A1A0S
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C | O | sing | 1.43Å | 1.44Å | |
| O | C1 | sing | 1.36Å | 1.38Å | |
| C1 | C2 | doub | 1.38Å | 1.37Å | Aromatic |
| C2 | C3 | sing | 1.40Å | 1.42Å | Aromatic |
| C3 | C4 | doub | 1.41Å | 1.41Å | Aromatic |
| C4 | C5 | sing | 1.36Å | 1.37Å | Aromatic |
| C5 | C6 | doub | 1.41Å | 1.39Å | Aromatic |
| C6 | C7 | sing | 1.47Å | 1.48Å | |
| C8 | C7 | sing | 1.51Å | 1.50Å | |
| C8 | C9 | sing | 1.53Å | 1.52Å | |
| C9 | N | sing | 1.47Å | 1.51Å | |
| C10 | N | sing | 1.47Å | 1.52Å | |
| C10 | C11 | sing | 1.54Å | 1.53Å | |
| C11 | C12 | sing | 1.54Å | 1.52Å | |
| C12 | C13 | sing | 1.54Å | 1.52Å | |
| C13 | C14 | sing | 1.55Å | 1.51Å | |
| C14 | C10 | sing | 1.55Å | 1.53Å | |
| N | C15 | sing | 1.47Å | 1.50Å | |
| C15 | C16 | sing | 1.53Å | 1.51Å | |
| C16 | C17 | sing | 1.53Å | 1.52Å | |
| C17 | C8 | sing | 1.53Å | 1.53Å | |
| C7 | N1 | doub | 1.29Å | 1.32Å | |
| N1 | O1 | sing | 1.42Å | 1.41Å | |
| O1 | C18 | sing | 1.43Å | 1.44Å | |
| C19 | C6 | sing | 1.39Å | 1.37Å | Aromatic |
| C20 | C19 | doub | 1.40Å | 1.42Å | Aromatic |
| C3 | C20 | sing | 1.42Å | 1.41Å | Aromatic |
| C21 | C20 | sing | 1.41Å | 1.41Å | Aromatic |
| C22 | C21 | doub | 1.36Å | 1.36Å | Aromatic |
| C1 | C22 | sing | 1.40Å | 1.39Å | Aromatic |
| C | H2 | sing | 1.09Å | 1.10Å | |
| C | H1 | sing | 1.09Å | 1.10Å | |
| C | H3 | sing | 1.09Å | 1.10Å | |
| C10 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H12 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C12 | H14 | sing | 1.09Å | 1.10Å | |
| C13 | H16 | sing | 1.09Å | 1.10Å | |
| C13 | H15 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C14 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C15 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C17 | H24 | sing | 1.09Å | 1.10Å | |
| C17 | H23 | sing | 1.09Å | 1.10Å | |
| C18 | H27 | sing | 1.09Å | 1.10Å | |
| C18 | H26 | sing | 1.09Å | 1.10Å | |
| C18 | H25 | sing | 1.09Å | 1.10Å | |
| C19 | H28 | sing | 1.08Å | 1.08Å | |
| C2 | H4 | sing | 1.08Å | 1.08Å | |
| C21 | H29 | sing | 1.08Å | 1.08Å | |
| C22 | H30 | sing | 1.08Å | 1.08Å | |
| C4 | H5 | sing | 1.08Å | 1.08Å | |
| C5 | H6 | sing | 1.08Å | 1.08Å | |
| C8 | H7 | sing | 1.09Å | 1.10Å | |
