A1BV9
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C15 | C14 | doub | 1.38Å | 1.53Å | Aromatic |
| C15 | C16 | sing | 1.38Å | 1.33Å | Aromatic |
| C14 | C13 | sing | 1.38Å | 1.33Å | Aromatic |
| C16 | C11 | doub | 1.40Å | 1.54Å | Aromatic |
| C13 | C12 | doub | 1.38Å | 1.54Å | Aromatic |
| C11 | C12 | sing | 1.40Å | 1.33Å | Aromatic |
| C11 | C10 | sing | 1.48Å | 1.57Å | |
| O1 | C10 | doub | 1.22Å | 1.19Å | |
| C10 | N1 | sing | 1.35Å | 1.50Å | |
| N1 | C8 | sing | 1.47Å | 1.48Å | |
| N1 | C9 | sing | 1.47Å | 1.46Å | |
| C18 | C8 | sing | 1.52Å | 1.56Å | |
| C18 | C17 | sing | 1.53Å | 1.49Å | |
| C8 | C7 | sing | 1.53Å | 1.54Å | |
| C8 | C17 | sing | 1.53Å | 1.57Å | |
| C7 | C5 | sing | 1.51Å | 1.54Å | |
| C9 | C6 | sing | 1.51Å | 1.53Å | |
| C9 | C19 | sing | 1.51Å | 1.55Å | |
| C5 | C6 | doub | 1.38Å | 1.32Å | Aromatic |
| C5 | C4 | sing | 1.39Å | 1.54Å | Aromatic |
| C6 | C1 | sing | 1.39Å | 1.54Å | Aromatic |
| C4 | C3 | doub | 1.38Å | 1.33Å | Aromatic |
| C1 | C2 | doub | 1.38Å | 1.33Å | Aromatic |
| C3 | C2 | sing | 1.39Å | 1.54Å | Aromatic |
| C3 | O2 | sing | 1.36Å | 1.41Å | |
| C19 | C24 | doub | 1.38Å | 1.54Å | Aromatic |
| C19 | C20 | sing | 1.38Å | 1.33Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.33Å | Aromatic |
| C20 | C21 | doub | 1.38Å | 1.54Å | Aromatic |
| C23 | C22 | doub | 1.39Å | 1.54Å | Aromatic |
| C21 | C22 | sing | 1.39Å | 1.33Å | Aromatic |
| C22 | O3 | sing | 1.36Å | 1.42Å | |
| O3 | C25 | sing | 1.43Å | 1.42Å | |
| C25 | C26 | sing | 1.53Å | 1.61Å | |
| C26 | C27 | sing | 1.51Å | 1.40Å | |
| C26 | C29 | sing | 1.54Å | 1.52Å | |
| C27 | C28 | doub | 1.31Å | 1.51Å | |
| C29 | N2 | sing | 1.47Å | 1.41Å | |
| C28 | N2 | sing | 1.38Å | 1.43Å | |
| N2 | C30 | sing | 1.47Å | 1.22Å | |
| C30 | C31 | sing | 1.53Å | 1.56Å | |
| F1 | C32 | sing | 1.40Å | 1.37Å | |
| C32 | C31 | sing | 1.53Å | 1.55Å | |
| C4 | H1 | sing | 1.08Å | 1.08Å | |
| C7 | H2 | sing | 1.09Å | 1.10Å | |
| C7 | H3 | sing | 1.09Å | 1.10Å | |
| C13 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C17 | H6 | sing | 1.09Å | 1.10Å | |
| C17 | H7 | sing | 1.09Å | 1.10Å | |
| C20 | H8 | sing | 1.08Å | 1.08Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C24 | H10 | sing | 1.08Å | 1.08Å | |
| C26 | H11 | sing | 1.09Å | 1.10Å | |
| C28 | H12 | sing | 1.08Å | 1.08Å | |
| C1 | H13 | sing | 1.08Å | 1.08Å | |
| C12 | H14 | sing | 1.08Å | 1.08Å | |
