | C1 | 71.1° | 95.0° |
| C7 | C8 | N1 | H6 | 179.9° | 0.0° |
| C8 | C7 | H5 | H4 | 122.3° | 120.0° |
| O1 | C8 | C7 | C6 | 48.9° | 0.0° |
| O1 | C8 | N1 | H6 | 0.6° | 179.9° |
| O1 | C8 | C7 | H5 | 168.2° | 119.9° |
| O1 | C8 | C7 | H4 | 70.3° | 120.0° |
| C7 | C6 | C5 | F1 | 2.4° | 0.0° |
| C7 | C6 | C5 | C1 | 177.9° | 180.0° |
| C7 | C6 | C5 | C4 | 179.4° | 179.9° |
| C7 | C6 | C1 | C2 | 178.7° | 180.0° |
| C6 | C7 | H5 | H4 | 122.3° | 120.0° |
| C7 | C6 | C1 | H1 | 1.3° | 0.0° |
| F1 | C5 | C6 | C4 | 178.2° | 180.0° |
| F1 | C5 | C6 | C1 | 179.7° | 180.0° |
| F1 | C5 | C4 | C3 | 178.7° | 180.0° |
| F1 | C5 | C4 | H3 | 1.3° | 0.3° |
| C5 | C6 | C1 | C2 | 0.9° | 0.0° |
| C6 | C5 | C4 | C3 | 0.4° | 0.1° |
| C6 | C5 | C4 | H3 | 179.6° | 179.7° |
| C5 | C6 | C7 | H5 | 12.6° | 155.0° |
| C5 | C6 | C7 | H4 | 134.1° | 35.0° |
| C5 | C6 | C1 | H1 | 179.1° | 180.0° |
| C1 | C6 | C5 | C4 | 1.4° | 0.1° |
| C6 | C1 | C2 | H1 | 180.0° | 180.0° |
| C6 | C1 | C2 | C3 | 0.7° | 0.0° |
| C1 | C6 | C7 | H5 | 169.6° | 25.0° |
| C1 | C6 | C7 | H4 | 48.1° | 145.1° |
| C6 | C1 | C2 | H2 | 179.3° | 179.9° |
| C5 | C4 | C3 | H3 | 180.0° | 179.7° |
| C5 | C4 | C3 | C2 | 1.2° | 0.0° |
| C5 | C4 | C3 | C16 | 178.9° | 179.7° |
| C1 | C2 | C3 | C4 | 1.7° | 0.0° |
| C1 | C2 | C3 | H2 | 180.0° | 179.9° |
| C1 | C2 | C3 | C16 | 179.1° | 179.8° |
| C4 | C3 | C2 | C16 | 177.4° | 179.8° |
| C4 | C3 | C16 | C21 | 35.6° | 180.0° |
| C4 | C3 | C16 | C17 | 140.8° | 0.0° |
| C4 | C3 | C2 | H2 | 178.3° | 179.9° |
| C2 | C3 | C16 | C21 | 146.9° | 0.3° |
| C2 | C3 | C16 | C17 | 36.7° | 179.8° |
| C2 | C3 | C4 | H3 | 178.8° | 179.7° |
| C3 | C2 | C1 | H1 | 179.3° | 180.0° |
| C3 | C16 | C21 | C17 | 176.5° | 179.9° |
| C3 | C16 | C21 | C20 | 177.7° | 179.4° |
| C3 | C16 | C17 | C18 | 177.9° | 180.0° |
| C16 | C3 | C4 | H3 | 1.1° | 0.1° |
| C3 | C16 | C17 | H14 | 2.1° | 0.3° |
| C3 | C16 | C21 | H17 | 2.3° | 0.2° |
| C16 | C3 | C2 | H2 | 0.9° | 0.3° |
| C16 | C21 | C20 | H17 | 180.0° | 179.3° |
| C21 | C16 | C17 | C18 | 1.4° | 0.1° |
| C16 | C21 | C20 | C19 | 0.1° | 0.8° |
| C21 | C16 | C17 | H14 | 178.6° | 179.7° |
| C16 | C21 | C20 | H16 | 179.8° | 179.8° |
| C17 | C16 | C21 | C20 | 1.2° | 0.5° |
| C16 | C17 | C18 | H14 | 180.0° | 179.6° |
| C16 | C17 | C18 | C19 | 0.3° | 0.4° |
| C17 | C16 | C21 | H17 | 178.8° | 179.7° |
| C16 | C17 | C18 | H15 | 179.7° | 179.7° |
| C21 | C20 | C19 | H16 | 180.0° | 179.5° |
| C21 | C20 | C19 | C18 | 1.3° | 0.5° |
| C21 | C20 | C19 | O2 | 179.3° | 180.0° |
| C17 | C18 | C19 | C20 | 1.1° | 0.1° |
| C17 | C18 | C19 | H15 | 180.0° | 179.9° |
| C17 | C18 | C19 | O2 | 179.1° | 179.4° |
| C20 | C19 | C18 | O2 | 178.0° | 179.5° |
| C20 | C19 | O2 | C22 | 28.9° | 180.0° |
| C19 | C20 | C21 | H17 | 179.9° | 179.9° |
| C20 | C19 | C18 | H15 | 178.9° | 180.0° |
| C18 | C19 | O2 | C22 | 153.1° | 0.5° |
