A1E5L
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C3 | N2 | sing | 1.47Å | 1.48Å | |
| C1 | N2 | sing | 1.47Å | 1.41Å | |
| N2 | C4 | sing | 1.47Å | 1.61Å | |
| C24 | C25 | doub | 1.38Å | 1.39Å | Aromatic |
| C24 | C23 | sing | 1.38Å | 1.38Å | Aromatic |
| C25 | C26 | sing | 1.38Å | 1.37Å | Aromatic |
| C4 | C23 | sing | 1.51Å | 1.55Å | |
| C4 | C9 | sing | 1.53Å | 1.53Å | |
| C4 | C5 | sing | 1.53Å | 1.47Å | |
| C23 | C28 | doub | 1.38Å | 1.38Å | Aromatic |
| C26 | C27 | doub | 1.38Å | 1.34Å | Aromatic |
| C9 | C8 | sing | 1.53Å | 1.53Å | |
| C28 | C27 | sing | 1.38Å | 1.38Å | Aromatic |
| C5 | C6 | sing | 1.53Å | 1.46Å | |
| C6 | C7 | sing | 1.53Å | 1.47Å | |
| C18 | C16 | doub | 1.39Å | 1.41Å | Aromatic |
| C18 | C19 | sing | 1.38Å | 1.36Å | Aromatic |
| N17 | C16 | sing | 1.37Å | 1.36Å | Aromatic |
| N17 | C10 | sing | 1.37Å | 1.36Å | Aromatic |
| C8 | C7 | sing | 1.53Å | 1.50Å | |
| C16 | C15 | sing | 1.42Å | 1.42Å | Aromatic |
| C7 | C10 | sing | 1.51Å | 1.49Å | |
| C7 | O14 | sing | 1.43Å | 1.34Å | |
| C19 | C20 | doub | 1.39Å | 1.40Å | Aromatic |
| C10 | C11 | doub | 1.35Å | 1.41Å | Aromatic |
| O14 | C13 | sing | 1.43Å | 1.41Å | |
| C15 | C11 | sing | 1.45Å | 1.46Å | Aromatic |
| C15 | C21 | doub | 1.40Å | 1.40Å | Aromatic |
| C20 | C21 | sing | 1.38Å | 1.37Å | Aromatic |
| C20 | F22 | sing | 1.35Å | 1.38Å | |
| C11 | C12 | sing | 1.51Å | 1.47Å | |
| C13 | C12 | sing | 1.54Å | 1.53Å | |
| C5 | H1 | sing | 1.09Å | 1.10Å | |
| C5 | H2 | sing | 1.09Å | 1.10Å | |
| C6 | H3 | sing | 1.09Å | 1.10Å | |
| C6 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C13 | H8 | sing | 1.09Å | 1.10Å | |
| C21 | H9 | sing | 1.08Å | 1.08Å | |
| C24 | H10 | sing | 1.08Å | 1.08Å | |
| C26 | H11 | sing | 1.08Å | 1.08Å | |
| C28 | H12 | sing | 1.08Å | 1.08Å | |
| C1 | H13 | sing | 1.09Å | 1.10Å | |
| C1 | H14 | sing | 1.09Å | 1.10Å | |
| C1 | H15 | sing | 1.09Å | 1.10Å | |
| C12 | H16 | sing | 1.09Å | 1.10Å | |
| C12 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.08Å | 1.08Å | |
| C19 | H19 | sing | 1.08Å | 1.08Å | |
| C25 | H20 | sing | 1.08Å | 1.08Å | |
| C27 | H21 | sing | 1.08Å | 1.08Å | |
| C3 | H22 | sing | 1.09Å | 1.10Å | |
| C3 | H23 | sing | 1.09Å | 1.10Å | |
| C3 | H24 | sing | 1.09Å | 1.10Å | |