| C9 | H9 | sing | 1.09Å | 1.10Å | |
| C9 | H8 | sing | 1.09Å | 1.10Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C | O | C1 | 117.2° | 117.0° |
| O | C | H2 | 109.5° | 109.4° |
| O | C | H1 | 109.4° | 109.5° |
| O | C | H3 | 109.5° | 109.5° |
| O | C1 | C2 | 124.0° | 119.6° |
| O | C1 | C22 | 115.2° | 119.6° |
| C1 | C2 | C3 | 120.2° | 119.6° |
| C2 | C1 | C22 | 120.8° | 120.7° |
| C1 | C2 | H4 | 119.9° | 120.2° |
| C2 | C3 | C4 | 122.6° | 120.9° |
| C2 | C3 | C20 | 118.9° | 119.4° |
| C3 | C2 | H4 | 119.9° | 120.2° |
| C3 | C4 | C5 | 121.3° | 120.0° |
| C4 | C3 | C20 | 118.5° | 119.7° |
| C3 | C4 | H5 | 119.4° | 120.0° |
| C4 | C5 | C6 | 120.6° | 120.9° |
| C5 | C4 | H5 | 119.4° | 120.0° |
| C4 | C5 | H6 | 119.7° | 119.6° |
| C5 | C6 | C7 | 120.3° | 119.8° |
| C5 | C6 | C19 | 119.9° | 120.5° |
| C6 | C5 | H6 | 119.7° | 119.6° |
| C6 | C7 | C8 | 119.8° | 120.0° |
| C6 | C7 | N1 | 113.5° | 120.0° |
| C7 | C6 | C19 | 119.8° | 119.8° |
| C7 | C8 | C9 | 113.7° | 109.5° |
| C7 | C8 | C17 | 110.8° | 109.5° |
| C8 | C7 | N1 | 126.6° | 120.0° |
| C7 | C8 | H7 | 107.4° | 109.5° |
| C8 | C9 | N | 112.2° | 109.5° |
| C9 | C8 | C17 | 110.2° | 109.3° |
| C9 | C8 | H7 | 107.3° | 109.5° |
| C8 | C9 | H9 | 108.8° | 109.4° |
| C8 | C9 | H8 | 108.8° | 109.5° |
| C9 | N | C10 | 111.8° | 111.0° |
| C9 | N | C15 | 109.3° | 111.2° |
| N | C9 | H9 | 108.8° | 109.5° |
| N | C9 | H8 | 108.8° | 109.5° |
| N | C10 | C11 | 113.2° | 110.4° |
| N | C10 | C14 | 113.5° | 110.5° |
| C10 | N | C15 | 111.5° | 111.0° |
| N | C10 | H10 | 108.6° | 110.4° |
| C10 | C11 | C12 | 105.2° | 106.6° |
| C11 | C10 | C14 | 104.3° | 104.2° |
| C11 | C10 | H10 | 108.5° | 110.5° |
| C10 | C11 | H12 | 110.5° | 110.1° |
| C10 | C11 | H11 | 110.5° | 110.0° |
| C11 | C12 | C13 | 107.5° | 106.6° |
| C12 | C11 | H12 | 110.5° | 110.1° |
| C12 | C11 | H11 | 110.5° | 110.0° |
| C11 | C12 | H13 | 110.0° | 110.0° |
| C11 | C12 | H14 | 110.0° | 110.1° |
| C12 | C13 | C14 | 106.3° | 104.2° |
| C13 | C12 | H13 | 109.9° | 110.0° |
| C13 | C12 | H14 | 110.0° | 110.0° |
| C12 | C13 | H16 | 110.3° | 110.5° |
| C12 | C13 | H15 | 110.3° | 110.5° |
| C13 | C14 | C10 | 104.1° | 102.8° |
| C14 | C13 | H16 | 110.3° | 110.4° |
| C14 | C13 | H15 | 110.3° | 110.5° |