| C19 | C18 | C17 | H14 | 179.7° | 180.0° |
| C18 | C19 | C20 | H16 | 178.7° | 180.0° |
| C19 | O2 | C22 | C23 | 97.0° | 180.0° |
| O2 | C19 | C20 | H16 | 0.7° | 0.6° |
| C19 | O2 | C22 | H18 | 143.0° | 59.9° |
| C19 | O2 | C22 | H19 | 23.0° | 60.0° |
| O2 | C19 | C18 | H15 | 0.9° | 0.5° |
| C22 | C23 | N2 | H21 | 120.0° | 120.0° |
| C22 | C23 | N2 | H20 | 120.0° | 120.0° |
| C23 | C22 | O2 | H18 | 120.0° | 120.1° |
| C23 | C22 | O2 | H19 | 120.0° | 120.0° |
| C22 | C23 | N2 | C27 | 171.6° | 75.8° |
| C22 | C23 | N2 | C24 | 66.3° | 159.8° |
| C23 | C22 | H18 | H19 | 119.9° | 120.0° |
| C22 | C23 | H21 | H20 | 119.9° | 120.0° |
| N2 | C23 | C22 | O2 | 109.7° | 65.0° |
| C23 | N2 | C27 | C24 | 110.7° | 124.3° |
| C23 | N2 | C27 | C26 | 167.3° | 172.7° |
| C23 | N2 | C24 | C25 | 171.5° | 172.9° |
| N2 | C23 | C22 | H18 | 10.4° | 174.9° |
| N2 | C23 | C22 | H19 | 130.3° | 55.0° |
| C23 | N2 | C24 | H23 | 51.0° | 52.7° |
| C23 | N2 | C24 | H22 | 67.9° | 67.1° |
| N2 | C23 | H21 | H20 | 120.0° | 120.0° |
| C23 | N2 | C27 | H29 | 47.4° | 67.4° |
| C23 | N2 | C27 | H28 | 72.8° | 52.7° |
| O2 | C22 | H18 | H19 | 119.9° | 119.9° |
| O2 | C22 | C23 | H21 | 10.4° | 175.0° |
| O2 | C22 | C23 | H20 | 130.3° | 55.1° |
| N2 | C27 | C26 | H29 | 119.9° | 119.9° |
| N2 | C27 | C26 | H28 | 119.9° | 120.0° |
| N2 | C27 | C26 | N3 | 65.5° | 53.9° |
| C27 | N2 | C24 | C25 | 62.8° | 62.9° |
| C27 | N2 | C24 | H23 | 57.8° | 177.0° |
| C27 | N2 | C24 | H22 | 176.7° | 57.1° |
| N2 | C27 | C26 | H26 | 54.6° | 173.6° |
| N2 | C27 | C26 | H27 | 174.4° | 65.9° |
| C27 | N2 | C23 | H21 | 68.3° | 44.2° |
| C27 | N2 | C23 | H20 | 51.6° | 164.1° |
| N2 | C27 | H29 | H28 | 120.4° | 120.1° |
| C26 | C27 | N2 | C24 | 82.0° | 63.0° |
| C27 | C26 | N3 | H26 | 120.1° | 119.7° |
| C27 | C26 | N3 | H27 | 120.1° | 119.9° |
| C27 | C26 | N3 | C25 | 28.2° | 51.2° |
| C27 | C26 | N3 | C28 | 149.5° | 128.5° |
| C27 | C26 | H26 | H27 | 119.8° | 120.6° |
| C26 | C27 | H29 | H28 | 120.4° | 120.1° |
| N2 | C24 | C25 | H23 | 120.5° | 120.2° |
| N2 | C24 | C25 | H22 | 120.5° | 119.8° |
| N2 | C24 | C25 | N3 | 32.5° | 53.6° |
| N2 | C24 | H23 | H22 | 118.4° | 119.7° |
| C24 | N2 | C23 | H21 | 173.7° | 80.2° |
| C24 | N2 | C23 | H20 | 53.7° | 39.7° |
| N2 | C24 | C25 | H25 | 153.6° | 66.1° |
| N2 | C24 | C25 | H24 | 88.7° | 173.3° |
| C24 | N2 | C27 | H29 | 158.1° | 56.8° |
| C24 | N2 | C27 | H28 | 37.9° | 177.0° |
| C26 | N3 | C25 | C24 | 13.5° | 51.0° |
| C26 | N3 | C25 | C28 | 178.0° | 179.7° |
| C26 | N3 | C28 | C29 | 4.5° | 0.3° |
| C26 | N3 | C28 | O3 | 179.9° | 179.7° |
| N3 | C26 | H26 | H27 | 119.8° | 120.4° |
| C26 | N3 | C25 | H25 | 134.6° | 68.8° |
| C26 | N3 | C25 | H24 | 107.7° | 170.7° |
| N3 | C26 | C27 | H29 | 174.6° | 66.1° |
| N3 | C26 | C27 | H28 | 54.4° | 173.8° |
| C24 | C25 | N3 | H25 | 121.1° | 119.8° |