| C9 | H25 | sing | 1.09Å | 1.10Å | |
| C9 | H26 | sing | 1.09Å | 1.10Å | |
| N17 | H27 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C3 | N2 | C1 | 105.0° | 110.9° |
| C3 | N2 | C4 | 121.6° | 111.0° |
| N2 | C3 | H22 | 109.5° | 109.5° |
| N2 | C3 | H23 | 109.5° | 109.4° |
| N2 | C3 | H24 | 109.5° | 109.5° |
| C1 | N2 | C4 | 114.4° | 111.0° |
| N2 | C1 | H13 | 109.5° | 109.5° |
| N2 | C1 | H14 | 109.5° | 109.5° |
| N2 | C1 | H15 | 109.5° | 109.5° |
| N2 | C4 | C23 | 119.4° | 109.5° |
| N2 | C4 | C9 | 102.4° | 109.4° |
| N2 | C4 | C5 | 110.2° | 109.4° |
| C25 | C24 | C23 | 119.8° | 120.0° |
| C24 | C25 | C26 | 122.2° | 120.0° |
| C25 | C24 | H10 | 120.1° | 120.0° |
| C24 | C25 | H20 | 118.9° | 120.0° |
| C24 | C23 | C4 | 121.8° | 120.0° |
| C24 | C23 | C28 | 116.8° | 120.1° |
| C23 | C24 | H10 | 120.1° | 120.0° |
| C25 | C26 | C27 | 118.0° | 120.0° |
| C25 | C26 | H11 | 121.0° | 120.0° |
| C26 | C25 | H20 | 118.9° | 120.0° |
| C23 | C4 | C9 | 112.1° | 109.5° |
| C23 | C4 | C5 | 107.5° | 109.5° |
| C4 | C23 | C28 | 121.3° | 120.0° |
| C9 | C4 | C5 | 104.2° | 109.6° |
| C4 | C9 | C8 | 118.5° | 109.4° |
| C4 | C9 | H25 | 107.1° | 109.5° |
| C4 | C9 | H26 | 107.2° | 109.5° |
| C4 | C5 | C6 | 107.2° | 109.5° |
| C4 | C5 | H1 | 110.0° | 109.4° |
| C4 | C5 | H2 | 110.0° | 109.5° |
| C23 | C28 | C27 | 122.3° | 119.9° |
| C23 | C28 | H12 | 118.9° | 120.1° |
| C26 | C27 | C28 | 120.8° | 120.1° |
| C27 | C26 | H11 | 121.0° | 120.1° |
| C26 | C27 | H21 | 119.6° | 119.9° |
| C9 | C8 | C7 | 115.4° | 109.4° |
| C9 | C8 | H5 | 107.9° | 109.4° |
| C9 | C8 | H6 | 108.0° | 109.5° |
| C8 | C9 | H25 | 107.2° | 109.5° |
| C8 | C9 | H26 | 107.2° | 109.5° |
| C27 | C28 | H12 | 118.9° | 120.0° |
| C28 | C27 | H21 | 119.6° | 120.0° |
| C5 | C6 | C7 | 108.9° | 109.4° |
| C6 | C5 | H1 | 110.0° | 109.5° |
| C6 | C5 | H2 | 110.1° | 109.4° |
| C5 | C6 | H3 | 109.6° | 109.5° |
| C5 | C6 | H4 | 109.6° | 109.5° |
| C6 | C7 | C8 | 106.9° | 109.7° |
| C6 | C7 | C10 | 116.0° | 109.7° |
| C6 | C7 | O14 | 109.5° | 109.6° |
| C7 | C6 | H3 | 109.6° | 109.5° |
| C7 | C6 | H4 | 109.6° | 109.5° |
| C16 | C18 | C19 | 119.6° | 117.2° |
| C18 | C16 | N17 | 129.9° | 132.0° |
| C18 | C16 | C15 | 125.1° | 120.7° |