| C13 | C14 | H17 | 110.8° | 110.7° |
| C13 | C14 | H18 | 110.8° | 110.8° |
| C14 | C10 | H10 | 108.5° | 110.7° |
| C10 | C14 | H17 | 110.8° | 110.7° |
| C10 | C14 | H18 | 110.8° | 110.8° |
| N | C15 | C16 | 111.1° | 109.5° |
| N | C15 | H19 | 109.1° | 109.4° |
| N | C15 | H20 | 109.0° | 109.5° |
| C15 | C16 | C17 | 111.0° | 109.3° |
| C16 | C15 | H19 | 109.1° | 109.5° |
| C16 | C15 | H20 | 109.1° | 109.5° |
| C15 | C16 | H21 | 109.1° | 109.5° |
| C15 | C16 | H22 | 109.1° | 109.5° |
| C16 | C17 | C8 | 110.5° | 109.1° |
| C17 | C16 | H21 | 109.1° | 109.5° |
| C17 | C16 | H22 | 109.1° | 109.5° |
| C16 | C17 | H24 | 109.2° | 109.6° |
| C16 | C17 | H23 | 109.2° | 109.6° |
| C8 | C17 | H24 | 109.2° | 109.5° |
| C8 | C17 | H23 | 109.2° | 109.5° |
| C17 | C8 | H7 | 107.1° | 109.5° |
| C7 | N1 | O1 | 112.3° | 120.0° |
| N1 | O1 | C18 | 109.2° | 114.0° |
| O1 | C18 | H27 | 109.5° | 109.5° |
| O1 | C18 | H26 | 109.5° | 109.5° |
| O1 | C18 | H25 | 109.4° | 109.5° |
| C6 | C19 | C20 | 120.9° | 119.5° |
| C6 | C19 | H28 | 119.6° | 120.2° |
| C19 | C20 | C3 | 119.0° | 119.5° |
| C19 | C20 | C21 | 122.2° | 120.9° |
| C20 | C19 | H28 | 119.6° | 120.3° |
| C3 | C20 | C21 | 118.9° | 119.5° |
| C20 | C21 | C22 | 120.8° | 119.9° |
| C20 | C21 | H29 | 119.6° | 120.1° |
| C21 | C22 | C1 | 120.4° | 120.9° |
| C22 | C21 | H29 | 119.6° | 120.0° |
| C21 | C22 | H30 | 119.8° | 119.5° |
| C1 | C22 | H30 | 119.8° | 119.5° |
| H2 | C | H1 | 109.4° | 109.5° |
| H2 | C | H3 | 109.5° | 109.4° |
| H1 | C | H3 | 109.5° | 109.5° |
| H12 | C11 | H11 | 109.5° | 110.1° |
| H13 | C12 | H14 | 109.5° | 110.0° |
| H16 | C13 | H15 | 109.5° | 110.6° |
| H17 | C14 | H18 | 109.5° | 110.8° |
| H19 | C15 | H20 | 109.5° | 109.4° |
| H21 | C16 | H22 | 109.5° | 109.5° |
| H24 | C17 | H23 | 109.5° | 109.6° |
| H27 | C18 | H26 | 109.5° | 109.4° |
| H27 | C18 | H25 | 109.5° | 109.5° |
| H26 | C18 | H25 | 109.5° | 109.5° |
| H9 | C9 | H8 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C | O | C1 | C2 | 7.2° | 180.0° |
| C | O | C1 | C22 | 172.2° | 0.2° |
| O | C | H2 | H1 | 120.0° | 120.0° |
| O | C | H2 | H3 | 120.0° | 120.0° |
| O | C | H1 | H3 | 120.0° | 120.0° |
| O | C1 | C2 | C22 | 179.4° | 179.8° |
| O | C1 | C2 | C3 | 179.1° | 180.0° |