| C14 | H15 | sing | 1.08Å | 1.08Å | |
| C16 | H16 | sing | 1.08Å | 1.08Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C2 | H19 | sing | 1.08Å | 1.08Å | |
| C23 | H20 | sing | 1.08Å | 1.08Å | |
| C25 | H21 | sing | 1.09Å | 1.10Å | |
| C25 | H22 | sing | 1.09Å | 1.10Å | |
| C27 | H23 | sing | 1.08Å | 1.08Å | |
| C29 | H24 | sing | 1.09Å | 1.10Å | |
| C29 | H25 | sing | 1.09Å | 1.10Å | |
| C30 | H26 | sing | 1.09Å | 1.10Å | |
| C30 | H27 | sing | 1.09Å | 1.10Å | |
| C31 | H28 | sing | 1.09Å | 1.10Å | |
| C31 | H29 | sing | 1.09Å | 1.10Å | |
| C32 | H30 | sing | 1.09Å | 1.10Å | |
| C32 | H31 | sing | 1.09Å | 1.10Å | |
| C9 | H32 | sing | 1.09Å | 1.10Å | |
| O2 | H33 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C14 | C15 | C16 | 119.7° | 120.1° |
| C15 | C14 | C13 | 120.3° | 120.3° |
| C14 | C15 | H5 | 120.1° | 119.9° |
| C15 | C14 | H15 | 119.9° | 119.9° |
| C15 | C16 | C11 | 120.0° | 119.9° |
| C16 | C15 | H5 | 120.1° | 119.9° |
| C15 | C16 | H16 | 120.0° | 120.1° |
| C14 | C13 | C12 | 120.1° | 120.2° |
| C14 | C13 | H4 | 119.9° | 119.9° |
| C13 | C14 | H15 | 119.8° | 119.8° |
| C16 | C11 | C12 | 120.2° | 119.7° |
| C16 | C11 | C10 | 119.0° | 120.2° |
| C11 | C16 | H16 | 120.0° | 120.0° |
| C13 | C12 | C11 | 119.6° | 119.8° |
| C12 | C13 | H4 | 119.9° | 119.9° |
| C13 | C12 | H14 | 120.2° | 120.1° |
| C12 | C11 | C10 | 120.8° | 120.1° |
| C11 | C12 | H14 | 120.2° | 120.1° |
| C11 | C10 | O1 | 118.9° | 120.0° |
| C11 | C10 | N1 | 122.4° | 120.0° |
| O1 | C10 | N1 | 118.7° | 120.0° |
| C10 | N1 | C8 | 121.4° | 121.6° |
| C10 | N1 | C9 | 117.2° | 121.7° |
| C8 | N1 | C9 | 121.4° | 116.7° |
| N1 | C8 | C18 | 132.5° | 118.0° |
| N1 | C8 | C7 | 111.3° | 113.6° |
| N1 | C8 | C17 | 128.6° | 118.0° |
| N1 | C9 | C6 | 110.7° | 110.4° |
| N1 | C9 | C19 | 113.7° | 109.3° |
| N1 | C9 | H32 | 108.5° | 109.3° |
| C8 | C18 | C17 | 61.8° | 59.9° |
| C18 | C8 | C7 | 114.9° | 118.6° |
| C18 | C8 | C17 | 56.6° | 60.2° |
| C8 | C18 | H17 | 119.7° | 117.6° |
| C8 | C18 | H18 | 119.7° | 117.5° |
| C18 | C17 | C8 | 61.5° | 59.8° |
| C18 | C17 | H6 | 119.8° | 117.5° |
| C18 | C17 | H7 | 119.8° | 117.6° |
| C17 | C18 | H17 | 119.7° | 117.5° |
| C17 | C18 | H18 | 119.7° | 117.5° |
| C7 | C8 | C17 | 95.8° | 118.5° |
| C8 | C7 | C5 | 114.0° | 110.2° |
| C8 | C7 | H2 | 108.3° | 109.4° |
| C8 | C7 | H3 | 108.3° | 109.3° |
| C8 | C17 | H6 | 119.7° | 117.5° |
| C8 | C17 | H7 | 119.7° | 117.5° |