| C16 | C18 | H18 | 120.2° | 121.4° |
| C18 | C19 | C20 | 115.2° | 122.2° |
| C19 | C18 | H18 | 120.2° | 121.4° |
| C18 | C19 | H19 | 122.4° | 118.9° |
| C16 | N17 | C10 | 115.5° | 109.8° |
| N17 | C16 | C15 | 105.0° | 107.3° |
| C16 | N17 | H27 | 122.3° | 125.1° |
| N17 | C10 | C7 | 127.2° | 127.8° |
| N17 | C10 | C11 | 104.9° | 109.8° |
| C10 | N17 | H27 | 122.3° | 125.1° |
| C8 | C7 | C10 | 120.8° | 109.7° |
| C8 | C7 | O14 | 91.3° | 109.6° |
| C7 | C8 | H5 | 108.0° | 109.5° |
| C7 | C8 | H6 | 108.0° | 109.5° |
| C16 | C15 | C11 | 106.8° | 105.9° |
| C16 | C15 | C21 | 114.1° | 121.2° |
| C10 | C7 | O14 | 109.4° | 108.4° |
| C7 | C10 | C11 | 127.9° | 122.5° |
| C7 | O14 | C13 | 116.0° | 114.3° |
| C19 | C20 | C21 | 126.5° | 121.9° |
| C19 | C20 | F22 | 116.7° | 119.1° |
| C20 | C19 | H19 | 122.4° | 118.9° |
| C10 | C11 | C15 | 107.8° | 107.2° |
| C10 | C11 | C12 | 114.6° | 123.2° |
| O14 | C13 | C12 | 111.2° | 109.4° |
| O14 | C13 | H7 | 109.1° | 109.5° |
| O14 | C13 | H8 | 109.1° | 109.5° |
| C11 | C15 | C21 | 139.1° | 132.8° |
| C15 | C11 | C12 | 137.6° | 129.6° |
| C15 | C21 | C20 | 119.7° | 116.8° |
| C15 | C21 | H9 | 120.1° | 121.6° |
| C21 | C20 | F22 | 116.8° | 119.0° |
| C20 | C21 | H9 | 120.2° | 121.6° |
| C11 | C12 | C13 | 109.8° | 108.0° |
| C11 | C12 | H16 | 109.4° | 109.8° |
| C11 | C12 | H17 | 109.3° | 109.8° |
| C12 | C13 | H7 | 109.0° | 109.5° |
| C12 | C13 | H8 | 109.1° | 109.5° |
| C13 | C12 | H16 | 109.4° | 109.8° |
| C13 | C12 | H17 | 109.4° | 109.8° |
| H1 | C5 | H2 | 109.5° | 109.4° |
| H3 | C6 | H4 | 109.5° | 109.5° |
| H5 | C8 | H6 | 109.5° | 109.4° |
| H7 | C13 | H8 | 109.4° | 109.5° |
| H13 | C1 | H14 | 109.4° | 109.4° |
| H13 | C1 | H15 | 109.5° | 109.5° |
| H14 | C1 | H15 | 109.5° | 109.4° |
| H16 | C12 | H17 | 109.5° | 109.8° |
| H22 | C3 | H23 | 109.5° | 109.5° |
| H22 | C3 | H24 | 109.5° | 109.5° |
| H23 | C3 | H24 | 109.4° | 109.5° |
| H25 | C9 | H26 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C3 | N2 | C1 | C4 | 135.7° | 123.9° |
| C3 | N2 | C4 | C23 | 38.8° | 64.3° |
| C3 | N2 | C4 | C9 | 163.3° | 55.7° |
| C3 | N2 | C4 | C5 | 86.4° | 175.8° |
| C3 | N2 | C1 | H13 | 180.0° | 57.8° |
| C3 | N2 | C1 | H14 | 60.0° | 177.7° |
| C3 | N2 | C1 | H15 | 60.0° | 62.3° |