| O | C1 | C22 | C21 | 179.3° | 180.0° |
| C1 | O | C | H2 | 180.0° | 60.1° |
| C1 | O | C | H1 | 60.0° | 60.0° |
| C1 | O | C | H3 | 60.0° | 180.0° |
| O | C1 | C2 | H4 | 0.9° | 0.1° |
| O | C1 | C22 | H30 | 0.7° | 0.1° |
| C1 | C2 | C3 | H4 | 180.0° | 180.0° |
| C1 | C2 | C3 | C4 | 179.2° | 179.9° |
| C1 | C2 | C3 | C20 | 0.3° | 0.0° |
| C2 | C1 | C22 | C21 | 0.2° | 0.2° |
| C2 | C1 | C22 | H30 | 179.8° | 179.7° |
| C2 | C3 | C4 | C20 | 179.5° | 179.9° |
| C2 | C3 | C4 | C5 | 179.6° | 180.0° |
| C2 | C3 | C20 | C19 | 179.9° | 180.0° |
| C2 | C3 | C20 | C21 | 0.1° | 0.2° |
| C3 | C2 | C1 | C22 | 0.3° | 0.2° |
| C2 | C3 | C4 | H5 | 0.4° | 0.1° |
| C3 | C4 | C5 | H5 | 180.0° | 179.9° |
| C3 | C4 | C5 | C6 | 0.5° | 0.0° |
| C4 | C3 | C20 | C19 | 0.4° | 0.1° |
| C4 | C3 | C20 | C21 | 179.4° | 179.7° |
| C4 | C3 | C2 | H4 | 0.8° | 0.0° |
| C3 | C4 | C5 | H6 | 179.5° | 179.9° |
| C4 | C5 | C6 | H6 | 180.0° | 180.0° |
| C4 | C5 | C6 | C7 | 176.7° | 179.9° |
| C4 | C5 | C6 | C19 | 0.9° | 0.0° |
| C5 | C4 | C3 | C20 | 0.1° | 0.1° |
| C5 | C6 | C7 | C19 | 177.5° | 179.9° |
| C5 | C6 | C7 | C8 | 148.7° | 5.4° |
| C5 | C6 | C7 | N1 | 34.2° | 174.6° |
| C5 | C6 | C19 | C20 | 0.6° | 0.0° |
| C5 | C6 | C19 | H28 | 179.4° | 180.0° |
| C6 | C5 | C4 | H5 | 179.5° | 180.0° |
| C6 | C7 | C8 | N1 | 176.8° | 180.0° |
| C6 | C7 | C8 | C9 | 133.0° | 64.4° |
| C6 | C7 | C8 | C17 | 102.2° | 55.5° |
| C6 | C7 | N1 | O1 | 174.1° | 175.0° |
| C7 | C6 | C19 | C20 | 177.0° | 179.9° |
| C7 | C6 | C19 | H28 | 3.0° | 0.1° |
| C7 | C6 | C5 | H6 | 3.3° | 0.1° |
| C6 | C7 | C8 | H7 | 14.5° | 175.6° |
| C7 | C8 | C9 | C17 | 125.1° | 120.0° |
| C7 | C8 | C9 | H7 | 118.6° | 120.1° |
| C7 | C8 | C9 | N | 178.8° | 179.1° |
| C7 | C8 | C17 | C16 | 179.1° | 177.6° |
| C7 | C8 | C17 | H7 | 116.9° | 120.1° |
| C8 | C7 | N1 | O1 | 2.8° | 5.0° |
| C8 | C7 | C6 | C19 | 33.8° | 174.5° |
| C7 | C8 | C17 | H24 | 58.9° | 62.5° |
| C7 | C8 | C17 | H23 | 60.8° | 57.6° |
| C7 | C8 | C9 | H9 | 58.4° | 59.1° |
| C7 | C8 | C9 | H8 | 60.8° | 60.8° |
| C8 | C9 | N | H9 | 120.4° | 119.9° |
| C8 | C9 | N | H8 | 120.4° | 120.1° |
| C8 | C9 | N | C10 | 178.3° | 174.2° |
| C8 | C9 | N | C15 | 57.8° | 61.7° |
| C9 | C8 | C17 | C16 | 54.2° | 57.6° |