| C7 | C5 | C6 | 124.8° | 123.2° |
| C7 | C5 | C4 | 113.5° | 117.1° |
| C5 | C7 | H2 | 108.3° | 109.3° |
| C5 | C7 | H3 | 108.3° | 109.3° |
| C6 | C9 | C19 | 108.9° | 109.3° |
| C9 | C6 | C5 | 121.9° | 123.4° |
| C9 | C6 | C1 | 119.0° | 116.9° |
| C6 | C9 | H32 | 107.5° | 109.3° |
| C9 | C19 | C24 | 119.9° | 120.0° |
| C9 | C19 | C20 | 120.1° | 119.9° |
| C19 | C9 | H32 | 107.4° | 109.2° |
| C6 | C5 | C4 | 121.7° | 119.7° |
| C5 | C6 | C1 | 119.1° | 119.6° |
| C5 | C4 | C3 | 118.9° | 120.7° |
| C5 | C4 | H1 | 120.6° | 119.7° |
| C6 | C1 | C2 | 119.7° | 120.8° |
| C6 | C1 | H13 | 120.1° | 119.6° |
| C4 | C3 | C2 | 119.9° | 119.5° |
| C4 | C3 | O2 | 120.2° | 120.3° |
| C3 | C4 | H1 | 120.6° | 119.7° |
| C1 | C2 | C3 | 120.7° | 119.6° |
| C2 | C1 | H13 | 120.2° | 119.6° |
| C1 | C2 | H19 | 119.6° | 120.2° |
| C2 | C3 | O2 | 119.9° | 120.2° |
| C3 | C2 | H19 | 119.7° | 120.2° |
| C3 | O2 | H33 | 109.5° | 114.0° |
| C24 | C19 | C20 | 120.0° | 120.1° |
| C19 | C24 | C23 | 119.9° | 120.1° |
| C19 | C24 | H10 | 120.0° | 120.0° |
| C19 | C20 | C21 | 120.1° | 120.1° |
| C19 | C20 | H8 | 119.9° | 120.0° |
| C24 | C23 | C22 | 119.9° | 119.9° |
| C23 | C24 | H10 | 120.0° | 120.0° |
| C24 | C23 | H20 | 120.1° | 120.0° |
| C20 | C21 | C22 | 119.8° | 119.9° |
| C21 | C20 | H8 | 120.0° | 119.9° |
| C20 | C21 | H9 | 120.1° | 120.1° |
| C23 | C22 | C21 | 120.2° | 119.9° |
| C23 | C22 | O3 | 120.3° | 120.0° |
| C22 | C23 | H20 | 120.0° | 120.0° |
| C21 | C22 | O3 | 119.5° | 120.1° |
| C22 | C21 | H9 | 120.1° | 120.0° |
| C22 | O3 | C25 | 114.6° | 117.1° |
| O3 | C25 | C26 | 108.4° | 109.5° |
| O3 | C25 | H21 | 109.7° | 109.5° |
| O3 | C25 | H22 | 109.7° | 109.4° |
| C25 | C26 | C27 | 109.6° | 110.5° |
| C25 | C26 | C29 | 109.3° | 110.5° |
| C25 | C26 | H11 | 108.2° | 110.6° |
| C26 | C25 | H21 | 109.8° | 109.5° |
| C26 | C25 | H22 | 109.8° | 109.5° |
| C27 | C26 | C29 | 109.3° | 103.9° |
| C26 | C27 | C28 | 105.9° | 109.1° |
| C27 | C26 | H11 | 111.1° | 110.6° |
| C26 | C27 | H23 | 127.0° | 125.5° |
| C26 | C29 | N2 | 105.6° | 103.9° |
| C29 | C26 | H11 | 109.3° | 110.5° |
| C26 | C29 | H24 | 110.4° | 110.5° |
| C26 | C29 | H25 | 110.4° | 110.5° |
| C27 | C28 | N2 | 107.3° | 113.9° |
| C27 | C28 | H12 | 126.3° | 123.1° |
| C28 | C27 | H23 | 127.0° | 125.4° |
| C29 | N2 | C28 | 110.6° | 109.3° |
| C29 | N2 | C30 | 110.5° | 125.4° |
| N2 | C29 | H24 | 110.4° | 110.6° |