| N2 | C3 | H22 | H23 | 120.0° | 119.9° |
| N2 | C3 | H22 | H24 | 120.0° | 120.0° |
| N2 | C3 | H23 | H24 | 120.0° | 120.0° |
| C1 | N2 | C4 | C23 | 88.9° | 59.6° |
| C1 | N2 | C4 | C9 | 35.6° | 179.6° |
| C1 | N2 | C4 | C5 | 145.9° | 60.4° |
| N2 | C1 | H13 | H14 | 120.0° | 120.0° |
| N2 | C1 | H13 | H15 | 120.0° | 120.1° |
| N2 | C1 | H14 | H15 | 120.0° | 120.0° |
| C1 | N2 | C3 | H22 | 180.0° | 64.0° |
| C1 | N2 | C3 | H23 | 60.0° | 176.1° |
| C1 | N2 | C3 | H24 | 60.0° | 56.1° |
| N2 | C4 | C23 | C24 | 55.9° | 91.9° |
| N2 | C4 | C23 | C9 | 119.7° | 120.0° |
| N2 | C4 | C23 | C5 | 126.4° | 119.9° |
| N2 | C4 | C9 | C5 | 114.8° | 119.9° |
| N2 | C4 | C23 | C28 | 126.7° | 88.0° |
| N2 | C4 | C9 | C8 | 122.2° | 60.0° |
| N2 | C4 | C5 | C6 | 57.5° | 60.0° |
| N2 | C4 | C5 | H1 | 177.1° | 180.0° |
| N2 | C4 | C5 | H2 | 62.2° | 60.0° |
| C4 | N2 | C1 | H13 | 44.2° | 178.3° |
| C4 | N2 | C1 | H14 | 164.2° | 58.4° |
| C4 | N2 | C1 | H15 | 75.8° | 61.6° |
| C4 | N2 | C3 | H22 | 48.2° | 59.9° |
| C4 | N2 | C3 | H23 | 71.8° | 60.0° |
| C4 | N2 | C3 | H24 | 168.3° | 180.0° |
| N2 | C4 | C9 | H25 | 0.9° | 60.0° |
| N2 | C4 | C9 | H26 | 116.5° | 180.0° |
| C25 | C24 | C23 | H10 | 180.0° | 179.7° |
| C24 | C25 | C26 | H20 | 180.0° | 180.0° |
| C25 | C24 | C23 | C4 | 179.5° | 180.0° |
| C25 | C24 | C23 | C28 | 1.9° | 0.0° |
| C24 | C25 | C26 | C27 | 0.1° | 0.0° |
| C24 | C25 | C26 | H11 | 179.9° | 180.0° |
| C23 | C24 | C25 | C26 | 0.8° | 0.0° |
| C24 | C23 | C4 | C28 | 177.5° | 180.0° |
| C24 | C23 | C4 | C9 | 175.5° | 148.1° |
| C24 | C23 | C4 | C5 | 70.6° | 28.0° |
| C24 | C23 | C28 | C27 | 2.2° | 0.0° |
| C24 | C23 | C28 | H12 | 177.7° | 180.0° |
| C23 | C24 | C25 | H20 | 179.2° | 180.0° |
| C25 | C26 | C27 | H11 | 180.0° | 179.9° |
| C25 | C26 | C27 | C28 | 0.2° | 0.0° |
| C26 | C25 | C24 | H10 | 179.2° | 179.7° |
| C25 | C26 | C27 | H21 | 179.8° | 179.9° |
| C23 | C4 | C9 | C5 | 116.0° | 120.1° |
| C23 | C4 | C9 | C8 | 108.6° | 180.0° |
| C4 | C23 | C28 | C27 | 179.8° | 180.0° |
| C23 | C4 | C5 | C6 | 170.9° | 180.0° |
| C23 | C4 | C5 | H1 | 51.2° | 60.0° |
| C23 | C4 | C5 | H2 | 69.5° | 60.0° |
| C4 | C23 | C24 | H10 | 0.5° | 0.3° |
| C4 | C23 | C28 | H12 | 0.2° | 0.1° |
| C23 | C4 | C9 | H25 | 130.1° | 60.0° |