| C9 | C8 | C17 | H7 | 116.4° | 119.9° |
| C9 | C8 | C7 | N1 | 50.2° | 115.6° |
| C9 | C8 | C17 | H24 | 174.4° | 177.5° |
| C9 | C8 | C17 | H23 | 65.9° | 62.3° |
| C8 | C9 | H9 | H8 | 118.8° | 120.0° |
| C9 | N | C10 | C15 | 122.7° | 124.2° |
| C9 | N | C10 | C11 | 64.3° | 60.8° |
| C9 | N | C10 | C14 | 177.1° | 175.5° |
| C9 | N | C15 | C16 | 58.4° | 61.8° |
| N | C9 | C8 | C17 | 56.1° | 59.1° |
| C9 | N | C10 | H10 | 56.3° | 61.7° |
| C9 | N | C15 | H19 | 178.7° | 178.2° |
| C9 | N | C15 | H20 | 61.8° | 58.3° |
| N | C9 | C8 | H7 | 60.2° | 60.8° |
| N | C9 | H9 | H8 | 118.8° | 120.0° |
| N | C10 | C11 | C14 | 123.8° | 118.6° |
| N | C10 | C11 | H10 | 120.6° | 122.5° |
| N | C10 | C11 | C12 | 152.4° | 142.3° |
| N | C10 | C14 | C13 | 159.6° | 156.6° |
| N | C10 | C14 | H10 | 120.9° | 122.6° |
| C10 | N | C15 | C16 | 177.5° | 174.2° |
| N | C10 | C11 | H12 | 33.0° | 23.0° |
| N | C10 | C11 | H11 | 88.3° | 98.5° |
| N | C10 | C14 | H17 | 40.5° | 85.1° |
| N | C10 | C14 | H18 | 81.2° | 38.3° |
| C10 | N | C15 | H19 | 57.2° | 54.2° |
| C10 | N | C15 | H20 | 62.3° | 65.8° |
| C10 | N | C9 | H9 | 57.9° | 65.8° |
| C10 | N | C9 | H8 | 61.3° | 54.2° |
| C10 | C11 | C12 | H12 | 119.3° | 119.3° |
| C10 | C11 | C12 | H11 | 119.3° | 119.2° |
| C10 | C11 | C12 | C13 | 10.5° | 0.0° |
| C11 | C10 | C14 | C13 | 36.0° | 38.0° |
| C11 | C10 | C14 | H10 | 115.5° | 118.8° |
| C11 | C10 | N | C15 | 173.0° | 175.0° |
| C10 | C11 | H12 | H11 | 122.0° | 121.4° |
| C10 | C11 | C12 | H13 | 130.1° | 119.3° |
| C10 | C11 | C12 | H14 | 109.2° | 119.3° |
| C11 | C10 | C14 | H17 | 83.1° | 156.3° |
| C11 | C10 | C14 | H18 | 155.1° | 80.3° |
| C11 | C12 | C13 | H13 | 119.7° | 119.2° |
| C11 | C12 | C13 | H14 | 119.7° | 119.4° |
| C11 | C12 | C13 | C14 | 11.9° | 23.6° |
| C12 | C11 | C10 | C14 | 28.5° | 23.7° |
| C12 | C11 | C10 | H10 | 87.0° | 95.2° |
| C12 | C11 | H12 | H11 | 121.9° | 121.4° |
| C11 | C12 | H13 | H14 | 120.9° | 121.5° |
| C11 | C12 | C13 | H16 | 131.4° | 142.2° |
| C11 | C12 | C13 | H15 | 107.6° | 95.1° |
| C12 | C13 | C14 | H16 | 119.5° | 118.7° |
| C12 | C13 | C14 | H15 | 119.5° | 118.7° |
| C12 | C13 | C14 | C10 | 29.6° | 38.0° |
| C13 | C12 | C11 | H12 | 108.9° | 119.3° |
| C13 | C12 | C11 | H11 | 129.8° | 119.3° |