| N2 | C29 | H25 | 110.4° | 110.5° |
| C28 | N2 | C30 | 112.1° | 125.3° |
| N2 | C28 | H12 | 126.4° | 123.1° |
| N2 | C30 | C31 | 111.2° | 109.4° |
| N2 | C30 | H26 | 109.0° | 109.5° |
| N2 | C30 | H27 | 109.1° | 109.5° |
| C30 | C31 | C32 | 111.4° | 109.4° |
| C31 | C30 | H26 | 109.0° | 109.5° |
| C31 | C30 | H27 | 109.0° | 109.4° |
| C30 | C31 | H28 | 109.0° | 109.4° |
| C30 | C31 | H29 | 109.0° | 109.5° |
| F1 | C32 | C31 | 110.2° | 109.4° |
| F1 | C32 | H30 | 109.3° | 109.5° |
| F1 | C32 | H31 | 109.3° | 109.5° |
| C32 | C31 | H28 | 109.0° | 109.4° |
| C32 | C31 | H29 | 109.0° | 109.5° |
| C31 | C32 | H30 | 109.3° | 109.4° |
| C31 | C32 | H31 | 109.3° | 109.5° |
| H2 | C7 | H3 | 109.5° | 109.3° |
| H6 | C17 | H7 | 109.5° | 115.5° |
| H17 | C18 | H18 | 109.5° | 115.5° |
| H21 | C25 | H22 | 109.5° | 109.5° |
| H24 | C29 | H25 | 109.5° | 110.6° |
| H26 | C30 | H27 | 109.5° | 109.5° |
| H28 | C31 | H29 | 109.5° | 109.5° |
| H30 | C32 | H31 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C14 | C15 | C16 | H5 | 180.0° | 179.9° |
| C15 | C14 | C13 | H15 | 180.0° | 179.9° |
| C14 | C15 | C16 | C11 | 0.3° | 0.3° |
| C15 | C14 | C13 | C12 | 0.1° | 0.0° |
| C15 | C14 | C13 | H4 | 179.9° | 179.8° |
| C14 | C15 | C16 | H16 | 179.8° | 180.0° |
| C16 | C15 | C14 | C13 | 0.2° | 0.0° |
| C15 | C16 | C11 | H16 | 180.0° | 179.8° |
| C15 | C16 | C11 | C12 | 0.3° | 0.5° |
| C15 | C16 | C11 | C10 | 179.9° | 180.0° |
| C16 | C15 | C14 | H15 | 179.8° | 180.0° |
| C14 | C13 | C12 | H4 | 180.0° | 179.7° |
| C14 | C13 | C12 | C11 | 0.2° | 0.3° |
| C13 | C14 | C15 | H5 | 179.8° | 180.0° |
| C14 | C13 | C12 | H14 | 179.8° | 179.8° |
| C16 | C11 | C12 | C13 | 0.3° | 0.5° |
| C16 | C11 | C12 | C10 | 179.6° | 179.5° |
| C16 | C11 | C10 | O1 | 109.8° | 56.2° |
| C16 | C11 | C10 | N1 | 69.9° | 123.9° |
| C11 | C16 | C15 | H5 | 179.7° | 179.8° |
| C16 | C11 | C12 | H14 | 179.7° | 179.5° |
| C13 | C12 | C11 | H14 | 180.0° | 180.0° |
| C13 | C12 | C11 | C10 | 179.8° | 180.0° |
| C12 | C13 | C14 | H15 | 179.9° | 180.0° |
| C12 | C11 | C10 | O1 | 69.8° | 124.3° |
| C12 | C11 | C10 | N1 | 110.6° | 55.6° |
| C11 | C12 | C13 | H4 | 179.8° | 180.0° |
| C12 | C11 | C16 | H16 | 179.7° | 179.7° |
| C11 | C10 | O1 | N1 | 179.7° | 180.0° |
| C11 | C10 | N1 | C8 | 0.1° | 174.9° |
| C11 | C10 | N1 | C9 | 178.8° | 4.8° |
| C10 | C11 | C12 | H14 | 0.1° | 0.0° |
| C10 | C11 | C16 | H16 | 0.1° | 0.2° |