| C23 | C4 | C9 | H26 | 12.7° | 60.0° |
| C9 | C4 | C23 | C28 | 7.0° | 31.9° |
| C4 | C9 | C8 | H25 | 121.3° | 120.0° |
| C4 | C9 | C8 | H26 | 121.3° | 120.0° |
| C9 | C4 | C5 | C6 | 51.7° | 59.9° |
| C4 | C9 | C8 | C7 | 42.6° | 59.9° |
| C9 | C4 | C5 | H1 | 67.9° | 60.1° |
| C9 | C4 | C5 | H2 | 171.4° | 180.0° |
| C4 | C9 | C8 | H5 | 163.5° | 179.9° |
| C4 | C9 | C8 | H6 | 78.2° | 60.2° |
| C4 | C9 | H25 | H26 | 115.9° | 120.0° |
| C5 | C4 | C23 | C28 | 106.9° | 152.0° |
| C5 | C4 | C9 | C8 | 7.4° | 60.0° |
| C4 | C5 | C6 | H1 | 119.6° | 120.0° |
| C4 | C5 | C6 | H2 | 119.6° | 120.1° |
| C4 | C5 | C6 | C7 | 87.9° | 59.7° |
| C4 | C5 | H1 | H2 | 121.0° | 120.0° |
| C4 | C5 | C6 | H3 | 152.2° | 179.7° |
| C4 | C5 | C6 | H4 | 32.0° | 60.2° |
| C5 | C4 | C9 | H25 | 113.9° | 180.0° |
| C5 | C4 | C9 | H26 | 128.7° | 60.0° |
| C23 | C28 | C27 | C26 | 1.4° | 0.0° |
| C23 | C28 | C27 | H12 | 180.0° | 179.9° |
| C28 | C23 | C24 | H10 | 178.1° | 179.7° |
| C23 | C28 | C27 | H21 | 178.6° | 180.0° |
| C26 | C27 | C28 | H21 | 180.0° | 179.9° |
| C26 | C27 | C28 | H12 | 178.6° | 179.9° |
| C27 | C26 | C25 | H20 | 179.9° | 180.0° |
| C9 | C8 | C7 | C6 | 12.7° | 59.9° |
| C9 | C8 | C7 | H5 | 120.9° | 120.0° |
| C9 | C8 | C7 | H6 | 120.9° | 120.0° |
| C9 | C8 | C7 | C10 | 123.0° | 179.5° |
| C9 | C8 | C7 | O14 | 123.5° | 60.5° |
| C9 | C8 | H5 | H6 | 117.3° | 120.0° |
| C8 | C9 | H25 | H26 | 115.9° | 120.0° |
| C28 | C27 | C26 | H11 | 179.9° | 180.0° |
| C5 | C6 | C7 | H3 | 119.9° | 120.0° |
| C5 | C6 | C7 | H4 | 119.9° | 120.0° |
| C5 | C6 | C7 | C8 | 46.5° | 59.8° |
| C5 | C6 | C7 | C10 | 175.4° | 179.6° |
| C5 | C6 | C7 | O14 | 51.0° | 60.6° |
| C6 | C5 | H1 | H2 | 121.1° | 119.9° |
| C5 | C6 | H3 | H4 | 120.3° | 120.0° |
| C6 | C7 | C10 | N17 | 62.4° | 44.6° |
| C6 | C7 | C8 | C10 | 135.6° | 120.6° |
| C6 | C7 | C8 | O14 | 110.8° | 120.4° |
| C6 | C7 | C10 | O14 | 124.4° | 119.7° |
| C6 | C7 | C10 | C11 | 115.0° | 135.3° |
| C6 | C7 | O14 | C13 | 86.6° | 170.9° |
| C7 | C6 | C5 | H1 | 31.8° | 60.3° |
| C7 | C6 | C5 | H2 | 152.5° | 179.8° |
| C7 | C6 | H3 | H4 | 120.3° | 120.0° |
| C6 | C7 | C8 | H5 | 133.5° | 179.9° |
| C6 | C7 | C8 | H6 | 108.2° | 60.1° |
| C16 | C18 | C19 | H18 | 180.0° | 180.0° |