| C13 | C12 | H13 | H14 | 120.9° | 121.4° |
| C12 | C13 | H16 | H15 | 121.5° | 122.6° |
| C12 | C13 | C14 | H17 | 89.5° | 156.3° |
| C12 | C13 | C14 | H18 | 148.8° | 80.4° |
| C13 | C14 | C10 | H17 | 119.1° | 118.3° |
| C13 | C14 | C10 | H18 | 119.1° | 118.3° |
| C13 | C14 | C10 | H10 | 79.5° | 80.8° |
| C14 | C13 | C12 | H13 | 107.7° | 95.6° |
| C14 | C13 | C12 | H14 | 131.6° | 143.0° |
| C14 | C13 | H16 | H15 | 121.5° | 122.6° |
| C13 | C14 | H17 | H18 | 122.5° | 123.3° |
| C14 | C10 | N | C15 | 54.4° | 60.3° |
| C14 | C10 | C11 | H12 | 90.8° | 95.7° |
| C14 | C10 | C11 | H11 | 147.9° | 142.9° |
| C10 | C14 | C13 | H16 | 149.1° | 156.6° |
| C10 | C14 | C13 | H15 | 89.9° | 80.7° |
| C10 | C14 | H17 | H18 | 122.5° | 123.4° |
| N | C15 | C16 | H19 | 120.3° | 120.0° |
| N | C15 | C16 | H20 | 120.2° | 120.1° |
| N | C15 | C16 | C17 | 58.5° | 59.2° |
| C15 | N | C10 | H10 | 66.4° | 62.5° |
| N | C15 | H19 | H20 | 119.2° | 120.0° |
| N | C15 | C16 | H21 | 61.7° | 60.7° |
| N | C15 | C16 | H22 | 178.7° | 179.1° |
| C15 | N | C9 | H9 | 178.2° | 58.2° |
| C15 | N | C9 | H8 | 62.6° | 178.2° |
| C15 | C16 | C17 | H21 | 120.2° | 119.9° |
| C15 | C16 | C17 | H22 | 120.2° | 120.0° |
| C15 | C16 | C17 | C8 | 55.9° | 57.7° |
| C16 | C15 | H19 | H20 | 119.3° | 120.0° |
| C15 | C16 | H21 | H22 | 119.3° | 120.1° |
| C15 | C16 | C17 | H24 | 176.0° | 177.5° |
| C15 | C16 | C17 | H23 | 64.3° | 62.3° |
| C16 | C17 | C8 | H24 | 120.1° | 119.9° |
| C16 | C17 | C8 | H23 | 120.2° | 119.9° |
| C17 | C16 | C15 | H19 | 178.7° | 179.2° |
| C17 | C16 | C15 | H20 | 61.7° | 60.9° |
| C17 | C16 | H21 | H22 | 119.3° | 120.1° |
| C16 | C17 | H24 | H23 | 119.5° | 120.2° |
| C16 | C17 | C8 | H7 | 62.1° | 62.3° |
| C17 | C8 | C7 | N1 | 74.6° | 124.5° |
| C8 | C17 | C16 | H21 | 64.3° | 62.3° |
| C8 | C17 | C16 | H22 | 176.1° | 177.6° |
| C8 | C17 | H24 | H23 | 119.5° | 120.1° |
| C17 | C8 | C9 | H9 | 176.5° | 60.9° |
| C17 | C8 | C9 | H8 | 64.3° | 179.2° |
| C7 | N1 | O1 | C18 | 179.8° | 180.0° |
| N1 | C7 | C6 | C19 | 143.4° | 5.5° |
| N1 | C7 | C8 | H7 | 168.7° | 4.4° |
| N1 | O1 | C18 | H27 | 180.0° | 60.0° |
| N1 | O1 | C18 | H26 | 60.0° | 60.0° |
| N1 | O1 | C18 | H25 | 60.0° | 180.0° |
| O1 | C18 | H27 | H26 | 120.0° | 120.0° |