| O1 | C10 | N1 | C8 | 179.6° | 5.1° |
| O1 | C10 | N1 | C9 | 0.9° | 175.2° |
| C10 | N1 | C8 | C9 | 178.7° | 179.7° |
| C10 | N1 | C8 | C18 | 35.6° | 23.1° |
| C10 | N1 | C8 | C7 | 130.5° | 122.3° |
| C10 | N1 | C8 | C17 | 112.7° | 92.4° |
| C10 | N1 | C9 | C6 | 136.5° | 138.2° |
| C10 | N1 | C9 | C19 | 100.6° | 101.6° |
| C10 | N1 | C9 | H32 | 18.7° | 17.9° |
| N1 | C8 | C18 | C7 | 165.6° | 143.7° |
| N1 | C8 | C18 | C17 | 114.2° | 107.9° |
| N1 | C8 | C7 | C17 | 135.5° | 145.1° |
| N1 | C8 | C7 | C5 | 26.6° | 40.8° |
| C8 | N1 | C9 | C6 | 42.3° | 41.6° |
| C8 | N1 | C9 | C19 | 80.6° | 78.7° |
| N1 | C8 | C7 | H2 | 94.1° | 161.0° |
| N1 | C8 | C7 | H3 | 147.2° | 79.4° |
| N1 | C8 | C17 | H6 | 129.5° | 0.6° |
| N1 | C8 | C17 | H7 | 10.7° | 144.5° |
| N1 | C8 | C18 | H17 | 135.8° | 144.6° |
| N1 | C8 | C18 | H18 | 4.3° | 0.5° |
| C8 | N1 | C9 | H32 | 160.0° | 161.8° |
| C9 | N1 | C8 | C18 | 145.8° | 157.1° |
| C9 | N1 | C8 | C7 | 48.2° | 57.4° |
| C9 | N1 | C8 | C17 | 68.6° | 87.8° |
| N1 | C9 | C6 | C19 | 125.7° | 120.3° |
| N1 | C9 | C6 | H32 | 118.3° | 120.3° |
| N1 | C9 | C19 | H32 | 120.0° | 119.5° |
| N1 | C9 | C6 | C5 | 16.4° | 14.9° |
| N1 | C9 | C6 | C1 | 163.6° | 166.1° |
| N1 | C9 | C19 | C24 | 93.8° | 60.3° |
| N1 | C9 | C19 | C20 | 87.6° | 120.3° |
| C8 | C18 | C17 | H17 | 110.0° | 107.5° |
| C8 | C18 | C17 | H18 | 110.0° | 107.5° |
| C18 | C8 | C7 | C17 | 55.8° | 69.7° |
| C18 | C8 | C7 | C5 | 164.8° | 174.0° |
| C18 | C8 | C7 | H2 | 74.6° | 53.8° |
| C18 | C8 | C7 | H3 | 44.1° | 65.9° |
| C8 | C18 | C17 | H6 | 109.9° | 107.4° |
| C8 | C18 | C17 | H7 | 109.9° | 107.4° |
| C8 | C18 | H17 | H18 | 143.8° | 145.8° |
| C18 | C17 | H6 | H7 | 143.9° | 145.8° |
| C17 | C18 | H17 | H18 | 143.7° | 145.6° |
| C8 | C7 | C5 | H2 | 120.6° | 120.3° |
| C8 | C7 | C5 | H3 | 120.7° | 120.1° |
| C8 | C7 | C5 | C6 | 5.5° | 16.0° |
| C8 | C7 | C5 | C4 | 174.5° | 165.1° |
| C8 | C7 | H2 | H3 | 117.9° | 119.6° |
| C7 | C8 | C17 | H6 | 6.1° | 144.1° |
| C7 | C8 | C17 | H7 | 134.1° | 0.9° |
| C7 | C8 | C18 | H17 | 29.8° | 0.9° |
| C7 | C8 | C18 | H18 | 169.9° | 144.2° |
| C17 | C8 | C7 | C5 | 109.0° | 104.3° |
| C17 | C8 | C7 | H2 | 130.4° | 15.9° |
| C17 | C8 | C7 | H3 | 11.7° | 135.6° |
| C8 | C17 | H6 | H7 | 143.9° | 145.7° |
| C7 | C5 | C6 | C9 | 0.0° | 3.5° |
| C7 | C5 | C6 | C4 | 179.9° | 178.9° |
| C7 | C5 | C6 | C1 | 180.0° | 177.5° |
| C7 | C5 | C4 | C3 | 179.9° | 178.1° |