| C18 | C16 | N17 | C15 | 179.5° | 180.0° |
| C18 | C16 | N17 | C10 | 179.7° | 180.0° |
| C16 | C18 | C19 | C20 | 0.1° | 0.1° |
| C18 | C16 | C15 | C11 | 179.8° | 180.0° |
| C18 | C16 | C15 | C21 | 0.1° | 0.1° |
| C16 | C18 | C19 | H19 | 179.9° | 179.9° |
| C18 | C16 | N17 | H27 | 0.3° | 0.0° |
| C19 | C18 | C16 | N17 | 179.3° | 179.9° |
| C19 | C18 | C16 | C15 | 0.1° | 0.1° |
| C18 | C19 | C20 | H19 | 180.0° | 180.0° |
| C18 | C19 | C20 | C21 | 0.4° | 0.1° |
| C18 | C19 | C20 | F22 | 179.1° | 180.0° |
| C16 | N17 | C10 | H27 | 180.0° | 180.0° |
| C16 | N17 | C10 | C7 | 178.7° | 180.0° |
| C16 | N17 | C10 | C11 | 0.8° | 0.0° |
| N17 | C16 | C15 | C11 | 0.3° | 0.0° |
| N17 | C16 | C15 | C21 | 179.4° | 179.9° |
| N17 | C16 | C18 | H18 | 0.7° | 0.1° |
| N17 | C10 | C7 | C8 | 69.5° | 76.0° |
| C10 | N17 | C16 | C15 | 0.7° | 0.0° |
| N17 | C10 | C7 | C11 | 177.4° | 180.0° |
| N17 | C10 | C7 | O14 | 173.2° | 164.3° |
| N17 | C10 | C11 | C15 | 0.6° | 0.0° |
| N17 | C10 | C11 | C12 | 179.6° | 179.9° |
| C8 | C7 | C10 | O14 | 103.8° | 119.7° |
| C8 | C7 | C10 | C11 | 113.1° | 104.1° |
| C8 | C7 | O14 | C13 | 165.0° | 68.6° |
| C8 | C7 | C6 | H3 | 166.5° | 179.8° |
| C8 | C7 | C6 | H4 | 73.3° | 60.1° |
| C7 | C8 | H5 | H6 | 117.3° | 120.1° |
| C7 | C8 | C9 | H25 | 78.6° | 179.9° |
| C7 | C8 | C9 | H26 | 164.0° | 60.1° |
| C16 | C15 | C11 | C10 | 0.2° | 0.0° |
| C16 | C15 | C11 | C21 | 179.6° | 179.9° |
| C16 | C15 | C21 | C20 | 0.1° | 0.1° |
| C16 | C15 | C11 | C12 | 179.9° | 179.9° |
| C16 | C15 | C21 | H9 | 179.9° | 179.9° |
| C15 | C16 | C18 | H18 | 179.9° | 179.9° |
| C15 | C16 | N17 | H27 | 179.2° | 179.9° |
| C10 | C7 | O14 | C13 | 41.5° | 51.1° |
| C7 | C10 | C11 | C15 | 178.5° | 180.0° |
| C7 | C10 | C11 | C12 | 1.8° | 0.1° |
| C10 | C7 | C6 | H3 | 55.5° | 59.6° |
| C10 | C7 | C6 | H4 | 64.7° | 60.4° |
| C10 | C7 | C8 | H5 | 2.1° | 59.5° |
| C10 | C7 | C8 | H6 | 116.1° | 60.5° |
| C7 | C10 | N17 | H27 | 1.2° | 0.0° |
| O14 | C7 | C10 | C11 | 9.4° | 15.6° |
| C7 | O14 | C13 | C12 | 66.8° | 70.5° |
| O14 | C7 | C6 | H3 | 68.9° | 59.4° |
| O14 | C7 | C6 | H4 | 170.9° | 179.4° |
| O14 | C7 | C8 | H5 | 115.7° | 59.5° |
| O14 | C7 | C8 | H6 | 2.6° | 179.4° |
| C7 | O14 | C13 | H7 | 172.9° | 169.5° |