| O1 | C18 | H27 | H25 | 120.0° | 120.0° |
| O1 | C18 | H26 | H25 | 120.0° | 120.0° |
| C6 | C19 | C20 | H28 | 180.0° | 180.0° |
| C6 | C19 | C20 | C3 | 0.1° | 0.0° |
| C6 | C19 | C20 | C21 | 179.7° | 179.7° |
| C19 | C6 | C5 | H6 | 179.2° | 180.0° |
| C19 | C20 | C3 | C21 | 179.8° | 179.8° |
| C19 | C20 | C21 | C22 | 179.7° | 180.0° |
| C19 | C20 | C21 | H29 | 0.3° | 0.0° |
| C3 | C20 | C21 | C22 | 0.1° | 0.2° |
| C3 | C20 | C19 | H28 | 179.9° | 179.9° |
| C20 | C3 | C2 | H4 | 179.7° | 179.9° |
| C3 | C20 | C21 | H29 | 179.9° | 179.8° |
| C20 | C3 | C4 | H5 | 179.9° | 180.0° |
| C20 | C21 | C22 | H29 | 180.0° | 180.0° |
| C20 | C21 | C22 | C1 | 0.0° | 0.0° |
| C21 | C20 | C19 | H28 | 0.3° | 0.3° |
| C20 | C21 | C22 | H30 | 180.0° | 179.9° |
| C21 | C22 | C1 | H30 | 180.0° | 179.9° |
| C22 | C1 | C2 | H4 | 179.7° | 179.7° |
| C1 | C22 | C21 | H29 | 180.0° | 180.0° |
| H2 | C | H1 | H3 | 120.0° | 120.0° |
| H10 | C10 | C11 | H12 | 153.7° | 145.5° |
| H10 | C10 | C11 | H11 | 32.3° | 24.0° |
| H10 | C10 | C14 | H17 | 161.4° | 37.5° |
| H10 | C10 | C14 | H18 | 39.7° | 160.9° |
| H12 | C11 | C12 | H13 | 10.8° | 0.1° |
| H12 | C11 | C12 | H14 | 131.4° | 121.4° |
| H11 | C11 | C12 | H13 | 110.5° | 121.5° |
| H11 | C11 | C12 | H14 | 10.1° | 0.1° |
| H13 | C12 | C13 | H16 | 11.7° | 23.0° |
| H13 | C12 | C13 | H15 | 132.8° | 145.7° |
| H14 | C12 | C13 | H16 | 108.9° | 98.4° |
| H14 | C12 | C13 | H15 | 12.1° | 24.3° |
| H16 | C13 | C14 | H17 | 29.9° | 85.1° |
| H16 | C13 | C14 | H18 | 91.8° | 38.3° |
| H15 | C13 | C14 | H17 | 150.9° | 37.6° |
| H15 | C13 | C14 | H18 | 29.2° | 160.9° |
| H19 | C15 | C16 | H21 | 58.5° | 59.2° |
| H19 | C15 | C16 | H22 | 61.1° | 60.9° |
| H20 | C15 | C16 | H21 | 178.1° | 179.2° |
| H20 | C15 | C16 | H22 | 58.5° | 59.1° |
| H21 | C16 | C17 | H24 | 55.8° | 57.6° |
| H21 | C16 | C17 | H23 | 175.5° | 177.8° |
| H22 | C16 | C17 | H24 | 63.8° | 62.5° |
| H22 | C16 | C17 | H23 | 55.9° | 57.7° |
| H24 | C17 | C8 | H7 | 58.0° | 57.6° |
| H23 | C17 | C8 | H7 | 177.7° | 177.7° |
| H27 | C18 | H26 | H25 | 120.0° | 120.0° |
| H29 | C21 | C22 | H30 | 0.0° | 0.1° |
| H5 | C4 | C5 | H6 | 0.5° | 0.0° |
| H7 | C8 | C9 | H9 | 60.2° | 179.2° |
| H7 | C8 | C9 | H8 | 179.5° | 59.2° |