| C7 | C5 | C4 | H1 | 0.1° | 2.0° |
| C5 | C7 | H2 | H3 | 117.9° | 119.6° |
| C6 | C9 | C19 | H32 | 116.1° | 119.5° |
| C9 | C6 | C5 | C1 | 180.0° | 179.0° |
| C9 | C6 | C5 | C4 | 180.0° | 177.6° |
| C9 | C6 | C1 | C2 | 180.0° | 178.1° |
| C6 | C9 | C19 | C24 | 142.3° | 60.7° |
| C6 | C9 | C19 | C20 | 36.3° | 118.7° |
| C9 | C6 | C1 | H13 | 0.0° | 1.8° |
| C19 | C9 | C6 | C5 | 109.3° | 105.4° |
| C19 | C9 | C6 | C1 | 70.7° | 73.6° |
| C9 | C19 | C24 | C20 | 178.6° | 179.4° |
| C9 | C19 | C24 | C23 | 179.6° | 180.0° |
| C9 | C19 | C20 | C21 | 179.7° | 179.5° |
| C9 | C19 | C20 | H8 | 0.3° | 0.2° |
| C9 | C19 | C24 | H10 | 0.4° | 0.9° |
| C6 | C5 | C4 | C3 | 0.1° | 0.9° |
| C5 | C6 | C1 | C2 | 0.0° | 0.9° |
| C6 | C5 | C4 | H1 | 179.9° | 179.1° |
| C6 | C5 | C7 | H2 | 115.2° | 136.2° |
| C6 | C5 | C7 | H3 | 126.1° | 104.1° |
| C5 | C6 | C1 | H13 | 180.0° | 179.1° |
| C5 | C6 | C9 | H32 | 134.7° | 135.1° |
| C4 | C5 | C6 | C1 | 0.0° | 1.4° |
| C5 | C4 | C3 | H1 | 180.0° | 180.0° |
| C5 | C4 | C3 | C2 | 0.1° | 0.1° |
| C5 | C4 | C3 | O2 | 180.0° | 180.0° |
| C4 | C5 | C7 | H2 | 64.9° | 44.8° |
| C4 | C5 | C7 | H3 | 53.8° | 74.8° |
| C6 | C1 | C2 | H13 | 180.0° | 180.0° |
| C6 | C1 | C2 | C3 | 0.1° | 0.1° |
| C6 | C1 | C2 | H19 | 179.9° | 180.0° |
| C1 | C6 | C9 | H32 | 45.3° | 45.9° |
| C4 | C3 | C2 | C1 | 0.1° | 0.6° |
| C4 | C3 | C2 | O2 | 179.9° | 179.9° |
| C4 | C3 | C2 | H19 | 179.8° | 179.6° |
| C4 | C3 | O2 | H33 | 180.0° | 90.0° |
| C1 | C2 | C3 | H19 | 180.0° | 179.9° |
| C1 | C2 | C3 | O2 | 180.0° | 179.6° |
| C2 | C3 | C4 | H1 | 179.9° | 180.0° |
| C3 | C2 | C1 | H13 | 180.0° | 179.9° |
| C2 | C3 | O2 | H33 | 0.1° | 90.2° |
| O2 | C3 | C4 | H1 | 0.0° | 0.1° |
| O2 | C3 | C2 | H19 | 0.1° | 0.3° |
| C19 | C24 | C23 | H10 | 180.0° | 179.1° |
| C24 | C19 | C20 | C21 | 1.1° | 0.1° |
| C19 | C24 | C23 | C22 | 0.6° | 0.9° |
| C24 | C19 | C20 | H8 | 178.9° | 179.6° |
| C19 | C24 | C23 | H20 | 179.4° | 180.0° |
| C24 | C19 | C9 | H32 | 26.2° | 179.8° |
| C20 | C19 | C24 | C23 | 0.9° | 0.6° |
| C19 | C20 | C21 | H8 | 180.0° | 179.7° |
| C19 | C20 | C21 | C22 | 0.9° | 0.2° |
| C19 | C20 | C21 | H9 | 179.1° | 179.8° |
| C20 | C19 | C24 | H10 | 179.1° | 179.7° |
| C20 | C19 | C9 | H32 | 152.4° | 0.8° |
| C24 | C23 | C22 | H20 | 180.0° | 179.2° |
| C24 | C23 | C22 | C21 | 0.5° | 0.6° |
| C24 | C23 | C22 | O3 | 179.8° | 179.5° |
| C20 | C21 | C22 | C23 | 0.6° | 0.0° |