| C7 | O14 | C13 | H8 | 53.4° | 49.5° |
| C19 | C20 | C21 | C15 | 0.4° | 0.1° |
| C19 | C20 | C21 | F22 | 178.7° | 179.9° |
| C19 | C20 | C21 | H9 | 179.6° | 179.9° |
| C20 | C19 | C18 | H18 | 179.9° | 179.9° |
| C10 | C11 | C15 | C12 | 179.7° | 179.9° |
| C10 | C11 | C15 | C21 | 179.8° | 179.9° |
| C10 | C11 | C12 | C13 | 22.6° | 15.7° |
| C10 | C11 | C12 | H16 | 142.6° | 135.3° |
| C10 | C11 | C12 | H17 | 97.5° | 103.9° |
| C11 | C10 | N17 | H27 | 179.1° | 179.9° |
| O14 | C13 | C12 | C11 | 53.1° | 47.4° |
| O14 | C13 | C12 | H7 | 120.3° | 120.0° |
| O14 | C13 | C12 | H8 | 120.3° | 120.0° |
| O14 | C13 | H7 | H8 | 119.2° | 120.0° |
| O14 | C13 | C12 | H16 | 173.2° | 167.0° |
| O14 | C13 | C12 | H17 | 66.9° | 72.2° |
| C11 | C15 | C21 | C20 | 179.5° | 180.0° |
| C15 | C11 | C12 | C13 | 157.8° | 164.4° |
| C11 | C15 | C21 | H9 | 0.5° | 0.0° |
| C15 | C11 | C12 | H16 | 37.7° | 44.8° |
| C15 | C11 | C12 | H17 | 82.2° | 76.0° |
| C15 | C21 | C20 | H9 | 180.0° | 180.0° |
| C15 | C21 | C20 | F22 | 179.1° | 180.0° |
| C21 | C15 | C11 | C12 | 0.5° | 0.2° |
| C21 | C20 | C19 | H19 | 179.6° | 179.9° |
| F22 | C20 | C21 | H9 | 0.9° | 0.0° |
| F22 | C20 | C19 | H19 | 0.9° | 0.0° |
| C11 | C12 | C13 | H16 | 120.1° | 119.6° |
| C11 | C12 | C13 | H17 | 120.0° | 119.7° |
| C11 | C12 | C13 | H7 | 173.4° | 167.4° |
| C11 | C12 | C13 | H8 | 67.2° | 72.5° |
| C11 | C12 | H16 | H17 | 119.8° | 120.8° |
| C12 | C13 | H7 | H8 | 119.2° | 120.0° |
| C13 | C12 | H16 | H17 | 119.9° | 120.7° |
| H1 | C5 | C6 | H3 | 88.2° | 59.7° |
| H1 | C5 | C6 | H4 | 151.6° | 179.8° |
| H2 | C5 | C6 | H3 | 32.6° | 60.2° |
| H2 | C5 | C6 | H4 | 87.6° | 59.8° |
| H5 | C8 | C9 | H25 | 42.2° | 60.2° |
| H5 | C8 | C9 | H26 | 75.2° | 59.9° |
| H6 | C8 | C9 | H25 | 160.5° | 59.8° |
| H6 | C8 | C9 | H26 | 43.1° | 179.8° |
| H7 | C13 | C12 | H16 | 66.6° | 72.9° |
| H7 | C13 | C12 | H17 | 53.4° | 47.8° |
| H8 | C13 | C12 | H16 | 52.9° | 47.1° |
| H8 | C13 | C12 | H17 | 172.8° | 167.8° |
| H10 | C24 | C25 | H20 | 0.8° | 0.3° |
| H11 | C26 | C25 | H20 | 0.1° | 0.0° |
| H11 | C26 | C27 | H21 | 0.1° | 0.0° |
| H12 | C28 | C27 | H21 | 1.4° | 0.1° |
| H13 | C1 | H14 | H15 | 120.0° | 120.0° |
| H18 | C18 | C19 | H19 | 0.1° | 0.1° |
| H22 | C3 | H23 | H24 | 120.0° | 120.1° |