| C24 | C25 | N3 | H24 | 121.1° | 119.7° |
| C24 | C25 | N3 | C28 | 164.5° | 128.8° |
| C25 | C24 | H23 | H22 | 118.4° | 120.1° |
| C24 | C25 | H25 | H24 | 116.3° | 120.5° |
| F2 | C30 | C29 | C31 | 130.3° | 107.5° |
| F2 | C30 | C29 | H31 | 126.4° | 144.9° |
| F2 | C30 | C31 | H31 | 171.7° | 144.9° |
| F2 | C30 | C29 | C28 | 113.8° | 145.0° |
| F2 | C30 | C29 | H30 | 26.4° | 0.0° |
| F2 | C30 | C31 | H32 | 163.8° | 0.1° |
| F2 | C30 | C31 | H33 | 23.6° | 144.9° |
| C29 | C30 | C31 | H31 | 102.0° | 107.5° |
| C30 | C29 | C28 | N3 | 14.2° | 111.4° |
| C30 | C29 | C28 | C31 | 72.9° | 68.6° |
| C30 | C29 | C28 | H30 | 140.3° | 145.7° |
| C30 | C29 | C31 | H30 | 103.2° | 107.5° |
| C30 | C29 | C28 | O3 | 170.2° | 68.6° |
| C29 | C30 | C31 | H32 | 109.9° | 107.4° |
| C29 | C30 | C31 | H33 | 109.9° | 107.5° |
| C30 | C31 | H32 | H33 | 143.8° | 145.7° |
| C25 | N3 | C28 | C29 | 177.8° | 180.0° |
| C25 | N3 | C28 | O3 | 2.2° | 0.0° |
| N3 | C25 | C24 | H23 | 88.1° | 173.8° |
| N3 | C25 | C24 | H22 | 153.0° | 66.2° |
| C25 | N3 | C26 | H26 | 91.9° | 170.9° |
| C25 | N3 | C26 | H27 | 148.3° | 68.7° |
| N3 | C25 | H25 | H24 | 116.4° | 120.4° |
| N3 | C28 | C29 | O3 | 175.6° | 180.0° |
| N3 | C28 | C29 | C31 | 58.8° | 180.0° |
| C28 | N3 | C26 | H26 | 90.4° | 8.9° |
| C28 | N3 | C26 | H27 | 29.5° | 111.5° |
| C28 | N3 | C25 | H25 | 43.4° | 111.5° |
| C28 | N3 | C25 | H24 | 74.3° | 9.1° |
| N3 | C28 | C29 | H30 | 154.4° | 34.3° |
| C28 | C29 | C31 | H30 | 146.6° | 145.0° |
| C28 | C29 | C30 | H31 | 12.7° | 0.0° |
| C28 | C29 | C31 | H32 | 0.2° | 145.0° |
| C28 | C29 | C31 | H33 | 139.9° | 0.0° |
| C31 | C29 | C28 | O3 | 116.9° | 0.0° |
| C29 | C31 | H32 | H33 | 143.8° | 145.7° |
| O3 | C28 | C29 | H30 | 29.9° | 145.7° |
| H6 | N1 | C9 | H8 | 62.2° | 120.3° |
| H6 | N1 | C9 | H7 | 177.0° | 119.7° |
| H11 | C13 | C12 | H10 | 0.4° | 0.3° |
| H11 | C13 | C14 | H12 | 0.4° | 0.3° |
| H13 | C15 | C14 | H12 | 0.0° | 0.3° |
| H14 | C17 | C18 | H15 | 0.3° | 0.1° |
| H16 | C20 | C21 | H17 | 0.2° | 0.5° |
| H18 | C22 | C23 | H21 | 130.4° | 55.0° |
| H18 | C22 | C23 | H20 | 109.7° | 65.0° |
| H19 | C22 | C23 | H21 | 109.6° | 65.0° |
| H19 | C22 | C23 | H20 | 10.3° | 175.1° |
| H23 | C24 | C25 | H25 | 33.1° | 54.1° |
| H23 | C24 | C25 | H24 | 150.8° | 66.5° |
| H22 | C24 | C25 | H25 | 85.9° | 174.1° |
| H22 | C24 | C25 | H24 | 31.8° | 53.5° |
| H26 | C26 | C27 | H29 | 65.3° | 53.6° |
| H26 | C26 | C27 | H28 | 174.5° | 66.5° |
| H27 | C26 | C27 | H29 | 54.5° | 174.1° |
| H27 | C26 | C27 | H28 | 65.7° | 54.0° |
| H1 | C1 | C2 | H2 | 0.7° | 0.0° |
| H9 | C11 | C12 | H10 | 0.0° | 0.3° |
| H30 | C29 | C30 | H31 | 152.8° | 145.0° |
| H30 | C29 | C31 | H32 | 146.8° | 0.0° |
| H30 | C29 | C31 | H33 | 6.7° | 145.0° |
| H31 | C30 | C31 | H32 | 7.9° | 145.0° |
| H31 | C30 | C31 | H33 | 148.0° | 0.0° |