| C20 | C21 | C22 | H9 | 180.0° | 180.0° |
| C20 | C21 | C22 | O3 | 179.9° | 180.0° |
| C23 | C22 | C21 | O3 | 179.4° | 179.9° |
| C23 | C22 | O3 | C25 | 48.8° | 0.1° |
| C23 | C22 | C21 | H9 | 179.4° | 179.9° |
| C22 | C23 | C24 | H10 | 179.4° | 180.0° |
| C21 | C22 | O3 | C25 | 131.8° | 180.0° |
| C22 | C21 | C20 | H8 | 179.1° | 179.9° |
| C21 | C22 | C23 | H20 | 179.5° | 179.8° |
| C22 | O3 | C25 | C26 | 172.7° | 180.0° |
| O3 | C22 | C21 | H9 | 0.0° | 0.0° |
| O3 | C22 | C23 | H20 | 0.2° | 0.3° |
| C22 | O3 | C25 | H21 | 67.4° | 60.0° |
| C22 | O3 | C25 | H22 | 52.9° | 60.0° |
| O3 | C25 | C26 | H21 | 119.8° | 120.0° |
| O3 | C25 | C26 | H22 | 119.8° | 120.0° |
| O3 | C25 | C26 | C27 | 146.0° | 66.5° |
| O3 | C25 | C26 | C29 | 94.2° | 179.1° |
| O3 | C25 | C26 | H11 | 24.8° | 56.3° |
| O3 | C25 | H21 | H22 | 120.5° | 120.0° |
| C25 | C26 | C27 | C29 | 119.8° | 118.6° |
| C25 | C26 | C27 | H11 | 119.5° | 122.8° |
| C25 | C26 | C29 | H11 | 118.3° | 122.8° |
| C25 | C26 | C27 | C28 | 130.4° | 118.6° |
| C25 | C26 | C29 | N2 | 126.2° | 118.6° |
| C26 | C25 | H21 | H22 | 120.5° | 120.0° |
| C25 | C26 | C27 | H23 | 49.6° | 61.5° |
| C25 | C26 | C29 | H24 | 6.8° | 0.0° |
| C25 | C26 | C29 | H25 | 114.4° | 122.8° |
| C27 | C26 | C29 | H11 | 121.8° | 118.6° |
| C26 | C27 | C28 | H23 | 180.0° | 179.9° |
| C27 | C26 | C29 | N2 | 6.3° | 0.1° |
| C26 | C27 | C28 | N2 | 11.2° | 0.0° |
| C26 | C27 | C28 | H12 | 168.9° | 179.9° |
| C27 | C26 | C25 | H21 | 26.2° | 173.5° |
| C27 | C26 | C25 | H22 | 94.1° | 53.5° |
| C27 | C26 | C29 | H24 | 113.1° | 118.6° |
| C27 | C26 | C29 | H25 | 125.7° | 118.6° |
| C29 | C26 | C27 | C28 | 10.6° | 0.0° |
| C26 | C29 | N2 | H24 | 119.4° | 118.6° |
| C26 | C29 | N2 | H25 | 119.4° | 118.6° |
| C26 | C29 | N2 | C28 | 1.1° | 0.0° |
| C26 | C29 | N2 | C30 | 125.8° | 180.0° |
| C29 | C26 | C25 | H21 | 146.0° | 59.1° |
| C29 | C26 | C25 | H22 | 25.6° | 60.9° |
| C29 | C26 | C27 | H23 | 169.4° | 179.9° |
| C26 | C29 | H24 | H25 | 121.8° | 122.8° |
| C27 | C28 | N2 | C29 | 7.5° | 0.0° |
| C27 | C28 | N2 | H12 | 180.0° | 180.0° |
| C27 | C28 | N2 | C30 | 131.3° | 180.0° |
| C28 | C27 | C26 | H11 | 110.2° | 118.6° |
| C29 | N2 | C28 | C30 | 123.8° | 180.0° |
| C29 | N2 | C30 | C31 | 168.0° | 89.9° |
| N2 | C29 | C26 | H11 | 115.5° | 118.6° |
| C29 | N2 | C28 | H12 | 172.5° | 180.0° |
| N2 | C29 | H24 | H25 | 121.8° | 122.8° |
| C29 | N2 | C30 | H26 | 47.8° | 150.0° |
| C29 | N2 | C30 | H27 | 71.7° | 30.0° |
| C28 | N2 | C30 | C31 | 68.1° | 90.0° |
| N2 | C28 | C27 | H23 | 168.8° | 179.9° |
| C28 | N2 | C29 | H24 | 120.5° | 118.6° |
| C28 | N2 | C29 | H25 | 118.3° | 118.6° |
| C28 | N2 | C30 | H26 | 171.6° | 30.0° |
| C28 | N2 | C30 | H27 | 52.2° | 150.0° |
| N2 | C30 | C31 | H26 | 120.3° | 120.1° |
| N2 | C30 | C31 | H27 | 120.3° | 120.0° |
| N2 | C30 | C31 | C32 | 54.6° | 180.0° |
| C30 | N2 | C28 | H12 | 48.7° | 0.0° |
| C30 | N2 | C29 | H24 | 114.8° | 61.4° |
| C30 | N2 | C29 | H25 | 6.4° | 61.4° |
| N2 | C30 | H26 | H27 | 119.2° | 120.0° |
| N2 | C30 | C31 | H28 | 174.9° | 60.1° |
| N2 | C30 | C31 | H29 | 65.7° | 60.0° |
| C30 | C31 | C32 | F1 | 48.0° | 180.0° |
| C30 | C31 | C32 | H28 | 120.3° | 119.9° |
| C30 | C31 | C32 | H29 | 120.3° | 120.0° |
| C31 | C30 | H26 | H27 | 119.2° | 120.0° |
| C30 | C31 | H28 | H29 | 119.1° | 120.0° |
| C30 | C31 | C32 | H30 | 72.1° | 60.0° |
| C30 | C31 | C32 | H31 | 168.2° | 60.0° |
| F1 | C32 | C31 | H30 | 120.1° | 120.0° |
| F1 | C32 | C31 | H31 | 120.1° | 120.0° |
| F1 | C32 | C31 | H28 | 72.3° | 60.1° |
| F1 | C32 | C31 | H29 | 168.3° | 60.0° |
| F1 | C32 | H30 | H31 | 119.6° | 120.1° |
| C32 | C31 | C30 | H26 | 65.7° | 60.0° |
| C32 | C31 | C30 | H27 | 174.9° | 60.0° |
| C32 | C31 | H28 | H29 | 119.1° | 120.0° |
| C31 | C32 | H30 | H31 | 119.7° | 120.0° |
| H4 | C13 | C12 | H14 | 0.2° | 0.0° |
| H4 | C13 | C14 | H15 | 0.1° | 0.3° |
| H5 | C15 | C14 | H15 | 0.2° | 0.1° |
| H5 | C15 | C16 | H16 | 0.2° | 0.0° |
| H6 | C17 | C18 | H17 | 0.1° | 145.0° |
| H6 | C17 | C18 | H18 | 140.1° | 0.1° |
| H7 | C17 | C18 | H17 | 140.2° | 0.1° |
| H7 | C17 | C18 | H18 | 0.1° | 145.1° |
| H8 | C20 | C21 | H9 | 1.0° | 0.1° |
| H10 | C24 | C23 | H20 | 0.6° | 0.9° |
| H11 | C26 | C25 | H21 | 95.0° | 63.7° |
| H11 | C26 | C25 | H22 | 144.6° | 176.3° |
| H11 | C26 | C27 | H23 | 69.9° | 61.3° |
| H11 | C26 | C29 | H24 | 125.1° | 122.8° |
| H11 | C26 | C29 | H25 | 3.9° | 0.0° |
| H12 | C28 | C27 | H23 | 11.2° | 0.1° |
| H13 | C1 | C2 | H19 | 0.1° | 0.0° |
| H26 | C30 | C31 | H28 | 54.6° | 60.0° |
| H26 | C30 | C31 | H29 | 174.0° | 180.0° |
| H27 | C30 | C31 | H28 | 64.8° | 180.0° |
| H27 | C30 | C31 | H29 | 54.6° | 60.0° |
| H28 | C31 | C32 | H30 | 167.6° | 180.0° |
| H28 | C31 | C32 | H31 | 47.8° | 59.9° |
| H29 | C31 | C32 | H30 | 48.2° | 60.0° |
| H29 | C31 | C32 | H31 | 71.5° | 180.0° |
